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37242 37243 37244 37245 37246 37247 37248 37249 37250 37251 37252 37253 37254 37255 37256 37257 37258 37259 37260 37261 37262 37263 37264 37265 37266 37267 37268 37269 37270 37271 37272 37273 37274 37275 37276 37277 37278 37279 37280 37281 37282 37283 37284 37285 37286 37287 37288 37289 37290 37291 37292 37293 37294 37295 37296 37297 37298 37299 37300 37301 37302 37303 37304 37305 37306 37307 37308 37309 37310 37311 37312 37313 37314 37315 37316 37317 37318 37319 37320 37321 37322 37323 37324 37325 37326 37327 37328 37329 37330 37331 37332 37333 37334 37335 37336 37337 37338 37339 37340 37341 37342 37343 37344 37345 37346 37347 37348 37349 37350 37351 37352 37353 37354 37355 37356 37357 37358 37359 37360 37361 37362 37363 37364 37365 37366 37367 37368 37369 37370 37371 37372 37373 37374 37375 37376 37377 37378 37379 37380 37381 37382 37383 37384 37385 37386 37387 37388 37389 37390 37391 37392 37393 37394 37395 37396 37397 37398 37399 37400 37401 37402 37403 37404 37405 37406 37407 37408 37409 37410 37411 37412 37413 37414 37415 37416 37417 37418 37419 37420 37421 37422 37423 37424 37425 37426 37427 37428 37429 37430 37431 37432 37433 37434 37435 37436 37437 37438 37439 37440 37441 37442 37443 37444 37445 37446 37447 37448 37449 37450 37451 37452 37453 37454 37455 37456 37457 37458 37459 37460 37461 37462 37463 37464 37465 37466 37467 37468 37469 37470 37471 37472 37473 37474 37475 37476 37477 37478 37479 37480 37481 37482 37483 37484 37485 37486 37487 37488 37489 37490 37491 37492 37493 37494 37495 37496 37497 37498 37499 37500 37501 37502 37503 37504 37505 37506 37507 37508 37509 37510 37511 37512 37513 37514 37515 37516 37517 37518 37519 37520 37521 37522 37523 37524 37525 37526 37527 37528 37529 37530 37531 37532 37533 37534 37535 37536 37537 37538 37539 37540 37541 37542 37543 37544 37545 37546 37547 37548 37549 37550 37551 37552 37553 37554 37555 37556 37557 37558 37559 37560 37561 37562 37563 37564 37565 37566 37567 37568 37569 37570 37571 37572 37573 37574 37575 37576 37577 37578 37579 37580 37581 37582 37583 37584 37585 37586 37587 37588 37589 37590 37591 37592 37593 37594 37595 37596 37597 37598 37599 37600 37601 37602 37603 37604 37605 37606 37607 37608 37609 37610 37611 37612 37613 37614 37615 37616 37617 37618 37619 37620 37621 37622 37623 37624 37625 37626 37627 37628 37629 37630 37631 37632 37633 37634 37635 37636 37637 37638 37639 37640 37641 37642 37643 37644 37645 37646 37647 37648 37649 37650 37651 37652 37653 37654 37655 37656 37657 37658 37659 37660 37661 37662 37663 37664 37665 37666 37667 37668 37669 37670 37671 37672 37673 37674 37675 37676 37677 37678 37679 37680 37681 37682 37683 37684 37685 37686 37687 37688 37689 37690 37691 37692 37693 37694 37695 37696 37697 37698 37699 37700 37701 37702 37703 37704 37705 37706 37707 37708 37709 37710 37711 37712 37713 37714 37715 37716 37717 37718 37719 37720 37721 37722 37723 37724 37725 37726 37727 37728 37729 37730 37731 37732 37733 37734 37735 37736 37737 37738 37739 37740 37741 37742 37743 37744 37745 37746 37747 37748 37749 37750 37751 37752 37753 37754 37755 37756 37757 37758 37759 37760 37761 37762 37763 37764 37765 37766 37767 37768 37769 37770 37771 37772 37773 37774 37775 37776 37777 37778 37779 37780 37781 37782 37783 37784 37785 37786 37787 37788 37789 37790 37791 37792 37793 37794 37795 37796 37797 37798 37799 37800 37801 37802 37803 37804 37805 37806 37807 37808 37809 37810 37811 37812 37813 37814 37815 37816 37817 37818 37819 37820 37821 37822 37823 37824 37825 37826 37827 37828 37829 37830 37831 37832 37833 37834 37835 37836 37837 37838 37839 37840 37841 37842 37843 37844 37845 37846 37847 37848 37849 37850 37851 37852 37853 37854 37855 37856 37857 37858 37859 37860 37861 37862 37863 37864 37865 37866 37867 37868 37869 37870 37871 37872 37873 37874 37875 37876 37877 37878 37879 37880 37881 37882 37883 37884 37885 37886 37887 37888 37889 37890 37891 37892 37893 37894 37895 37896 37897 37898 37899 37900 37901 37902 37903 37904 37905 37906 37907 37908 37909 37910 37911 37912 37913 37914 37915 37916 37917 37918 37919 37920 37921 37922 37923 37924 37925 37926 37927 37928 37929 37930 37931 37932 37933 37934 37935 37936 37937 37938 37939 37940 37941 37942 37943 37944 37945 37946 37947 37948 37949 37950 37951 37952 37953 37954 37955 37956 37957 37958 37959 37960 37961 37962 37963 37964 37965 37966 37967 37968 37969 37970 37971 37972 37973 37974 37975 37976 37977 37978 37979 37980 37981 37982 37983 37984 37985 37986 37987 37988 37989 37990 37991 37992 37993 37994 37995 37996 37997 37998 37999 38000 38001 38002 38003 38004 38005 38006 38007 38008 38009 38010 38011 38012 38013 38014 38015 38016 38017 38018 38019 38020 38021 38022 38023 38024 38025 38026 38027 38028 38029 38030 38031 38032 38033 38034 38035 38036 38037 38038 38039 38040 38041 38042 38043 38044 38045 38046 38047 38048 38049 38050 38051 38052 38053 38054 38055 38056 38057 38058 38059 38060 38061 38062 38063 38064 38065 38066 38067 38068 38069 38070 38071 38072 38073 38074 38075 38076 38077 38078 38079 38080 38081 38082 38083 38084 38085 38086 38087 38088 38089 38090 38091 38092 38093 38094 38095 38096 38097 38098 38099 38100 38101 38102 38103 38104 38105 38106 38107 38108 38109 38110 38111 38112 38113 38114 38115 38116 38117 38118 38119 38120 38121 38122 38123 38124 38125 38126 38127 38128 38129 38130 38131 38132 38133 38134 38135 38136 38137 38138 38139 38140 38141 38142 38143 38144 38145 38146 38147 38148 38149 38150 38151 38152 38153 38154 38155 38156 38157 38158 38159 38160 38161 38162 38163 38164 38165 38166 38167 38168 38169 38170 38171 38172 38173 38174 38175 38176 38177 38178 38179 38180 38181 38182 38183 38184 38185 38186 38187 38188 38189 38190 38191 38192 38193 38194 38195 38196 38197 38198 38199 38200 38201 38202 38203 38204 38205 38206 38207 38208 38209 38210 38211 38212 38213 38214 38215 38216 38217 38218 38219 38220 38221 38222 38223 38224 38225 38226 38227 38228 38229 38230 38231 38232 38233 38234 38235 38236 38237 38238 38239 38240 38241 38242 38243 38244 38245 38246 38247 38248 38249 38250 38251 38252 38253 38254 38255 38256 38257 38258 38259 38260 38261 38262 38263 38264 38265 38266 38267 38268 38269 38270 38271 38272 38273 38274 38275 38276 38277 38278 38279 38280 38281 38282 38283 38284 38285 38286 38287 38288 38289
|
***********************************************************
***********************************************************
This calculation was performed by OpenMX Ver. 3.7.33
using 264 MPI processes and 2 OpenMP threads.
Fri Mar 25 04:38:38 2016
***********************************************************
***********************************************************
#
# Rutile TiO2 including 1050 atoms
#
System.CurrrentDirectory ./ # default=./
System.Name R-TiO2-1050
level.of.stdout 1 # default=1 (1-3)
level.of.fileout 0 # default=1 (1-3)
#
# Definition of Atomic Species
#
Species.Number 2
<Definition.of.Atomic.Species
Ti Ti7.0-s3p2d2 Ti_PBE13
O O5.0-s2p2d1 O_PBE13
Definition.of.Atomic.Species>
#
# Atoms
#
Atoms.Number 1050
Atoms.SpeciesAndCoordinates.Unit Ang # Ang|AU
<Atoms.SpeciesAndCoordinates # Unit=Ang.
1 Ti 0.000000000000 0.000000000000 0.000000000000 6.0 6.0
2 Ti 2.297050000000 2.297050000000 1.479450000000 6.0 6.0
3 O 1.424171000000 1.424171000000 0.000000000000 3.0 3.0
4 O 3.169929000000 3.169929000000 0.000000000000 3.0 3.0
5 O 3.721221000000 0.872879000000 1.479450000000 3.0 3.0
6 O 0.872879000000 3.721221000000 1.479450000000 3.0 3.0
7 Ti 0.000000000000 0.000000000000 2.958900000000 6.0 6.0
8 Ti 2.297050000000 2.297050000000 4.438350000000 6.0 6.0
9 O 1.424171000000 1.424171000000 2.958900000000 3.0 3.0
10 O 3.169929000000 3.169929000000 2.958900000000 3.0 3.0
11 O 3.721221000000 0.872879000000 4.438350000000 3.0 3.0
12 O 0.872879000000 3.721221000000 4.438350000000 3.0 3.0
13 Ti 0.000000000000 0.000000000000 5.917800000000 6.0 6.0
14 Ti 2.297050000000 2.297050000000 7.397250000000 6.0 6.0
15 O 1.424171000000 1.424171000000 5.917800000000 3.0 3.0
16 O 3.169929000000 3.169929000000 5.917800000000 3.0 3.0
17 O 3.721221000000 0.872879000000 7.397250000000 3.0 3.0
18 O 0.872879000000 3.721221000000 7.397250000000 3.0 3.0
19 Ti 0.000000000000 0.000000000000 8.876700000000 6.0 6.0
20 Ti 2.297050000000 2.297050000000 10.356150000000 6.0 6.0
21 O 1.424171000000 1.424171000000 8.876700000000 3.0 3.0
22 O 3.169929000000 3.169929000000 8.876700000000 3.0 3.0
23 O 3.721221000000 0.872879000000 10.356150000000 3.0 3.0
24 O 0.872879000000 3.721221000000 10.356150000000 3.0 3.0
25 Ti 0.000000000000 0.000000000000 11.835600000000 6.0 6.0
26 Ti 2.297050000000 2.297050000000 13.315050000000 6.0 6.0
27 O 1.424171000000 1.424171000000 11.835600000000 3.0 3.0
28 O 3.169929000000 3.169929000000 11.835600000000 3.0 3.0
29 O 3.721221000000 0.872879000000 13.315050000000 3.0 3.0
30 O 0.872879000000 3.721221000000 13.315050000000 3.0 3.0
31 Ti 0.000000000000 0.000000000000 14.794500000000 6.0 6.0
32 Ti 2.297050000000 2.297050000000 16.273950000000 6.0 6.0
33 O 1.424171000000 1.424171000000 14.794500000000 3.0 3.0
34 O 3.169929000000 3.169929000000 14.794500000000 3.0 3.0
35 O 3.721221000000 0.872879000000 16.273950000000 3.0 3.0
36 O 0.872879000000 3.721221000000 16.273950000000 3.0 3.0
37 Ti 0.000000000000 0.000000000000 17.753400000000 6.0 6.0
38 Ti 2.297050000000 2.297050000000 19.232850000000 6.0 6.0
39 O 1.424171000000 1.424171000000 17.753400000000 3.0 3.0
40 O 3.169929000000 3.169929000000 17.753400000000 3.0 3.0
41 O 3.721221000000 0.872879000000 19.232850000000 3.0 3.0
42 O 0.872879000000 3.721221000000 19.232850000000 3.0 3.0
43 Ti 0.000000000000 4.594100000000 0.000000000000 6.0 6.0
44 Ti 2.297050000000 6.891150000000 1.479450000000 6.0 6.0
45 O 1.424171000000 6.018271000000 0.000000000000 3.0 3.0
46 O 3.169929000000 7.764029000000 0.000000000000 3.0 3.0
47 O 3.721221000000 5.466979000000 1.479450000000 3.0 3.0
48 O 0.872879000000 8.315321000000 1.479450000000 3.0 3.0
49 Ti 0.000000000000 4.594100000000 2.958900000000 6.0 6.0
50 Ti 2.297050000000 6.891150000000 4.438350000000 6.0 6.0
51 O 1.424171000000 6.018271000000 2.958900000000 3.0 3.0
52 O 3.169929000000 7.764029000000 2.958900000000 3.0 3.0
53 O 3.721221000000 5.466979000000 4.438350000000 3.0 3.0
54 O 0.872879000000 8.315321000000 4.438350000000 3.0 3.0
55 Ti 0.000000000000 4.594100000000 5.917800000000 6.0 6.0
56 Ti 2.297050000000 6.891150000000 7.397250000000 6.0 6.0
57 O 1.424171000000 6.018271000000 5.917800000000 3.0 3.0
58 O 3.169929000000 7.764029000000 5.917800000000 3.0 3.0
59 O 3.721221000000 5.466979000000 7.397250000000 3.0 3.0
60 O 0.872879000000 8.315321000000 7.397250000000 3.0 3.0
61 Ti 0.000000000000 4.594100000000 8.876700000000 6.0 6.0
62 Ti 2.297050000000 6.891150000000 10.356150000000 6.0 6.0
63 O 1.424171000000 6.018271000000 8.876700000000 3.0 3.0
64 O 3.169929000000 7.764029000000 8.876700000000 3.0 3.0
65 O 3.721221000000 5.466979000000 10.356150000000 3.0 3.0
66 O 0.872879000000 8.315321000000 10.356150000000 3.0 3.0
67 Ti 0.000000000000 4.594100000000 11.835600000000 6.0 6.0
68 Ti 2.297050000000 6.891150000000 13.315050000000 6.0 6.0
69 O 1.424171000000 6.018271000000 11.835600000000 3.0 3.0
70 O 3.169929000000 7.764029000000 11.835600000000 3.0 3.0
71 O 3.721221000000 5.466979000000 13.315050000000 3.0 3.0
72 O 0.872879000000 8.315321000000 13.315050000000 3.0 3.0
73 Ti 0.000000000000 4.594100000000 14.794500000000 6.0 6.0
74 Ti 2.297050000000 6.891150000000 16.273950000000 6.0 6.0
75 O 1.424171000000 6.018271000000 14.794500000000 3.0 3.0
76 O 3.169929000000 7.764029000000 14.794500000000 3.0 3.0
77 O 3.721221000000 5.466979000000 16.273950000000 3.0 3.0
78 O 0.872879000000 8.315321000000 16.273950000000 3.0 3.0
79 Ti 0.000000000000 4.594100000000 17.753400000000 6.0 6.0
80 Ti 2.297050000000 6.891150000000 19.232850000000 6.0 6.0
81 O 1.424171000000 6.018271000000 17.753400000000 3.0 3.0
82 O 3.169929000000 7.764029000000 17.753400000000 3.0 3.0
83 O 3.721221000000 5.466979000000 19.232850000000 3.0 3.0
84 O 0.872879000000 8.315321000000 19.232850000000 3.0 3.0
85 Ti 0.000000000000 9.188200000000 0.000000000000 6.0 6.0
86 Ti 2.297050000000 11.485250000000 1.479450000000 6.0 6.0
87 O 1.424171000000 10.612371000000 0.000000000000 3.0 3.0
88 O 3.169929000000 12.358129000000 0.000000000000 3.0 3.0
89 O 3.721221000000 10.061079000000 1.479450000000 3.0 3.0
90 O 0.872879000000 12.909421000000 1.479450000000 3.0 3.0
91 Ti 0.000000000000 9.188200000000 2.958900000000 6.0 6.0
92 Ti 2.297050000000 11.485250000000 4.438350000000 6.0 6.0
93 O 1.424171000000 10.612371000000 2.958900000000 3.0 3.0
94 O 3.169929000000 12.358129000000 2.958900000000 3.0 3.0
95 O 3.721221000000 10.061079000000 4.438350000000 3.0 3.0
96 O 0.872879000000 12.909421000000 4.438350000000 3.0 3.0
97 Ti 0.000000000000 9.188200000000 5.917800000000 6.0 6.0
98 Ti 2.297050000000 11.485250000000 7.397250000000 6.0 6.0
99 O 1.424171000000 10.612371000000 5.917800000000 3.0 3.0
100 O 3.169929000000 12.358129000000 5.917800000000 3.0 3.0
101 O 3.721221000000 10.061079000000 7.397250000000 3.0 3.0
102 O 0.872879000000 12.909421000000 7.397250000000 3.0 3.0
103 Ti 0.000000000000 9.188200000000 8.876700000000 6.0 6.0
104 Ti 2.297050000000 11.485250000000 10.356150000000 6.0 6.0
105 O 1.424171000000 10.612371000000 8.876700000000 3.0 3.0
106 O 3.169929000000 12.358129000000 8.876700000000 3.0 3.0
107 O 3.721221000000 10.061079000000 10.356150000000 3.0 3.0
108 O 0.872879000000 12.909421000000 10.356150000000 3.0 3.0
109 Ti 0.000000000000 9.188200000000 11.835600000000 6.0 6.0
110 Ti 2.297050000000 11.485250000000 13.315050000000 6.0 6.0
111 O 1.424171000000 10.612371000000 11.835600000000 3.0 3.0
112 O 3.169929000000 12.358129000000 11.835600000000 3.0 3.0
113 O 3.721221000000 10.061079000000 13.315050000000 3.0 3.0
114 O 0.872879000000 12.909421000000 13.315050000000 3.0 3.0
115 Ti 0.000000000000 9.188200000000 14.794500000000 6.0 6.0
116 Ti 2.297050000000 11.485250000000 16.273950000000 6.0 6.0
117 O 1.424171000000 10.612371000000 14.794500000000 3.0 3.0
118 O 3.169929000000 12.358129000000 14.794500000000 3.0 3.0
119 O 3.721221000000 10.061079000000 16.273950000000 3.0 3.0
120 O 0.872879000000 12.909421000000 16.273950000000 3.0 3.0
121 Ti 0.000000000000 9.188200000000 17.753400000000 6.0 6.0
122 Ti 2.297050000000 11.485250000000 19.232850000000 6.0 6.0
123 O 1.424171000000 10.612371000000 17.753400000000 3.0 3.0
124 O 3.169929000000 12.358129000000 17.753400000000 3.0 3.0
125 O 3.721221000000 10.061079000000 19.232850000000 3.0 3.0
126 O 0.872879000000 12.909421000000 19.232850000000 3.0 3.0
127 Ti 0.000000000000 13.782300000000 0.000000000000 6.0 6.0
128 Ti 2.297050000000 16.079350000000 1.479450000000 6.0 6.0
129 O 1.424171000000 15.206471000000 0.000000000000 3.0 3.0
130 O 3.169929000000 16.952229000000 0.000000000000 3.0 3.0
131 O 3.721221000000 14.655179000000 1.479450000000 3.0 3.0
132 O 0.872879000000 17.503521000000 1.479450000000 3.0 3.0
133 Ti 0.000000000000 13.782300000000 2.958900000000 6.0 6.0
134 Ti 2.297050000000 16.079350000000 4.438350000000 6.0 6.0
135 O 1.424171000000 15.206471000000 2.958900000000 3.0 3.0
136 O 3.169929000000 16.952229000000 2.958900000000 3.0 3.0
137 O 3.721221000000 14.655179000000 4.438350000000 3.0 3.0
138 O 0.872879000000 17.503521000000 4.438350000000 3.0 3.0
139 Ti 0.000000000000 13.782300000000 5.917800000000 6.0 6.0
140 Ti 2.297050000000 16.079350000000 7.397250000000 6.0 6.0
141 O 1.424171000000 15.206471000000 5.917800000000 3.0 3.0
142 O 3.169929000000 16.952229000000 5.917800000000 3.0 3.0
143 O 3.721221000000 14.655179000000 7.397250000000 3.0 3.0
144 O 0.872879000000 17.503521000000 7.397250000000 3.0 3.0
145 Ti 0.000000000000 13.782300000000 8.876700000000 6.0 6.0
146 Ti 2.297050000000 16.079350000000 10.356150000000 6.0 6.0
147 O 1.424171000000 15.206471000000 8.876700000000 3.0 3.0
148 O 3.169929000000 16.952229000000 8.876700000000 3.0 3.0
149 O 3.721221000000 14.655179000000 10.356150000000 3.0 3.0
150 O 0.872879000000 17.503521000000 10.356150000000 3.0 3.0
151 Ti 0.000000000000 13.782300000000 11.835600000000 6.0 6.0
152 Ti 2.297050000000 16.079350000000 13.315050000000 6.0 6.0
153 O 1.424171000000 15.206471000000 11.835600000000 3.0 3.0
154 O 3.169929000000 16.952229000000 11.835600000000 3.0 3.0
155 O 3.721221000000 14.655179000000 13.315050000000 3.0 3.0
156 O 0.872879000000 17.503521000000 13.315050000000 3.0 3.0
157 Ti 0.000000000000 13.782300000000 14.794500000000 6.0 6.0
158 Ti 2.297050000000 16.079350000000 16.273950000000 6.0 6.0
159 O 1.424171000000 15.206471000000 14.794500000000 3.0 3.0
160 O 3.169929000000 16.952229000000 14.794500000000 3.0 3.0
161 O 3.721221000000 14.655179000000 16.273950000000 3.0 3.0
162 O 0.872879000000 17.503521000000 16.273950000000 3.0 3.0
163 Ti 0.000000000000 13.782300000000 17.753400000000 6.0 6.0
164 Ti 2.297050000000 16.079350000000 19.232850000000 6.0 6.0
165 O 1.424171000000 15.206471000000 17.753400000000 3.0 3.0
166 O 3.169929000000 16.952229000000 17.753400000000 3.0 3.0
167 O 3.721221000000 14.655179000000 19.232850000000 3.0 3.0
168 O 0.872879000000 17.503521000000 19.232850000000 3.0 3.0
169 Ti 0.000000000000 18.376400000000 0.000000000000 6.0 6.0
170 Ti 2.297050000000 20.673450000000 1.479450000000 6.0 6.0
171 O 1.424171000000 19.800571000000 0.000000000000 3.0 3.0
172 O 3.169929000000 21.546329000000 0.000000000000 3.0 3.0
173 O 3.721221000000 19.249279000000 1.479450000000 3.0 3.0
174 O 0.872879000000 22.097621000000 1.479450000000 3.0 3.0
175 Ti 0.000000000000 18.376400000000 2.958900000000 6.0 6.0
176 Ti 2.297050000000 20.673450000000 4.438350000000 6.0 6.0
177 O 1.424171000000 19.800571000000 2.958900000000 3.0 3.0
178 O 3.169929000000 21.546329000000 2.958900000000 3.0 3.0
179 O 3.721221000000 19.249279000000 4.438350000000 3.0 3.0
180 O 0.872879000000 22.097621000000 4.438350000000 3.0 3.0
181 Ti 0.000000000000 18.376400000000 5.917800000000 6.0 6.0
182 Ti 2.297050000000 20.673450000000 7.397250000000 6.0 6.0
183 O 1.424171000000 19.800571000000 5.917800000000 3.0 3.0
184 O 3.169929000000 21.546329000000 5.917800000000 3.0 3.0
185 O 3.721221000000 19.249279000000 7.397250000000 3.0 3.0
186 O 0.872879000000 22.097621000000 7.397250000000 3.0 3.0
187 Ti 0.000000000000 18.376400000000 8.876700000000 6.0 6.0
188 Ti 2.297050000000 20.673450000000 10.356150000000 6.0 6.0
189 O 1.424171000000 19.800571000000 8.876700000000 3.0 3.0
190 O 3.169929000000 21.546329000000 8.876700000000 3.0 3.0
191 O 3.721221000000 19.249279000000 10.356150000000 3.0 3.0
192 O 0.872879000000 22.097621000000 10.356150000000 3.0 3.0
193 Ti 0.000000000000 18.376400000000 11.835600000000 6.0 6.0
194 Ti 2.297050000000 20.673450000000 13.315050000000 6.0 6.0
195 O 1.424171000000 19.800571000000 11.835600000000 3.0 3.0
196 O 3.169929000000 21.546329000000 11.835600000000 3.0 3.0
197 O 3.721221000000 19.249279000000 13.315050000000 3.0 3.0
198 O 0.872879000000 22.097621000000 13.315050000000 3.0 3.0
199 Ti 0.000000000000 18.376400000000 14.794500000000 6.0 6.0
200 Ti 2.297050000000 20.673450000000 16.273950000000 6.0 6.0
201 O 1.424171000000 19.800571000000 14.794500000000 3.0 3.0
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203 O 3.721221000000 19.249279000000 16.273950000000 3.0 3.0
204 O 0.872879000000 22.097621000000 16.273950000000 3.0 3.0
205 Ti 0.000000000000 18.376400000000 17.753400000000 6.0 6.0
206 Ti 2.297050000000 20.673450000000 19.232850000000 6.0 6.0
207 O 1.424171000000 19.800571000000 17.753400000000 3.0 3.0
208 O 3.169929000000 21.546329000000 17.753400000000 3.0 3.0
209 O 3.721221000000 19.249279000000 19.232850000000 3.0 3.0
210 O 0.872879000000 22.097621000000 19.232850000000 3.0 3.0
211 Ti 4.594100000000 0.000000000000 0.000000000000 6.0 6.0
212 Ti 6.891150000000 2.297050000000 1.479450000000 6.0 6.0
213 O 6.018271000000 1.424171000000 0.000000000000 3.0 3.0
214 O 7.764029000000 3.169929000000 0.000000000000 3.0 3.0
215 O 8.315321000000 0.872879000000 1.479450000000 3.0 3.0
216 O 5.466979000000 3.721221000000 1.479450000000 3.0 3.0
217 Ti 4.594100000000 0.000000000000 2.958900000000 6.0 6.0
218 Ti 6.891150000000 2.297050000000 4.438350000000 6.0 6.0
219 O 6.018271000000 1.424171000000 2.958900000000 3.0 3.0
220 O 7.764029000000 3.169929000000 2.958900000000 3.0 3.0
221 O 8.315321000000 0.872879000000 4.438350000000 3.0 3.0
222 O 5.466979000000 3.721221000000 4.438350000000 3.0 3.0
223 Ti 4.594100000000 0.000000000000 5.917800000000 6.0 6.0
224 Ti 6.891150000000 2.297050000000 7.397250000000 6.0 6.0
225 O 6.018271000000 1.424171000000 5.917800000000 3.0 3.0
226 O 7.764029000000 3.169929000000 5.917800000000 3.0 3.0
227 O 8.315321000000 0.872879000000 7.397250000000 3.0 3.0
228 O 5.466979000000 3.721221000000 7.397250000000 3.0 3.0
229 Ti 4.594100000000 0.000000000000 8.876700000000 6.0 6.0
230 Ti 6.891150000000 2.297050000000 10.356150000000 6.0 6.0
231 O 6.018271000000 1.424171000000 8.876700000000 3.0 3.0
232 O 7.764029000000 3.169929000000 8.876700000000 3.0 3.0
233 O 8.315321000000 0.872879000000 10.356150000000 3.0 3.0
234 O 5.466979000000 3.721221000000 10.356150000000 3.0 3.0
235 Ti 4.594100000000 0.000000000000 11.835600000000 6.0 6.0
236 Ti 6.891150000000 2.297050000000 13.315050000000 6.0 6.0
237 O 6.018271000000 1.424171000000 11.835600000000 3.0 3.0
238 O 7.764029000000 3.169929000000 11.835600000000 3.0 3.0
239 O 8.315321000000 0.872879000000 13.315050000000 3.0 3.0
240 O 5.466979000000 3.721221000000 13.315050000000 3.0 3.0
241 Ti 4.594100000000 0.000000000000 14.794500000000 6.0 6.0
242 Ti 6.891150000000 2.297050000000 16.273950000000 6.0 6.0
243 O 6.018271000000 1.424171000000 14.794500000000 3.0 3.0
244 O 7.764029000000 3.169929000000 14.794500000000 3.0 3.0
245 O 8.315321000000 0.872879000000 16.273950000000 3.0 3.0
246 O 5.466979000000 3.721221000000 16.273950000000 3.0 3.0
247 Ti 4.594100000000 0.000000000000 17.753400000000 6.0 6.0
248 Ti 6.891150000000 2.297050000000 19.232850000000 6.0 6.0
249 O 6.018271000000 1.424171000000 17.753400000000 3.0 3.0
250 O 7.764029000000 3.169929000000 17.753400000000 3.0 3.0
251 O 8.315321000000 0.872879000000 19.232850000000 3.0 3.0
252 O 5.466979000000 3.721221000000 19.232850000000 3.0 3.0
253 Ti 4.594100000000 4.594100000000 0.000000000000 6.0 6.0
254 Ti 6.891150000000 6.891150000000 1.479450000000 6.0 6.0
255 O 6.018271000000 6.018271000000 0.000000000000 3.0 3.0
256 O 7.764029000000 7.764029000000 0.000000000000 3.0 3.0
257 O 8.315321000000 5.466979000000 1.479450000000 3.0 3.0
258 O 5.466979000000 8.315321000000 1.479450000000 3.0 3.0
259 Ti 4.594100000000 4.594100000000 2.958900000000 6.0 6.0
260 Ti 6.891150000000 6.891150000000 4.438350000000 6.0 6.0
261 O 6.018271000000 6.018271000000 2.958900000000 3.0 3.0
262 O 7.764029000000 7.764029000000 2.958900000000 3.0 3.0
263 O 8.315321000000 5.466979000000 4.438350000000 3.0 3.0
264 O 5.466979000000 8.315321000000 4.438350000000 3.0 3.0
265 Ti 4.594100000000 4.594100000000 5.917800000000 6.0 6.0
266 Ti 6.891150000000 6.891150000000 7.397250000000 6.0 6.0
267 O 6.018271000000 6.018271000000 5.917800000000 3.0 3.0
268 O 7.764029000000 7.764029000000 5.917800000000 3.0 3.0
269 O 8.315321000000 5.466979000000 7.397250000000 3.0 3.0
270 O 5.466979000000 8.315321000000 7.397250000000 3.0 3.0
271 Ti 4.594100000000 4.594100000000 8.876700000000 6.0 6.0
272 Ti 6.891150000000 6.891150000000 10.356150000000 6.0 6.0
273 O 6.018271000000 6.018271000000 8.876700000000 3.0 3.0
274 O 7.764029000000 7.764029000000 8.876700000000 3.0 3.0
275 O 8.315321000000 5.466979000000 10.356150000000 3.0 3.0
276 O 5.466979000000 8.315321000000 10.356150000000 3.0 3.0
277 Ti 4.594100000000 4.594100000000 11.835600000000 6.0 6.0
278 Ti 6.891150000000 6.891150000000 13.315050000000 6.0 6.0
279 O 6.018271000000 6.018271000000 11.835600000000 3.0 3.0
280 O 7.764029000000 7.764029000000 11.835600000000 3.0 3.0
281 O 8.315321000000 5.466979000000 13.315050000000 3.0 3.0
282 O 5.466979000000 8.315321000000 13.315050000000 3.0 3.0
283 Ti 4.594100000000 4.594100000000 14.794500000000 6.0 6.0
284 Ti 6.891150000000 6.891150000000 16.273950000000 6.0 6.0
285 O 6.018271000000 6.018271000000 14.794500000000 3.0 3.0
286 O 7.764029000000 7.764029000000 14.794500000000 3.0 3.0
287 O 8.315321000000 5.466979000000 16.273950000000 3.0 3.0
288 O 5.466979000000 8.315321000000 16.273950000000 3.0 3.0
289 Ti 4.594100000000 4.594100000000 17.753400000000 6.0 6.0
290 Ti 6.891150000000 6.891150000000 19.232850000000 6.0 6.0
291 O 6.018271000000 6.018271000000 17.753400000000 3.0 3.0
292 O 7.764029000000 7.764029000000 17.753400000000 3.0 3.0
293 O 8.315321000000 5.466979000000 19.232850000000 3.0 3.0
294 O 5.466979000000 8.315321000000 19.232850000000 3.0 3.0
295 Ti 4.594100000000 9.188200000000 0.000000000000 6.0 6.0
296 Ti 6.891150000000 11.485250000000 1.479450000000 6.0 6.0
297 O 6.018271000000 10.612371000000 0.000000000000 3.0 3.0
298 O 7.764029000000 12.358129000000 0.000000000000 3.0 3.0
299 O 8.315321000000 10.061079000000 1.479450000000 3.0 3.0
300 O 5.466979000000 12.909421000000 1.479450000000 3.0 3.0
301 Ti 4.594100000000 9.188200000000 2.958900000000 6.0 6.0
302 Ti 6.891150000000 11.485250000000 4.438350000000 6.0 6.0
303 O 6.018271000000 10.612371000000 2.958900000000 3.0 3.0
304 O 7.764029000000 12.358129000000 2.958900000000 3.0 3.0
305 O 8.315321000000 10.061079000000 4.438350000000 3.0 3.0
306 O 5.466979000000 12.909421000000 4.438350000000 3.0 3.0
307 Ti 4.594100000000 9.188200000000 5.917800000000 6.0 6.0
308 Ti 6.891150000000 11.485250000000 7.397250000000 6.0 6.0
309 O 6.018271000000 10.612371000000 5.917800000000 3.0 3.0
310 O 7.764029000000 12.358129000000 5.917800000000 3.0 3.0
311 O 8.315321000000 10.061079000000 7.397250000000 3.0 3.0
312 O 5.466979000000 12.909421000000 7.397250000000 3.0 3.0
313 Ti 4.594100000000 9.188200000000 8.876700000000 6.0 6.0
314 Ti 6.891150000000 11.485250000000 10.356150000000 6.0 6.0
315 O 6.018271000000 10.612371000000 8.876700000000 3.0 3.0
316 O 7.764029000000 12.358129000000 8.876700000000 3.0 3.0
317 O 8.315321000000 10.061079000000 10.356150000000 3.0 3.0
318 O 5.466979000000 12.909421000000 10.356150000000 3.0 3.0
319 Ti 4.594100000000 9.188200000000 11.835600000000 6.0 6.0
320 Ti 6.891150000000 11.485250000000 13.315050000000 6.0 6.0
321 O 6.018271000000 10.612371000000 11.835600000000 3.0 3.0
322 O 7.764029000000 12.358129000000 11.835600000000 3.0 3.0
323 O 8.315321000000 10.061079000000 13.315050000000 3.0 3.0
324 O 5.466979000000 12.909421000000 13.315050000000 3.0 3.0
325 Ti 4.594100000000 9.188200000000 14.794500000000 6.0 6.0
326 Ti 6.891150000000 11.485250000000 16.273950000000 6.0 6.0
327 O 6.018271000000 10.612371000000 14.794500000000 3.0 3.0
328 O 7.764029000000 12.358129000000 14.794500000000 3.0 3.0
329 O 8.315321000000 10.061079000000 16.273950000000 3.0 3.0
330 O 5.466979000000 12.909421000000 16.273950000000 3.0 3.0
331 Ti 4.594100000000 9.188200000000 17.753400000000 6.0 6.0
332 Ti 6.891150000000 11.485250000000 19.232850000000 6.0 6.0
333 O 6.018271000000 10.612371000000 17.753400000000 3.0 3.0
334 O 7.764029000000 12.358129000000 17.753400000000 3.0 3.0
335 O 8.315321000000 10.061079000000 19.232850000000 3.0 3.0
336 O 5.466979000000 12.909421000000 19.232850000000 3.0 3.0
337 Ti 4.594100000000 13.782300000000 0.000000000000 6.0 6.0
338 Ti 6.891150000000 16.079350000000 1.479450000000 6.0 6.0
339 O 6.018271000000 15.206471000000 0.000000000000 3.0 3.0
340 O 7.764029000000 16.952229000000 0.000000000000 3.0 3.0
341 O 8.315321000000 14.655179000000 1.479450000000 3.0 3.0
342 O 5.466979000000 17.503521000000 1.479450000000 3.0 3.0
343 Ti 4.594100000000 13.782300000000 2.958900000000 6.0 6.0
344 Ti 6.891150000000 16.079350000000 4.438350000000 6.0 6.0
345 O 6.018271000000 15.206471000000 2.958900000000 3.0 3.0
346 O 7.764029000000 16.952229000000 2.958900000000 3.0 3.0
347 O 8.315321000000 14.655179000000 4.438350000000 3.0 3.0
348 O 5.466979000000 17.503521000000 4.438350000000 3.0 3.0
349 Ti 4.594100000000 13.782300000000 5.917800000000 6.0 6.0
350 Ti 6.891150000000 16.079350000000 7.397250000000 6.0 6.0
351 O 6.018271000000 15.206471000000 5.917800000000 3.0 3.0
352 O 7.764029000000 16.952229000000 5.917800000000 3.0 3.0
353 O 8.315321000000 14.655179000000 7.397250000000 3.0 3.0
354 O 5.466979000000 17.503521000000 7.397250000000 3.0 3.0
355 Ti 4.594100000000 13.782300000000 8.876700000000 6.0 6.0
356 Ti 6.891150000000 16.079350000000 10.356150000000 6.0 6.0
357 O 6.018271000000 15.206471000000 8.876700000000 3.0 3.0
358 O 7.764029000000 16.952229000000 8.876700000000 3.0 3.0
359 O 8.315321000000 14.655179000000 10.356150000000 3.0 3.0
360 O 5.466979000000 17.503521000000 10.356150000000 3.0 3.0
361 Ti 4.594100000000 13.782300000000 11.835600000000 6.0 6.0
362 Ti 6.891150000000 16.079350000000 13.315050000000 6.0 6.0
363 O 6.018271000000 15.206471000000 11.835600000000 3.0 3.0
364 O 7.764029000000 16.952229000000 11.835600000000 3.0 3.0
365 O 8.315321000000 14.655179000000 13.315050000000 3.0 3.0
366 O 5.466979000000 17.503521000000 13.315050000000 3.0 3.0
367 Ti 4.594100000000 13.782300000000 14.794500000000 6.0 6.0
368 Ti 6.891150000000 16.079350000000 16.273950000000 6.0 6.0
369 O 6.018271000000 15.206471000000 14.794500000000 3.0 3.0
370 O 7.764029000000 16.952229000000 14.794500000000 3.0 3.0
371 O 8.315321000000 14.655179000000 16.273950000000 3.0 3.0
372 O 5.466979000000 17.503521000000 16.273950000000 3.0 3.0
373 Ti 4.594100000000 13.782300000000 17.753400000000 6.0 6.0
374 Ti 6.891150000000 16.079350000000 19.232850000000 6.0 6.0
375 O 6.018271000000 15.206471000000 17.753400000000 3.0 3.0
376 O 7.764029000000 16.952229000000 17.753400000000 3.0 3.0
377 O 8.315321000000 14.655179000000 19.232850000000 3.0 3.0
378 O 5.466979000000 17.503521000000 19.232850000000 3.0 3.0
379 Ti 4.594100000000 18.376400000000 0.000000000000 6.0 6.0
380 Ti 6.891150000000 20.673450000000 1.479450000000 6.0 6.0
381 O 6.018271000000 19.800571000000 0.000000000000 3.0 3.0
382 O 7.764029000000 21.546329000000 0.000000000000 3.0 3.0
383 O 8.315321000000 19.249279000000 1.479450000000 3.0 3.0
384 O 5.466979000000 22.097621000000 1.479450000000 3.0 3.0
385 Ti 4.594100000000 18.376400000000 2.958900000000 6.0 6.0
386 Ti 6.891150000000 20.673450000000 4.438350000000 6.0 6.0
387 O 6.018271000000 19.800571000000 2.958900000000 3.0 3.0
388 O 7.764029000000 21.546329000000 2.958900000000 3.0 3.0
389 O 8.315321000000 19.249279000000 4.438350000000 3.0 3.0
390 O 5.466979000000 22.097621000000 4.438350000000 3.0 3.0
391 Ti 4.594100000000 18.376400000000 5.917800000000 6.0 6.0
392 Ti 6.891150000000 20.673450000000 7.397250000000 6.0 6.0
393 O 6.018271000000 19.800571000000 5.917800000000 3.0 3.0
394 O 7.764029000000 21.546329000000 5.917800000000 3.0 3.0
395 O 8.315321000000 19.249279000000 7.397250000000 3.0 3.0
396 O 5.466979000000 22.097621000000 7.397250000000 3.0 3.0
397 Ti 4.594100000000 18.376400000000 8.876700000000 6.0 6.0
398 Ti 6.891150000000 20.673450000000 10.356150000000 6.0 6.0
399 O 6.018271000000 19.800571000000 8.876700000000 3.0 3.0
400 O 7.764029000000 21.546329000000 8.876700000000 3.0 3.0
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402 O 5.466979000000 22.097621000000 10.356150000000 3.0 3.0
403 Ti 4.594100000000 18.376400000000 11.835600000000 6.0 6.0
404 Ti 6.891150000000 20.673450000000 13.315050000000 6.0 6.0
405 O 6.018271000000 19.800571000000 11.835600000000 3.0 3.0
406 O 7.764029000000 21.546329000000 11.835600000000 3.0 3.0
407 O 8.315321000000 19.249279000000 13.315050000000 3.0 3.0
408 O 5.466979000000 22.097621000000 13.315050000000 3.0 3.0
409 Ti 4.594100000000 18.376400000000 14.794500000000 6.0 6.0
410 Ti 6.891150000000 20.673450000000 16.273950000000 6.0 6.0
411 O 6.018271000000 19.800571000000 14.794500000000 3.0 3.0
412 O 7.764029000000 21.546329000000 14.794500000000 3.0 3.0
413 O 8.315321000000 19.249279000000 16.273950000000 3.0 3.0
414 O 5.466979000000 22.097621000000 16.273950000000 3.0 3.0
415 Ti 4.594100000000 18.376400000000 17.753400000000 6.0 6.0
416 Ti 6.891150000000 20.673450000000 19.232850000000 6.0 6.0
417 O 6.018271000000 19.800571000000 17.753400000000 3.0 3.0
418 O 7.764029000000 21.546329000000 17.753400000000 3.0 3.0
419 O 8.315321000000 19.249279000000 19.232850000000 3.0 3.0
420 O 5.466979000000 22.097621000000 19.232850000000 3.0 3.0
421 Ti 9.188200000000 0.000000000000 0.000000000000 6.0 6.0
422 Ti 11.485250000000 2.297050000000 1.479450000000 6.0 6.0
423 O 10.612371000000 1.424171000000 0.000000000000 3.0 3.0
424 O 12.358129000000 3.169929000000 0.000000000000 3.0 3.0
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426 O 10.061079000000 3.721221000000 1.479450000000 3.0 3.0
427 Ti 9.188200000000 0.000000000000 2.958900000000 6.0 6.0
428 Ti 11.485250000000 2.297050000000 4.438350000000 6.0 6.0
429 O 10.612371000000 1.424171000000 2.958900000000 3.0 3.0
430 O 12.358129000000 3.169929000000 2.958900000000 3.0 3.0
431 O 12.909421000000 0.872879000000 4.438350000000 3.0 3.0
432 O 10.061079000000 3.721221000000 4.438350000000 3.0 3.0
433 Ti 9.188200000000 0.000000000000 5.917800000000 6.0 6.0
434 Ti 11.485250000000 2.297050000000 7.397250000000 6.0 6.0
435 O 10.612371000000 1.424171000000 5.917800000000 3.0 3.0
436 O 12.358129000000 3.169929000000 5.917800000000 3.0 3.0
437 O 12.909421000000 0.872879000000 7.397250000000 3.0 3.0
438 O 10.061079000000 3.721221000000 7.397250000000 3.0 3.0
439 Ti 9.188200000000 0.000000000000 8.876700000000 6.0 6.0
440 Ti 11.485250000000 2.297050000000 10.356150000000 6.0 6.0
441 O 10.612371000000 1.424171000000 8.876700000000 3.0 3.0
442 O 12.358129000000 3.169929000000 8.876700000000 3.0 3.0
443 O 12.909421000000 0.872879000000 10.356150000000 3.0 3.0
444 O 10.061079000000 3.721221000000 10.356150000000 3.0 3.0
445 Ti 9.188200000000 0.000000000000 11.835600000000 6.0 6.0
446 Ti 11.485250000000 2.297050000000 13.315050000000 6.0 6.0
447 O 10.612371000000 1.424171000000 11.835600000000 3.0 3.0
448 O 12.358129000000 3.169929000000 11.835600000000 3.0 3.0
449 O 12.909421000000 0.872879000000 13.315050000000 3.0 3.0
450 O 10.061079000000 3.721221000000 13.315050000000 3.0 3.0
451 Ti 9.188200000000 0.000000000000 14.794500000000 6.0 6.0
452 Ti 11.485250000000 2.297050000000 16.273950000000 6.0 6.0
453 O 10.612371000000 1.424171000000 14.794500000000 3.0 3.0
454 O 12.358129000000 3.169929000000 14.794500000000 3.0 3.0
455 O 12.909421000000 0.872879000000 16.273950000000 3.0 3.0
456 O 10.061079000000 3.721221000000 16.273950000000 3.0 3.0
457 Ti 9.188200000000 0.000000000000 17.753400000000 6.0 6.0
458 Ti 11.485250000000 2.297050000000 19.232850000000 6.0 6.0
459 O 10.612371000000 1.424171000000 17.753400000000 3.0 3.0
460 O 12.358129000000 3.169929000000 17.753400000000 3.0 3.0
461 O 12.909421000000 0.872879000000 19.232850000000 3.0 3.0
462 O 10.061079000000 3.721221000000 19.232850000000 3.0 3.0
463 Ti 9.188200000000 4.594100000000 0.000000000000 6.0 6.0
464 Ti 11.485250000000 6.891150000000 1.479450000000 6.0 6.0
465 O 10.612371000000 6.018271000000 0.000000000000 3.0 3.0
466 O 12.358129000000 7.764029000000 0.000000000000 3.0 3.0
467 O 12.909421000000 5.466979000000 1.479450000000 3.0 3.0
468 O 10.061079000000 8.315321000000 1.479450000000 3.0 3.0
469 Ti 9.188200000000 4.594100000000 2.958900000000 6.0 6.0
470 Ti 11.485250000000 6.891150000000 4.438350000000 6.0 6.0
471 O 10.612371000000 6.018271000000 2.958900000000 3.0 3.0
472 O 12.358129000000 7.764029000000 2.958900000000 3.0 3.0
473 O 12.909421000000 5.466979000000 4.438350000000 3.0 3.0
474 O 10.061079000000 8.315321000000 4.438350000000 3.0 3.0
475 Ti 9.188200000000 4.594100000000 5.917800000000 6.0 6.0
476 Ti 11.485250000000 6.891150000000 7.397250000000 6.0 6.0
477 O 10.612371000000 6.018271000000 5.917800000000 3.0 3.0
478 O 12.358129000000 7.764029000000 5.917800000000 3.0 3.0
479 O 12.909421000000 5.466979000000 7.397250000000 3.0 3.0
480 O 10.061079000000 8.315321000000 7.397250000000 3.0 3.0
481 Ti 9.188200000000 4.594100000000 8.876700000000 6.0 6.0
482 Ti 11.485250000000 6.891150000000 10.356150000000 6.0 6.0
483 O 10.612371000000 6.018271000000 8.876700000000 3.0 3.0
484 O 12.358129000000 7.764029000000 8.876700000000 3.0 3.0
485 O 12.909421000000 5.466979000000 10.356150000000 3.0 3.0
486 O 10.061079000000 8.315321000000 10.356150000000 3.0 3.0
487 Ti 9.188200000000 4.594100000000 11.835600000000 6.0 6.0
488 Ti 11.485250000000 6.891150000000 13.315050000000 6.0 6.0
489 O 10.612371000000 6.018271000000 11.835600000000 3.0 3.0
490 O 12.358129000000 7.764029000000 11.835600000000 3.0 3.0
491 O 12.909421000000 5.466979000000 13.315050000000 3.0 3.0
492 O 10.061079000000 8.315321000000 13.315050000000 3.0 3.0
493 Ti 9.188200000000 4.594100000000 14.794500000000 6.0 6.0
494 Ti 11.485250000000 6.891150000000 16.273950000000 6.0 6.0
495 O 10.612371000000 6.018271000000 14.794500000000 3.0 3.0
496 O 12.358129000000 7.764029000000 14.794500000000 3.0 3.0
497 O 12.909421000000 5.466979000000 16.273950000000 3.0 3.0
498 O 10.061079000000 8.315321000000 16.273950000000 3.0 3.0
499 Ti 9.188200000000 4.594100000000 17.753400000000 6.0 6.0
500 Ti 11.485250000000 6.891150000000 19.232850000000 6.0 6.0
501 O 10.612371000000 6.018271000000 17.753400000000 3.0 3.0
502 O 12.358129000000 7.764029000000 17.753400000000 3.0 3.0
503 O 12.909421000000 5.466979000000 19.232850000000 3.0 3.0
504 O 10.061079000000 8.315321000000 19.232850000000 3.0 3.0
505 Ti 9.188200000000 9.188200000000 0.000000000000 6.0 6.0
506 Ti 11.485250000000 11.485250000000 1.479450000000 6.0 6.0
507 O 10.612371000000 10.612371000000 0.000000000000 3.0 3.0
508 O 12.358129000000 12.358129000000 0.000000000000 3.0 3.0
509 O 12.909421000000 10.061079000000 1.479450000000 3.0 3.0
510 O 10.061079000000 12.909421000000 1.479450000000 3.0 3.0
511 Ti 9.188200000000 9.188200000000 2.958900000000 6.0 6.0
512 Ti 11.485250000000 11.485250000000 4.438350000000 6.0 6.0
513 O 10.612371000000 10.612371000000 2.958900000000 3.0 3.0
514 O 12.358129000000 12.358129000000 2.958900000000 3.0 3.0
515 O 12.909421000000 10.061079000000 4.438350000000 3.0 3.0
516 O 10.061079000000 12.909421000000 4.438350000000 3.0 3.0
517 Ti 9.188200000000 9.188200000000 5.917800000000 6.0 6.0
518 Ti 11.485250000000 11.485250000000 7.397250000000 6.0 6.0
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831 O 15.206471000000 19.800571000000 14.794500000000 3.0 3.0
832 O 16.952229000000 21.546329000000 14.794500000000 3.0 3.0
833 O 17.503521000000 19.249279000000 16.273950000000 3.0 3.0
834 O 14.655179000000 22.097621000000 16.273950000000 3.0 3.0
835 Ti 13.782300000000 18.376400000000 17.753400000000 6.0 6.0
836 Ti 16.079350000000 20.673450000000 19.232850000000 6.0 6.0
837 O 15.206471000000 19.800571000000 17.753400000000 3.0 3.0
838 O 16.952229000000 21.546329000000 17.753400000000 3.0 3.0
839 O 17.503521000000 19.249279000000 19.232850000000 3.0 3.0
840 O 14.655179000000 22.097621000000 19.232850000000 3.0 3.0
841 Ti 18.376400000000 0.000000000000 0.000000000000 6.0 6.0
842 Ti 20.673450000000 2.297050000000 1.479450000000 6.0 6.0
843 O 19.800571000000 1.424171000000 0.000000000000 3.0 3.0
844 O 21.546329000000 3.169929000000 0.000000000000 3.0 3.0
845 O 22.097621000000 0.872879000000 1.479450000000 3.0 3.0
846 O 19.249279000000 3.721221000000 1.479450000000 3.0 3.0
847 Ti 18.376400000000 0.000000000000 2.958900000000 6.0 6.0
848 Ti 20.673450000000 2.297050000000 4.438350000000 6.0 6.0
849 O 19.800571000000 1.424171000000 2.958900000000 3.0 3.0
850 O 21.546329000000 3.169929000000 2.958900000000 3.0 3.0
851 O 22.097621000000 0.872879000000 4.438350000000 3.0 3.0
852 O 19.249279000000 3.721221000000 4.438350000000 3.0 3.0
853 Ti 18.376400000000 0.000000000000 5.917800000000 6.0 6.0
854 Ti 20.673450000000 2.297050000000 7.397250000000 6.0 6.0
855 O 19.800571000000 1.424171000000 5.917800000000 3.0 3.0
856 O 21.546329000000 3.169929000000 5.917800000000 3.0 3.0
857 O 22.097621000000 0.872879000000 7.397250000000 3.0 3.0
858 O 19.249279000000 3.721221000000 7.397250000000 3.0 3.0
859 Ti 18.376400000000 0.000000000000 8.876700000000 6.0 6.0
860 Ti 20.673450000000 2.297050000000 10.356150000000 6.0 6.0
861 O 19.800571000000 1.424171000000 8.876700000000 3.0 3.0
862 O 21.546329000000 3.169929000000 8.876700000000 3.0 3.0
863 O 22.097621000000 0.872879000000 10.356150000000 3.0 3.0
864 O 19.249279000000 3.721221000000 10.356150000000 3.0 3.0
865 Ti 18.376400000000 0.000000000000 11.835600000000 6.0 6.0
866 Ti 20.673450000000 2.297050000000 13.315050000000 6.0 6.0
867 O 19.800571000000 1.424171000000 11.835600000000 3.0 3.0
868 O 21.546329000000 3.169929000000 11.835600000000 3.0 3.0
869 O 22.097621000000 0.872879000000 13.315050000000 3.0 3.0
870 O 19.249279000000 3.721221000000 13.315050000000 3.0 3.0
871 Ti 18.376400000000 0.000000000000 14.794500000000 6.0 6.0
872 Ti 20.673450000000 2.297050000000 16.273950000000 6.0 6.0
873 O 19.800571000000 1.424171000000 14.794500000000 3.0 3.0
874 O 21.546329000000 3.169929000000 14.794500000000 3.0 3.0
875 O 22.097621000000 0.872879000000 16.273950000000 3.0 3.0
876 O 19.249279000000 3.721221000000 16.273950000000 3.0 3.0
877 Ti 18.376400000000 0.000000000000 17.753400000000 6.0 6.0
878 Ti 20.673450000000 2.297050000000 19.232850000000 6.0 6.0
879 O 19.800571000000 1.424171000000 17.753400000000 3.0 3.0
880 O 21.546329000000 3.169929000000 17.753400000000 3.0 3.0
881 O 22.097621000000 0.872879000000 19.232850000000 3.0 3.0
882 O 19.249279000000 3.721221000000 19.232850000000 3.0 3.0
883 Ti 18.376400000000 4.594100000000 0.000000000000 6.0 6.0
884 Ti 20.673450000000 6.891150000000 1.479450000000 6.0 6.0
885 O 19.800571000000 6.018271000000 0.000000000000 3.0 3.0
886 O 21.546329000000 7.764029000000 0.000000000000 3.0 3.0
887 O 22.097621000000 5.466979000000 1.479450000000 3.0 3.0
888 O 19.249279000000 8.315321000000 1.479450000000 3.0 3.0
889 Ti 18.376400000000 4.594100000000 2.958900000000 6.0 6.0
890 Ti 20.673450000000 6.891150000000 4.438350000000 6.0 6.0
891 O 19.800571000000 6.018271000000 2.958900000000 3.0 3.0
892 O 21.546329000000 7.764029000000 2.958900000000 3.0 3.0
893 O 22.097621000000 5.466979000000 4.438350000000 3.0 3.0
894 O 19.249279000000 8.315321000000 4.438350000000 3.0 3.0
895 Ti 18.376400000000 4.594100000000 5.917800000000 6.0 6.0
896 Ti 20.673450000000 6.891150000000 7.397250000000 6.0 6.0
897 O 19.800571000000 6.018271000000 5.917800000000 3.0 3.0
898 O 21.546329000000 7.764029000000 5.917800000000 3.0 3.0
899 O 22.097621000000 5.466979000000 7.397250000000 3.0 3.0
900 O 19.249279000000 8.315321000000 7.397250000000 3.0 3.0
901 Ti 18.376400000000 4.594100000000 8.876700000000 6.0 6.0
902 Ti 20.673450000000 6.891150000000 10.356150000000 6.0 6.0
903 O 19.800571000000 6.018271000000 8.876700000000 3.0 3.0
904 O 21.546329000000 7.764029000000 8.876700000000 3.0 3.0
905 O 22.097621000000 5.466979000000 10.356150000000 3.0 3.0
906 O 19.249279000000 8.315321000000 10.356150000000 3.0 3.0
907 Ti 18.376400000000 4.594100000000 11.835600000000 6.0 6.0
908 Ti 20.673450000000 6.891150000000 13.315050000000 6.0 6.0
909 O 19.800571000000 6.018271000000 11.835600000000 3.0 3.0
910 O 21.546329000000 7.764029000000 11.835600000000 3.0 3.0
911 O 22.097621000000 5.466979000000 13.315050000000 3.0 3.0
912 O 19.249279000000 8.315321000000 13.315050000000 3.0 3.0
913 Ti 18.376400000000 4.594100000000 14.794500000000 6.0 6.0
914 Ti 20.673450000000 6.891150000000 16.273950000000 6.0 6.0
915 O 19.800571000000 6.018271000000 14.794500000000 3.0 3.0
916 O 21.546329000000 7.764029000000 14.794500000000 3.0 3.0
917 O 22.097621000000 5.466979000000 16.273950000000 3.0 3.0
918 O 19.249279000000 8.315321000000 16.273950000000 3.0 3.0
919 Ti 18.376400000000 4.594100000000 17.753400000000 6.0 6.0
920 Ti 20.673450000000 6.891150000000 19.232850000000 6.0 6.0
921 O 19.800571000000 6.018271000000 17.753400000000 3.0 3.0
922 O 21.546329000000 7.764029000000 17.753400000000 3.0 3.0
923 O 22.097621000000 5.466979000000 19.232850000000 3.0 3.0
924 O 19.249279000000 8.315321000000 19.232850000000 3.0 3.0
925 Ti 18.376400000000 9.188200000000 0.000000000000 6.0 6.0
926 Ti 20.673450000000 11.485250000000 1.479450000000 6.0 6.0
927 O 19.800571000000 10.612371000000 0.000000000000 3.0 3.0
928 O 21.546329000000 12.358129000000 0.000000000000 3.0 3.0
929 O 22.097621000000 10.061079000000 1.479450000000 3.0 3.0
930 O 19.249279000000 12.909421000000 1.479450000000 3.0 3.0
931 Ti 18.376400000000 9.188200000000 2.958900000000 6.0 6.0
932 Ti 20.673450000000 11.485250000000 4.438350000000 6.0 6.0
933 O 19.800571000000 10.612371000000 2.958900000000 3.0 3.0
934 O 21.546329000000 12.358129000000 2.958900000000 3.0 3.0
935 O 22.097621000000 10.061079000000 4.438350000000 3.0 3.0
936 O 19.249279000000 12.909421000000 4.438350000000 3.0 3.0
937 Ti 18.376400000000 9.188200000000 5.917800000000 6.0 6.0
938 Ti 20.673450000000 11.485250000000 7.397250000000 6.0 6.0
939 O 19.800571000000 10.612371000000 5.917800000000 3.0 3.0
940 O 21.546329000000 12.358129000000 5.917800000000 3.0 3.0
941 O 22.097621000000 10.061079000000 7.397250000000 3.0 3.0
942 O 19.249279000000 12.909421000000 7.397250000000 3.0 3.0
943 Ti 18.376400000000 9.188200000000 8.876700000000 6.0 6.0
944 Ti 20.673450000000 11.485250000000 10.356150000000 6.0 6.0
945 O 19.800571000000 10.612371000000 8.876700000000 3.0 3.0
946 O 21.546329000000 12.358129000000 8.876700000000 3.0 3.0
947 O 22.097621000000 10.061079000000 10.356150000000 3.0 3.0
948 O 19.249279000000 12.909421000000 10.356150000000 3.0 3.0
949 Ti 18.376400000000 9.188200000000 11.835600000000 6.0 6.0
950 Ti 20.673450000000 11.485250000000 13.315050000000 6.0 6.0
951 O 19.800571000000 10.612371000000 11.835600000000 3.0 3.0
952 O 21.546329000000 12.358129000000 11.835600000000 3.0 3.0
953 O 22.097621000000 10.061079000000 13.315050000000 3.0 3.0
954 O 19.249279000000 12.909421000000 13.315050000000 3.0 3.0
955 Ti 18.376400000000 9.188200000000 14.794500000000 6.0 6.0
956 Ti 20.673450000000 11.485250000000 16.273950000000 6.0 6.0
957 O 19.800571000000 10.612371000000 14.794500000000 3.0 3.0
958 O 21.546329000000 12.358129000000 14.794500000000 3.0 3.0
959 O 22.097621000000 10.061079000000 16.273950000000 3.0 3.0
960 O 19.249279000000 12.909421000000 16.273950000000 3.0 3.0
961 Ti 18.376400000000 9.188200000000 17.753400000000 6.0 6.0
962 Ti 20.673450000000 11.485250000000 19.232850000000 6.0 6.0
963 O 19.800571000000 10.612371000000 17.753400000000 3.0 3.0
964 O 21.546329000000 12.358129000000 17.753400000000 3.0 3.0
965 O 22.097621000000 10.061079000000 19.232850000000 3.0 3.0
966 O 19.249279000000 12.909421000000 19.232850000000 3.0 3.0
967 Ti 18.376400000000 13.782300000000 0.000000000000 6.0 6.0
968 Ti 20.673450000000 16.079350000000 1.479450000000 6.0 6.0
969 O 19.800571000000 15.206471000000 0.000000000000 3.0 3.0
970 O 21.546329000000 16.952229000000 0.000000000000 3.0 3.0
971 O 22.097621000000 14.655179000000 1.479450000000 3.0 3.0
972 O 19.249279000000 17.503521000000 1.479450000000 3.0 3.0
973 Ti 18.376400000000 13.782300000000 2.958900000000 6.0 6.0
974 Ti 20.673450000000 16.079350000000 4.438350000000 6.0 6.0
975 O 19.800571000000 15.206471000000 2.958900000000 3.0 3.0
976 O 21.546329000000 16.952229000000 2.958900000000 3.0 3.0
977 O 22.097621000000 14.655179000000 4.438350000000 3.0 3.0
978 O 19.249279000000 17.503521000000 4.438350000000 3.0 3.0
979 Ti 18.376400000000 13.782300000000 5.917800000000 6.0 6.0
980 Ti 20.673450000000 16.079350000000 7.397250000000 6.0 6.0
981 O 19.800571000000 15.206471000000 5.917800000000 3.0 3.0
982 O 21.546329000000 16.952229000000 5.917800000000 3.0 3.0
983 O 22.097621000000 14.655179000000 7.397250000000 3.0 3.0
984 O 19.249279000000 17.503521000000 7.397250000000 3.0 3.0
985 Ti 18.376400000000 13.782300000000 8.876700000000 6.0 6.0
986 Ti 20.673450000000 16.079350000000 10.356150000000 6.0 6.0
987 O 19.800571000000 15.206471000000 8.876700000000 3.0 3.0
988 O 21.546329000000 16.952229000000 8.876700000000 3.0 3.0
989 O 22.097621000000 14.655179000000 10.356150000000 3.0 3.0
990 O 19.249279000000 17.503521000000 10.356150000000 3.0 3.0
991 Ti 18.376400000000 13.782300000000 11.835600000000 6.0 6.0
992 Ti 20.673450000000 16.079350000000 13.315050000000 6.0 6.0
993 O 19.800571000000 15.206471000000 11.835600000000 3.0 3.0
994 O 21.546329000000 16.952229000000 11.835600000000 3.0 3.0
995 O 22.097621000000 14.655179000000 13.315050000000 3.0 3.0
996 O 19.249279000000 17.503521000000 13.315050000000 3.0 3.0
997 Ti 18.376400000000 13.782300000000 14.794500000000 6.0 6.0
998 Ti 20.673450000000 16.079350000000 16.273950000000 6.0 6.0
999 O 19.800571000000 15.206471000000 14.794500000000 3.0 3.0
1000 O 21.546329000000 16.952229000000 14.794500000000 3.0 3.0
1001 O 22.097621000000 14.655179000000 16.273950000000 3.0 3.0
1002 O 19.249279000000 17.503521000000 16.273950000000 3.0 3.0
1003 Ti 18.376400000000 13.782300000000 17.753400000000 6.0 6.0
1004 Ti 20.673450000000 16.079350000000 19.232850000000 6.0 6.0
1005 O 19.800571000000 15.206471000000 17.753400000000 3.0 3.0
1006 O 21.546329000000 16.952229000000 17.753400000000 3.0 3.0
1007 O 22.097621000000 14.655179000000 19.232850000000 3.0 3.0
1008 O 19.249279000000 17.503521000000 19.232850000000 3.0 3.0
1009 Ti 18.376400000000 18.376400000000 0.000000000000 6.0 6.0
1010 Ti 20.673450000000 20.673450000000 1.479450000000 6.0 6.0
1011 O 19.800571000000 19.800571000000 0.000000000000 3.0 3.0
1012 O 21.546329000000 21.546329000000 0.000000000000 3.0 3.0
1013 O 22.097621000000 19.249279000000 1.479450000000 3.0 3.0
1014 O 19.249279000000 22.097621000000 1.479450000000 3.0 3.0
1015 Ti 18.376400000000 18.376400000000 2.958900000000 6.0 6.0
1016 Ti 20.673450000000 20.673450000000 4.438350000000 6.0 6.0
1017 O 19.800571000000 19.800571000000 2.958900000000 3.0 3.0
1018 O 21.546329000000 21.546329000000 2.958900000000 3.0 3.0
1019 O 22.097621000000 19.249279000000 4.438350000000 3.0 3.0
1020 O 19.249279000000 22.097621000000 4.438350000000 3.0 3.0
1021 Ti 18.376400000000 18.376400000000 5.917800000000 6.0 6.0
1022 Ti 20.673450000000 20.673450000000 7.397250000000 6.0 6.0
1023 O 19.800571000000 19.800571000000 5.917800000000 3.0 3.0
1024 O 21.546329000000 21.546329000000 5.917800000000 3.0 3.0
1025 O 22.097621000000 19.249279000000 7.397250000000 3.0 3.0
1026 O 19.249279000000 22.097621000000 7.397250000000 3.0 3.0
1027 Ti 18.376400000000 18.376400000000 8.876700000000 6.0 6.0
1028 Ti 20.673450000000 20.673450000000 10.356150000000 6.0 6.0
1029 O 19.800571000000 19.800571000000 8.876700000000 3.0 3.0
1030 O 21.546329000000 21.546329000000 8.876700000000 3.0 3.0
1031 O 22.097621000000 19.249279000000 10.356150000000 3.0 3.0
1032 O 19.249279000000 22.097621000000 10.356150000000 3.0 3.0
1033 Ti 18.376400000000 18.376400000000 11.835600000000 6.0 6.0
1034 Ti 20.673450000000 20.673450000000 13.315050000000 6.0 6.0
1035 O 19.800571000000 19.800571000000 11.835600000000 3.0 3.0
1036 O 21.546329000000 21.546329000000 11.835600000000 3.0 3.0
1037 O 22.097621000000 19.249279000000 13.315050000000 3.0 3.0
1038 O 19.249279000000 22.097621000000 13.315050000000 3.0 3.0
1039 Ti 18.376400000000 18.376400000000 14.794500000000 6.0 6.0
1040 Ti 20.673450000000 20.673450000000 16.273950000000 6.0 6.0
1041 O 19.800571000000 19.800571000000 14.794500000000 3.0 3.0
1042 O 21.546329000000 21.546329000000 14.794500000000 3.0 3.0
1043 O 22.097621000000 19.249279000000 16.273950000000 3.0 3.0
1044 O 19.249279000000 22.097621000000 16.273950000000 3.0 3.0
1045 Ti 18.376400000000 18.376400000000 17.753400000000 6.0 6.0
1046 Ti 20.673450000000 20.673450000000 19.232850000000 6.0 6.0
1047 O 19.800571000000 19.800571000000 17.753400000000 3.0 3.0
1048 O 21.546329000000 21.546329000000 17.753400000000 3.0 3.0
1049 O 22.097621000000 19.249279000000 19.232850000000 3.0 3.0
1050 O 19.249279000000 22.097621000000 19.232850000000 3.0 3.0
Atoms.SpeciesAndCoordinates>
Atoms.UnitVectors.Unit Ang # Ang|AU
<Atoms.UnitVectors # unit=Ang.
22.970500000000 0.000000000000 0.000000000000
0.000000000000 22.970500000000 0.000000000000
0.000000000000 0.000000000000 20.712300000000
Atoms.UnitVectors>
#
# SCF or Electronic System
#
scf.XcType GGA-PBE # LDA|LSDA-CA|LSDA-PW
scf.SpinPolarization off # On|Off
scf.ElectronicTemperature 300.0 # default=300 (K)
scf.energycutoff 180.0 # default=150 (Ry)
scf.ProExpn.VNA on # default=on
scf.maxIter 300 # default=40
scf.EigenvalueSolver cluster # Recursion|Cluster|Band
scf.Kgrid 1 1 1 # means 4x4x4
scf.Mixing.Type rmm-diisk # Simple|Rmm-Diis|Gr-Pulay
scf.Init.Mixing.Weight 0.010 # default=0.30
scf.Min.Mixing.Weight 0.001 # default=0.001
scf.Max.Mixing.Weight 0.200 # default=0.40
scf.Mixing.History 30 # default=5
scf.Mixing.StartPulay 15 # default=6
scf.criterion 1.0e-10 # default=1.0e-6 (Hartree)
#
# MD or Geometry Optimization
#
MD.Type nomd # Nomd|Opt|DIIS|NVE|NVT_VS|NVT_NH
MD.maxIter 1 # default=1
MD.TimeStep 0.5 # default=0.5 (fs)
MD.Opt.criterion 1.0e-4 # default=1.0e-4 (Hartree/bohr)
***********************************************************
***********************************************************
Required cutoff energy (Ryd) for 3D-grids = 180.0000
Used cutoff energy (Ryd) for 3D-grids = 187.1047, 187.1047, 181.8293
Num. of grids of a-, b-, and c-axes = 189, 189, 168
Num.Grid1. 189
Num.Grid2. 189
Num.Grid3. 168
Cell_Volume = 73750.629635380552 (Bohr^3)
GridVol = 0.012289461187 (Bohr^3)
Cell vectors (bohr) of the grid cell (gtv)
gtv_a = 0.229671697464, 0.000000000000, 0.000000000000
gtv_b = 0.000000000000, 0.229671697464, 0.000000000000
gtv_c = 0.000000000000, 0.000000000000, 0.232979592817
|gtv_a| = 0.229671697464
|gtv_b| = 0.229671697464
|gtv_c| = 0.232979592817
***********************************************************
***********************************************************
***********************************************************
***********************************************************
SCF history at MD= 1
***********************************************************
***********************************************************
SCF= 1 NormRD= 1.000000000000 Uele= -7915.617990969126
SCF= 2 NormRD= 44.474326295948 Uele= -7912.410818851042
SCF= 3 NormRD= 44.343827035824 Uele= -7912.092997703011
SCF= 4 NormRD= 19.899796919530 Uele= -7868.360912677754
SCF= 5 NormRD= 6.376954548665 Uele= -7857.822765619998
SCF= 6 NormRD= 4.927670383962 Uele= -7845.487769846395
SCF= 7 NormRD= 3.982379163329 Uele= -7833.392188754894
SCF= 8 NormRD= 3.207072488147 Uele= -7824.281433218786
SCF= 9 NormRD= 2.583487253369 Uele= -7817.429317687771
SCF= 10 NormRD= 2.081594170786 Uele= -7812.220810499888
SCF= 11 NormRD= 1.677408436954 Uele= -7808.222086929622
SCF= 12 NormRD= 1.351801331157 Uele= -7805.124574258192
SCF= 13 NormRD= 1.089450355633 Uele= -7802.706155390317
SCF= 14 NormRD= 0.878048151417 Uele= -7800.804969068722
SCF= 15 NormRD= 0.707693263449 Uele= -7799.301606325025
SCF= 16 NormRD= 0.014594913156 Uele= -7793.289358770387
SCF= 17 NormRD= 0.003086345255 Uele= -7793.187810168210
SCF= 18 NormRD= 0.002720665263 Uele= -7793.195796034717
SCF= 19 NormRD= 0.000579828439 Uele= -7793.189045372274
SCF= 20 NormRD= 0.000141277295 Uele= -7793.190374651658
SCF= 21 NormRD= 0.000220828581 Uele= -7793.190269666700
SCF= 22 NormRD= 0.000024659549 Uele= -7793.190081796480
SCF= 23 NormRD= 0.000005721938 Uele= -7793.190074921866
SCF= 24 NormRD= 0.000008035833 Uele= -7793.190069192409
SCF= 25 NormRD= 0.000001593085 Uele= -7793.190066656446
SCF= 26 NormRD= 0.000000266415 Uele= -7793.190066538362
SCF= 27 NormRD= 0.000000417681 Uele= -7793.190066508640
SCF= 28 NormRD= 0.000000142980 Uele= -7793.190066505582
SCF= 29 NormRD= 0.000000056443 Uele= -7793.190066511515
SCF= 30 NormRD= 0.000000041071 Uele= -7793.190066518649
SCF= 31 NormRD= 0.000000035756 Uele= -7793.190066523886
SCF= 32 NormRD= 0.000000033061 Uele= -7793.190066527621
SCF= 33 NormRD= 0.000000032098 Uele= -7793.190066529102
SCF= 34 NormRD= 0.000000030249 Uele= -7793.190066529812
SCF= 35 NormRD= 0.000000030085 Uele= -7793.190066530078
SCF= 36 NormRD= 0.000000028889 Uele= -7793.190066530502
SCF= 37 NormRD= 0.000000029473 Uele= -7793.190066530849
SCF= 38 NormRD= 0.000000029074 Uele= -7793.190066531139
SCF= 39 NormRD= 0.000000028879 Uele= -7793.190066531481
SCF= 40 NormRD= 0.000000028296 Uele= -7793.190066531890
SCF= 41 NormRD= 0.000000028204 Uele= -7793.190066532153
SCF= 42 NormRD= 0.000000027616 Uele= -7793.190066532284
SCF= 43 NormRD= 0.000000027923 Uele= -7793.190066532396
SCF= 44 NormRD= 0.000000027739 Uele= -7793.190066532637
SCF= 45 NormRD= 0.000000027362 Uele= -7793.190066556920
SCF= 46 NormRD= 0.000000027409 Uele= -7793.190066555407
SCF= 47 NormRD= 0.000000027490 Uele= -7793.190066546271
SCF= 48 NormRD= 0.000000027184 Uele= -7793.190066545663
SCF= 49 NormRD= 0.000000027482 Uele= -7793.190066508302
SCF= 50 NormRD= 0.000000028261 Uele= -7793.190066545999
SCF= 51 NormRD= 0.000000029959 Uele= -7793.190066558639
SCF= 52 NormRD= 0.000000029646 Uele= -7793.190066552665
SCF= 53 NormRD= 0.000000028639 Uele= -7793.190066548632
SCF= 54 NormRD= 0.000000028936 Uele= -7793.190066546331
SCF= 55 NormRD= 0.000000029796 Uele= -7793.190066544053
SCF= 56 NormRD= 0.000000030712 Uele= -7793.190066534154
SCF= 57 NormRD= 0.000000030702 Uele= -7793.190066536026
SCF= 58 NormRD= 0.000000029368 Uele= -7793.190066538956
SCF= 59 NormRD= 0.000000030759 Uele= -7793.190066539215
SCF= 60 NormRD= 0.000000030653 Uele= -7793.190066537582
SCF= 61 NormRD= 0.000000029138 Uele= -7793.190066537995
SCF= 62 NormRD= 0.000000028947 Uele= -7793.190066538291
SCF= 63 NormRD= 0.000000029189 Uele= -7793.190066538869
SCF= 64 NormRD= 0.000000028689 Uele= -7793.190066539209
SCF= 65 NormRD= 0.000000028943 Uele= -7793.190066539160
*******************************************************
Total energy (Hartree) at MD = 1
*******************************************************
Uele. -7793.190066539160
Ukin. 16393.074070577881
UH0. -425611.344500243897
UH1. 18.971586925003
Una. -22040.684436869291
Unl. 4438.232462174900
Uxc0. -2866.410905131038
Uxc1. -2866.410905131038
Ucore. 400317.384481673944
Uhub. 0.000000000000
Ucs. 0.000000000000
Uzs. 0.000000000000
Uzo. 0.000000000000
Uef. 0.000000000000
UvdW 0.000000000000
Utot. -32217.188146023535
Note:
Utot = Ukin+UH0+UH1+Una+Unl+Uxc0+Uxc1+Ucore+Uhub+Ucs+Uzs+Uzo+Uef+UvdW
Uene: band energy
Ukin: kinetic energy
UH0: electric part of screened Coulomb energy
UH1: difference electron-electron Coulomb energy
Una: neutral atom potential energy
Unl: non-local potential energy
Uxc0: exchange-correlation energy for alpha spin
Uxc1: exchange-correlation energy for beta spin
Ucore: core-core Coulomb energy
Uhub: LDA+U energy
Ucs: constraint energy for spin orientation
Uzs: Zeeman term for spin magnetic moment
Uzo: Zeeman term for orbital magnetic moment
Uef: electric energy by electric field
UvdW: semi-empirical vdW energy
(see also PRB 72, 045121(2005) for the energy contributions)
Chemical potential (Hartree) -0.263671875000
***********************************************************
***********************************************************
Eigenvalues (Hartree) for SCF KS-eq.
***********************************************************
***********************************************************
Chemical Potential (Hartree) = -0.26367187500000
Number of States = 8400.00000000000000
HOMO = 4200
Eigenvalues
Up-spin Down-spin
1 -2.38587136402759 -2.38587136402759
2 -2.38581560314223 -2.38581560314223
3 -2.38581545601168 -2.38581545601168
4 -2.38581535387877 -2.38581535387877
5 -2.38581428419476 -2.38581428419476
6 -2.38576791717848 -2.38576791717848
7 -2.38576764971781 -2.38576764971781
8 -2.38576764732146 -2.38576764732146
9 -2.38576698721002 -2.38576698721002
10 -2.38566262238810 -2.38566262238810
11 -2.38566241354297 -2.38566241354297
12 -2.38566239692393 -2.38566239692393
13 -2.38566221605898 -2.38566221605898
14 -2.38565084624231 -2.38565084624231
15 -2.38565075679788 -2.38565075679788
16 -2.38565051135618 -2.38565051135618
17 -2.38565015309441 -2.38565015309441
18 -2.38565011768588 -2.38565011768588
19 -2.38564993540262 -2.38564993540262
20 -2.38564966987543 -2.38564966987543
21 -2.38564964851027 -2.38564964851027
22 -2.38560764259489 -2.38560764259489
23 -2.38560760916331 -2.38560760916331
24 -2.38560699509441 -2.38560699509441
25 -2.38560692619642 -2.38560692619642
26 -2.38555189619741 -2.38555189619741
27 -2.38555182037223 -2.38555182037223
28 -2.38555117962259 -2.38555117962259
29 -2.38555112968269 -2.38555112968269
30 -2.38551895602478 -2.38551895602478
31 -2.38551895601829 -2.38551895601829
32 -2.38550599932727 -2.38550599932727
33 -2.38550597912848 -2.38550597912848
34 -2.38550572440130 -2.38550572440130
35 -2.38550554926242 -2.38550554926242
36 -2.38550513426077 -2.38550513426077
37 -2.38550510965969 -2.38550510965969
38 -2.38550489244626 -2.38550489244626
39 -2.38550486173101 -2.38550486173101
40 -2.38548052966208 -2.38548052966208
41 -2.38548035245444 -2.38548035245444
42 -2.38548034218339 -2.38548034218339
43 -2.38548018203639 -2.38548018203639
44 -2.38546426567268 -2.38546426567268
45 -2.38546426564896 -2.38546426564896
46 -2.38546411550748 -2.38546411550748
47 -2.38546411548635 -2.38546411548635
48 -2.38546401405793 -2.38546401405793
49 -2.38546401403924 -2.38546401403924
50 -2.38546294512930 -2.38546294512930
51 -2.38546294510942 -2.38546294510942
52 -2.38542415700669 -2.38542415700669
53 -2.38542415699922 -2.38542415699922
54 -2.38542387788658 -2.38542387788658
55 -2.38542387787968 -2.38542387787968
56 -2.38542387174769 -2.38542387174769
57 -2.38542387173565 -2.38542387173565
58 -2.38542321375467 -2.38542321375467
59 -2.38542321374675 -2.38542321374675
60 -2.38539021734883 -2.38539021734883
61 -2.38539003653276 -2.38539003653276
62 -2.38539001939716 -2.38539001939716
63 -2.38538950234409 -2.38538950234409
64 -2.38534515686241 -2.38534515686241
65 -2.38534486969421 -2.38534486969421
66 -2.38534475610727 -2.38534475610727
67 -2.38534376417231 -2.38534376417231
68 -2.38532366301333 -2.38532366301333
69 -2.38532366299469 -2.38532366299469
70 -2.38532344523434 -2.38532344523434
71 -2.38532344518920 -2.38532344518920
72 -2.38532343804436 -2.38532343804436
73 -2.38532343801174 -2.38532343801174
74 -2.38532325199498 -2.38532325199498
75 -2.38532325197533 -2.38532325197533
76 -2.38531622339839 -2.38531622339839
77 -2.38531622317603 -2.38531622317603
78 -2.38531609930523 -2.38531609930523
79 -2.38531609926165 -2.38531609926165
80 -2.38531586173722 -2.38531586173722
81 -2.38531586171312 -2.38531586171312
82 -2.38531548892428 -2.38531548892428
83 -2.38531548887457 -2.38531548887457
84 -2.38531538650465 -2.38531538650465
85 -2.38531538640003 -2.38531538640003
86 -2.38531520012015 -2.38531520012015
87 -2.38531520006261 -2.38531520006261
88 -2.38531492927358 -2.38531492927358
89 -2.38531492919673 -2.38531492919673
90 -2.38531488894480 -2.38531488894480
91 -2.38531488878649 -2.38531488878649
92 -2.38529599008231 -2.38529599008231
93 -2.38528234671514 -2.38528234671514
94 -2.38528234669860 -2.38528234669860
95 -2.38528230600086 -2.38528230600086
96 -2.38528230597944 -2.38528230597944
97 -2.38528177477654 -2.38528177477654
98 -2.38528177477297 -2.38528177477297
99 -2.38528170367492 -2.38528170367492
100 -2.38528170364388 -2.38528170364388
101 -2.38522639403540 -2.38522639403540
102 -2.38522639401798 -2.38522639401798
103 -2.38522632538360 -2.38522632538360
104 -2.38522632537566 -2.38522632537566
105 -2.38522561174184 -2.38522561174184
106 -2.38522561171394 -2.38522561171394
107 -2.38522555748481 -2.38522555748481
108 -2.38522555746329 -2.38522555746329
109 -2.38518213861914 -2.38518213861914
110 -2.38518213860119 -2.38518213860119
111 -2.38518212020844 -2.38518212020844
112 -2.38518212020685 -2.38518212020685
113 -2.38518187153569 -2.38518187153569
114 -2.38518187151814 -2.38518187151814
115 -2.38518171620487 -2.38518171620487
116 -2.38518171618821 -2.38518171618821
117 -2.38518131099338 -2.38518131099338
118 -2.38518131097860 -2.38518131097860
119 -2.38518129773301 -2.38518129773301
120 -2.38518129771007 -2.38518129771007
121 -2.38518108783342 -2.38518108783342
122 -2.38518108778186 -2.38518108778186
123 -2.38518105349200 -2.38518105349200
124 -2.38518105342992 -2.38518105342992
125 -2.38516148984858 -2.38516148984858
126 -2.38516148982522 -2.38516148982522
127 -2.38516130919935 -2.38516130919935
128 -2.38516130917566 -2.38516130917566
129 -2.38516129440372 -2.38516129440372
130 -2.38516129438832 -2.38516129438832
131 -2.38516112620500 -2.38516112620500
132 -2.38516112619579 -2.38516112619579
133 -2.38507979926223 -2.38507979926223
134 -2.38507979923999 -2.38507979923999
135 -2.38507962993424 -2.38507962993424
136 -2.38507962990664 -2.38507962990664
137 -2.38507961558981 -2.38507961558981
138 -2.38507961557145 -2.38507961557145
139 -2.38507909179976 -2.38507909179976
140 -2.38507909178619 -2.38507909178619
141 -2.38503776579720 -2.38503776579720
142 -2.38503776578260 -2.38503776578260
143 -2.38503746549100 -2.38503746549100
144 -2.38503746548537 -2.38503746548537
145 -2.38503735221031 -2.38503735221031
146 -2.38503735220099 -2.38503735220099
147 -2.38503635472208 -2.38503635472208
148 -2.38503635470770 -2.38503635470770
149 -2.38499077703676 -2.38499077703676
150 -2.38499077703071 -2.38499077703071
151 -2.38477590984511 -2.38477590984511
152 -2.38477590984107 -2.38477590984107
153 -2.38474322597737 -2.38474322597737
154 -2.38474322593592 -2.38474322593592
155 -2.38474308339668 -2.38474308339668
156 -2.38474308338361 -2.38474308338361
157 -2.38474297894645 -2.38474297894645
158 -2.38474297893060 -2.38474297893060
159 -2.38474186820389 -2.38474186820389
160 -2.38474186817716 -2.38474186817716
161 -2.38471771360094 -2.38471771360094
162 -2.38471771356865 -2.38471771356865
163 -2.38471739567661 -2.38471739567661
164 -2.38471739564535 -2.38471739564535
165 -2.38471739093951 -2.38471739093951
166 -2.38471739092412 -2.38471739092412
167 -2.38471670444881 -2.38471670444881
168 -2.38471670441738 -2.38471670441738
169 -2.38464606803324 -2.38464606803324
170 -2.38464606802671 -2.38464606802671
171 -2.38464584458330 -2.38464584458330
172 -2.38464584454555 -2.38464584454555
173 -2.38464584433473 -2.38464584433473
174 -2.38464584432915 -2.38464584432915
175 -2.38464565448325 -2.38464565448325
176 -2.38464565443497 -2.38464565443497
177 -2.38464040849554 -2.38464040849554
178 -2.38464040846593 -2.38464040846593
179 -2.38464024963810 -2.38464024963810
180 -2.38464024959612 -2.38464024959612
181 -2.38464003222546 -2.38464003222546
182 -2.38464003220432 -2.38464003220432
183 -2.38463964731694 -2.38463964731694
184 -2.38463964728726 -2.38463964728726
185 -2.38463948945866 -2.38463948945866
186 -2.38463948944747 -2.38463948944747
187 -2.38463930270008 -2.38463930270008
188 -2.38463930268515 -2.38463930268515
189 -2.38463903555625 -2.38463903555625
190 -2.38463903551750 -2.38463903551750
191 -2.38463898328782 -2.38463898328782
192 -2.38463898324121 -2.38463898324121
193 -2.38461768729955 -2.38461768729955
194 -2.38461768728164 -2.38461768728164
195 -2.38461764146079 -2.38461764146079
196 -2.38461764143087 -2.38461764143087
197 -2.38461717573705 -2.38461717573705
198 -2.38461717570072 -2.38461717570072
199 -2.38461710289737 -2.38461710289737
200 -2.38461710287919 -2.38461710287919
201 -2.38457446908708 -2.38457446908708
202 -2.38457446908071 -2.38457446908071
203 -2.38457440271562 -2.38457440271562
204 -2.38457440270001 -2.38457440270001
205 -2.38457363615107 -2.38457363615107
206 -2.38457363613175 -2.38457363613175
207 -2.38457357635727 -2.38457357635727
208 -2.38457357634288 -2.38457357634288
209 -2.38454145618040 -2.38454145618040
210 -2.38454145615732 -2.38454145615732
211 -2.38454142616381 -2.38454142616381
212 -2.38454142611492 -2.38454142611492
213 -2.38454120326719 -2.38454120326719
214 -2.38454120321999 -2.38454120321999
215 -2.38454113758598 -2.38454113758598
216 -2.38454113755431 -2.38454113755431
217 -2.38454067263710 -2.38454067263710
218 -2.38454067259146 -2.38454067259146
219 -2.38454066159348 -2.38454066159348
220 -2.38454066156770 -2.38454066156770
221 -2.38454049745516 -2.38454049745516
222 -2.38454049742234 -2.38454049742234
223 -2.38454042160361 -2.38454042160361
224 -2.38454042156027 -2.38454042156027
225 -2.38453205582910 -2.38453205582910
226 -2.38453205581696 -2.38453205581696
227 -2.38453188611630 -2.38453188611630
228 -2.38453188609474 -2.38453188609474
229 -2.38453184862569 -2.38453184862569
230 -2.38453184861433 -2.38453184861433
231 -2.38453167992400 -2.38453167992400
232 -2.38453167989540 -2.38453167989540
233 -2.38447096655044 -2.38447096655044
234 -2.38447096652578 -2.38447096652578
235 -2.38447084482423 -2.38447084482423
236 -2.38447084479838 -2.38447084479838
237 -2.38447083530574 -2.38447083530574
238 -2.38447083527132 -2.38447083527132
239 -2.38447031349165 -2.38447031349165
240 -2.38447031347577 -2.38447031347577
241 -2.38444310025833 -2.38444310025833
242 -2.38444310024057 -2.38444310024057
243 -2.38444276511950 -2.38444276511950
244 -2.38444276508627 -2.38444276508627
245 -2.38444265298112 -2.38444265298112
246 -2.38444265296881 -2.38444265296881
247 -2.38444166517877 -2.38444166517877
248 -2.38444166515413 -2.38444166515413
249 -2.38440696795631 -2.38440696795631
250 -2.38440696794979 -2.38440696794979
251 -2.38421328983712 -2.38421328983712
252 -2.38421328981680 -2.38421328981680
253 -2.38420207471924 -2.38420207471924
254 -2.38420207468285 -2.38420207468285
255 -2.38420201933553 -2.38420201933553
256 -2.38420201932971 -2.38420201932971
257 -2.38420197115739 -2.38420197115739
258 -2.38420197114182 -2.38420197114182
259 -2.38420085865589 -2.38420085865589
260 -2.38420085861924 -2.38420085861924
261 -2.38419405181317 -2.38419405181317
262 -2.38419405179725 -2.38419405179725
263 -2.38419354070494 -2.38419354070494
264 -2.38419354066410 -2.38419354066410
265 -2.38419353474453 -2.38419353474453
266 -2.38419353472892 -2.38419353472892
267 -2.38419263892512 -2.38419263892512
268 -2.38419263889570 -2.38419263889570
269 -2.38417111671976 -2.38417111671976
270 -2.38417111671833 -2.38417111671833
271 -2.38417089238364 -2.38417089238364
272 -2.38417089236320 -2.38417089236320
273 -2.38417088483072 -2.38417088483072
274 -2.38417088479039 -2.38417088479039
275 -2.38417068414179 -2.38417068414179
276 -2.38417068411527 -2.38417068411527
277 -2.38416740749857 -2.38416740749857
278 -2.38416740745187 -2.38416740745187
279 -2.38416718689620 -2.38416718689620
280 -2.38416718685903 -2.38416718685903
281 -2.38416701176426 -2.38416701176426
282 -2.38416701175603 -2.38416701175603
283 -2.38416660332017 -2.38416660332017
284 -2.38416660327767 -2.38416660327767
285 -2.38416631657884 -2.38416631657884
286 -2.38416631656286 -2.38416631656286
287 -2.38416612531970 -2.38416612531970
288 -2.38416612530237 -2.38416612530237
289 -2.38416586639001 -2.38416586639001
290 -2.38416586636454 -2.38416586636454
291 -2.38416579003421 -2.38416579003421
292 -2.38416579001308 -2.38416579001308
293 -2.38415451629888 -2.38415451629888
294 -2.38415451626901 -2.38415451626901
295 -2.38415446696798 -2.38415446696798
296 -2.38415446694348 -2.38415446694348
297 -2.38415421847518 -2.38415421847518
298 -2.38415421844534 -2.38415421844534
299 -2.38415414844574 -2.38415414844574
300 -2.38415414842369 -2.38415414842369
301 -2.38413888298255 -2.38413888298255
302 -2.38413888294266 -2.38413888294266
303 -2.38413881517479 -2.38413881517479
304 -2.38413881516198 -2.38413881516198
305 -2.38413788873022 -2.38413788873022
306 -2.38413788870554 -2.38413788870554
307 -2.38413782898065 -2.38413782898065
308 -2.38413782894397 -2.38413782894397
309 -2.38413249275529 -2.38413249275529
310 -2.38413249274948 -2.38413249274948
311 -2.38413234106931 -2.38413234106931
312 -2.38413234101876 -2.38413234101876
313 -2.38413219574253 -2.38413219574253
314 -2.38413219571501 -2.38413219571501
315 -2.38413191550681 -2.38413191550681
316 -2.38413191548739 -2.38413191548739
317 -2.38413121748425 -2.38413121748425
318 -2.38413121741174 -2.38413121741174
319 -2.38413083446353 -2.38413083446353
320 -2.38413083446158 -2.38413083446158
321 -2.38413059763353 -2.38413059763353
322 -2.38413059762061 -2.38413059762061
323 -2.38413022038622 -2.38413022038622
324 -2.38413022036828 -2.38413022036828
325 -2.38412925161010 -2.38412925161010
326 -2.38412925157162 -2.38412925157162
327 -2.38412901048508 -2.38412901048508
328 -2.38412901043291 -2.38412901043291
329 -2.38412880209608 -2.38412880209608
330 -2.38412880208155 -2.38412880208155
331 -2.38412866035081 -2.38412866035081
332 -2.38412866033568 -2.38412866033568
333 -2.38410435969654 -2.38410435969654
334 -2.38410435967803 -2.38410435967803
335 -2.38410434906660 -2.38410434906660
336 -2.38410434904132 -2.38410434904132
337 -2.38410429799767 -2.38410429799767
338 -2.38410429795919 -2.38410429795919
339 -2.38410393407951 -2.38410393407951
340 -2.38410393406632 -2.38410393406632
341 -2.38409473641895 -2.38409473641895
342 -2.38409473639638 -2.38409473639638
343 -2.38409423327143 -2.38409423327143
344 -2.38409423325720 -2.38409423325720
345 -2.38409411651766 -2.38409411651766
346 -2.38409411647501 -2.38409411647501
347 -2.38409326700825 -2.38409326700825
348 -2.38409326699919 -2.38409326699919
349 -2.38407955592946 -2.38407955592946
350 -2.38407955591520 -2.38407955591520
351 -1.52697242333842 -1.52697242333842
352 -1.52697242332333 -1.52697242332333
353 -1.52697227046659 -1.52697227046659
354 -1.52697227046232 -1.52697227046232
355 -1.52697220550935 -1.52697220550935
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5567 -0.06844666682558 -0.06844666682558
5568 -0.06708105658726 -0.06708105658726
5569 -0.06708105653942 -0.06708105653942
5570 -0.06708103899893 -0.06708103899893
5571 -0.06708103896008 -0.06708103896008
5572 -0.06707952946091 -0.06707952946091
5573 -0.06707952943065 -0.06707952943065
5574 -0.06707942684736 -0.06707942684736
5575 -0.06707942681236 -0.06707942681236
5576 -0.06663856671387 -0.06663856671387
5577 -0.06663856663590 -0.06663856663590
5578 -0.06663849751365 -0.06663849751365
5579 -0.06663849740369 -0.06663849740369
5580 -0.06663840712198 -0.06663840712198
5581 -0.06663840706057 -0.06663840706057
5582 -0.06663827837896 -0.06663827837896
5583 -0.06663827834083 -0.06663827834083
5584 -0.06587986536077 -0.06587986536077
5585 -0.06587986534011 -0.06587986534011
5586 -0.06587980534734 -0.06587980534734
5587 -0.06587980532900 -0.06587980532900
5588 -0.06357741287310 -0.06357741287310
5589 -0.06357741279613 -0.06357741279613
5590 -0.06357740897296 -0.06357740897296
5591 -0.06357740881668 -0.06357740881668
5592 -0.06357646055970 -0.06357646055970
5593 -0.06357646049592 -0.06357646049592
5594 -0.06357638175479 -0.06357638175479
5595 -0.06357638163622 -0.06357638163622
5596 -0.06341126817019 -0.06341126817019
5597 -0.06341126814157 -0.06341126814157
5598 -0.06341124672179 -0.06341124672179
5599 -0.06341124663032 -0.06341124663032
5600 -0.06341112981821 -0.06341112981821
5601 -0.06341112979003 -0.06341112979003
5602 -0.06341103182889 -0.06341103182889
5603 -0.06341103180556 -0.06341103180556
5604 -0.06294351099463 -0.06294351099463
5605 -0.06294351097199 -0.06294351097199
5606 -0.06294346385743 -0.06294346385743
5607 -0.06294346384279 -0.06294346384279
5608 -0.06176447351062 -0.06176447351062
5609 -0.06176447345341 -0.06176447345341
5610 -0.06175942648282 -0.06175942648282
5611 -0.06175942638465 -0.06175942638465
5612 -0.06175935308574 -0.06175935308574
5613 -0.06175935300344 -0.06175935300344
5614 -0.06175459906207 -0.06175459906207
5615 -0.06175459903094 -0.06175459903094
5616 -0.06155267859569 -0.06155267859569
5617 -0.06155267855854 -0.06155267855854
5618 -0.06099625305207 -0.06099625305207
5619 -0.06099625298044 -0.06099625298044
5620 -0.06099401588057 -0.06099401588057
5621 -0.06099401578150 -0.06099401578150
5622 -0.06099397791023 -0.06099397791023
5623 -0.06099397778730 -0.06099397778730
5624 -0.06099222181832 -0.06099222181832
5625 -0.06099222177506 -0.06099222177506
5626 -0.05780469322144 -0.05780469322144
5627 -0.05780444959555 -0.05780444959555
5628 -0.05780430295186 -0.05780430295186
5629 -0.05780391533948 -0.05780391533948
5630 -0.05780008014616 -0.05780008014616
5631 -0.05779972039195 -0.05779972039195
5632 -0.05779956221480 -0.05779956221480
5633 -0.05779924167781 -0.05779924167781
5634 -0.05598182592133 -0.05598182592133
5635 -0.05598182581020 -0.05598182581020
5636 -0.05598178710933 -0.05598178710933
5637 -0.05598178704305 -0.05598178704305
5638 -0.05598175532072 -0.05598175532072
5639 -0.05598175525213 -0.05598175525213
5640 -0.05598172836906 -0.05598172836906
5641 -0.05598172828079 -0.05598172828079
5642 -0.05564383726403 -0.05564383726403
5643 -0.05564383716779 -0.05564383716779
5644 -0.05563656394201 -0.05563656394201
5645 -0.05563656375896 -0.05563656375896
5646 -0.05563651638110 -0.05563651638110
5647 -0.05563651636393 -0.05563651636393
5648 -0.05562946717182 -0.05562946717182
5649 -0.05562946706735 -0.05562946706735
5650 -0.05558813300383 -0.05558813300383
5651 -0.05558813287318 -0.05558813287318
5652 -0.05558801573170 -0.05558801573170
5653 -0.05558801552337 -0.05558801552337
5654 -0.05558789739133 -0.05558789739133
5655 -0.05558789728160 -0.05558789728160
5656 -0.05558778516808 -0.05558778516808
5657 -0.05558778497071 -0.05558778497071
5658 -0.05557751475509 -0.05557751475509
5659 -0.05557751471044 -0.05557751471044
5660 -0.05557737133869 -0.05557737133869
5661 -0.05557737129770 -0.05557737129770
5662 -0.05557727065229 -0.05557727065229
5663 -0.05557727049894 -0.05557727049894
5664 -0.05557713674575 -0.05557713674575
5665 -0.05557713667629 -0.05557713667629
5666 -0.05357224284660 -0.05357224284660
5667 -0.05357224281675 -0.05357224281675
5668 -0.05357219606487 -0.05357219606487
5669 -0.05357219602047 -0.05357219602047
5670 -0.05355977613428 -0.05355977613428
5671 -0.05355977604464 -0.05355977604464
5672 -0.05355970847593 -0.05355970847593
5673 -0.05355970844589 -0.05355970844589
5674 -0.05323594089603 -0.05323594089603
5675 -0.05323594081261 -0.05323594081261
5676 -0.05323581037724 -0.05323581037724
5677 -0.05323581016093 -0.05323581016093
5678 -0.05323575265340 -0.05323575265340
5679 -0.05323575248300 -0.05323575248300
5680 -0.05323560127457 -0.05323560127457
5681 -0.05323560122795 -0.05323560122795
5682 -0.05323242204315 -0.05323242204315
5683 -0.05323242195109 -0.05323242195109
5684 -0.05323225172445 -0.05323225172445
5685 -0.05323225157386 -0.05323225157386
5686 -0.05323215506929 -0.05323215506929
5687 -0.05323215491495 -0.05323215491495
5688 -0.05323201664733 -0.05323201664733
5689 -0.05323201656960 -0.05323201656960
5690 -0.05310144526473 -0.05310144526473
5691 -0.05310144522415 -0.05310144522415
5692 -0.05309858397207 -0.05309858397207
5693 -0.05309858393637 -0.05309858393637
5694 -0.05309857640804 -0.05309857640804
5695 -0.05309857632356 -0.05309857632356
5696 -0.05309658911967 -0.05309658911967
5697 -0.05309658902310 -0.05309658902310
5698 -0.05130346408887 -0.05130346408887
5699 -0.05130314289222 -0.05130314289222
5700 -0.05130310090696 -0.05130310090696
5701 -0.05130284787964 -0.05130284787964
5702 -0.05129677319866 -0.05129677319866
5703 -0.05129677296502 -0.05129677296502
5704 -0.05129669861061 -0.05129669861061
5705 -0.05129669855926 -0.05129669855926
5706 -0.05128980372511 -0.05128980372511
5707 -0.05128980369364 -0.05128980369364
5708 -0.05128977820234 -0.05128977820234
5709 -0.05128977813730 -0.05128977813730
5710 -0.05124524540236 -0.05124524540236
5711 -0.05124524529815 -0.05124524529815
5712 -0.05124521894033 -0.05124521894033
5713 -0.05124521879218 -0.05124521879218
5714 -0.05124517649811 -0.05124517649811
5715 -0.05124517634105 -0.05124517634105
5716 -0.05124510954045 -0.05124510954045
5717 -0.05124510952805 -0.05124510952805
5718 -0.05039140178030 -0.05039140178030
5719 -0.05039140159909 -0.05039140159909
5720 -0.05039132808521 -0.05039132808521
5721 -0.05039132802345 -0.05039132802345
5722 -0.05039123032789 -0.05039123032789
5723 -0.05039123026346 -0.05039123026346
5724 -0.05039116923464 -0.05039116923464
5725 -0.05039116908629 -0.05039116908629
5726 -0.05037628703356 -0.05037628703356
5727 -0.05037628692713 -0.05037628692713
5728 -0.05037607418502 -0.05037607418502
5729 -0.05037607400587 -0.05037607400587
5730 -0.05037602803833 -0.05037602803833
5731 -0.05037602793159 -0.05037602793159
5732 -0.05037589626961 -0.05037589626961
5733 -0.05037589613024 -0.05037589613024
5734 -0.05030887279448 -0.05030887279448
5735 -0.05030887269272 -0.05030887269272
5736 -0.05030887255174 -0.05030887255174
5737 -0.05030887252793 -0.05030887252793
5738 -0.05030840276940 -0.05030840276940
5739 -0.05030840263427 -0.05030840263427
5740 -0.05030832548098 -0.05030832548098
5741 -0.05030832536364 -0.05030832536364
5742 -0.05019002299033 -0.05019002299033
5743 -0.05019002288424 -0.05019002288424
5744 -0.05018999380389 -0.05018999380389
5745 -0.05018999377682 -0.05018999377682
5746 -0.05018990105789 -0.05018990105789
5747 -0.05018990085341 -0.05018990085341
5748 -0.05018981830868 -0.05018981830868
5749 -0.05018981822087 -0.05018981822087
5750 -0.05005311709844 -0.05005311709844
5751 -0.05005311699036 -0.05005311699036
5752 -0.05005307588999 -0.05005307588999
5753 -0.05005307567439 -0.05005307567439
5754 -0.04996840457720 -0.04996840457720
5755 -0.04996840434885 -0.04996840434885
5756 -0.04996840235241 -0.04996840235241
5757 -0.04996840231217 -0.04996840231217
5758 -0.04995321663232 -0.04995321663232
5759 -0.04995321656235 -0.04995321656235
5760 -0.04995319412323 -0.04995319412323
5761 -0.04995319398298 -0.04995319398298
5762 -0.04963390021280 -0.04963390021280
5763 -0.04963386652926 -0.04963386652926
5764 -0.04963384228281 -0.04963384228281
5765 -0.04963381839748 -0.04963381839748
5766 -0.04947108649611 -0.04947108649611
5767 -0.04947108646338 -0.04947108646338
5768 -0.04946349510723 -0.04946349510723
5769 -0.04946349506182 -0.04946349506182
5770 -0.04946345213105 -0.04946345213105
5771 -0.04946345205454 -0.04946345205454
5772 -0.04945649863897 -0.04945649863897
5773 -0.04945649856974 -0.04945649856974
5774 -0.04942865340026 -0.04942865340026
5775 -0.04942848305178 -0.04942848305178
***********************************************************
***********************************************************
Mulliken populations
***********************************************************
***********************************************************
Total spin moment (muB) 0.000000000
Up spin Down spin Sum Diff
1 Ti 5.620205203 5.620205203 11.240410406 0.000000000
2 Ti 5.620239209 5.620239209 11.240478419 0.000000000
3 O 3.189946116 3.189946116 6.379892233 0.000000000
4 O 3.189914766 3.189914766 6.379829532 0.000000000
5 O 3.189889284 3.189889284 6.379778567 0.000000000
6 O 3.189889283 3.189889283 6.379778567 0.000000000
7 Ti 5.620205203 5.620205203 11.240410405 0.000000000
8 Ti 5.620239210 5.620239210 11.240478420 0.000000000
9 O 3.189946117 3.189946117 6.379892234 0.000000000
10 O 3.189914766 3.189914766 6.379829531 0.000000000
11 O 3.189889284 3.189889284 6.379778568 0.000000000
12 O 3.189889284 3.189889284 6.379778567 0.000000000
13 Ti 5.620205202 5.620205202 11.240410405 0.000000000
14 Ti 5.620239210 5.620239210 11.240478419 0.000000000
15 O 3.189946117 3.189946117 6.379892233 0.000000000
16 O 3.189914766 3.189914766 6.379829532 0.000000000
17 O 3.189889284 3.189889284 6.379778568 0.000000000
18 O 3.189889284 3.189889284 6.379778567 0.000000000
19 Ti 5.620205203 5.620205203 11.240410406 0.000000000
20 Ti 5.620239210 5.620239210 11.240478420 0.000000000
21 O 3.189946117 3.189946117 6.379892233 0.000000000
22 O 3.189914766 3.189914766 6.379829533 0.000000000
23 O 3.189889284 3.189889284 6.379778567 0.000000000
24 O 3.189889283 3.189889283 6.379778567 0.000000000
25 Ti 5.620205203 5.620205203 11.240410406 0.000000000
26 Ti 5.620239209 5.620239209 11.240478419 0.000000000
27 O 3.189946117 3.189946117 6.379892233 0.000000000
28 O 3.189914766 3.189914766 6.379829532 0.000000000
29 O 3.189889284 3.189889284 6.379778568 0.000000000
30 O 3.189889283 3.189889283 6.379778566 0.000000000
31 Ti 5.620205203 5.620205203 11.240410407 0.000000000
32 Ti 5.620239210 5.620239210 11.240478421 0.000000000
33 O 3.189946117 3.189946117 6.379892233 0.000000000
34 O 3.189914766 3.189914766 6.379829532 0.000000000
35 O 3.189889284 3.189889284 6.379778568 0.000000000
36 O 3.189889284 3.189889284 6.379778567 0.000000000
37 Ti 5.620205203 5.620205203 11.240410405 0.000000000
38 Ti 5.620239210 5.620239210 11.240478420 0.000000000
39 O 3.189946116 3.189946116 6.379892233 0.000000000
40 O 3.189914765 3.189914765 6.379829531 0.000000000
41 O 3.189889284 3.189889284 6.379778568 0.000000000
42 O 3.189889284 3.189889284 6.379778567 0.000000000
43 Ti 5.620217686 5.620217686 11.240435373 0.000000000
44 Ti 5.620212729 5.620212729 11.240425458 0.000000000
45 O 3.189917491 3.189917491 6.379834983 0.000000000
46 O 3.189935429 3.189935429 6.379870858 0.000000000
47 O 3.189931488 3.189931488 6.379862976 0.000000000
48 O 3.189835404 3.189835404 6.379670808 0.000000000
49 Ti 5.620217686 5.620217686 11.240435372 0.000000000
50 Ti 5.620212729 5.620212729 11.240425458 0.000000000
51 O 3.189917491 3.189917491 6.379834983 0.000000000
52 O 3.189935429 3.189935429 6.379870858 0.000000000
53 O 3.189931488 3.189931488 6.379862975 0.000000000
54 O 3.189835404 3.189835404 6.379670808 0.000000000
55 Ti 5.620217686 5.620217686 11.240435372 0.000000000
56 Ti 5.620212730 5.620212730 11.240425459 0.000000000
57 O 3.189917491 3.189917491 6.379834983 0.000000000
58 O 3.189935429 3.189935429 6.379870858 0.000000000
59 O 3.189931488 3.189931488 6.379862975 0.000000000
60 O 3.189835404 3.189835404 6.379670808 0.000000000
61 Ti 5.620217686 5.620217686 11.240435372 0.000000000
62 Ti 5.620212730 5.620212730 11.240425459 0.000000000
63 O 3.189917491 3.189917491 6.379834983 0.000000000
64 O 3.189935429 3.189935429 6.379870859 0.000000000
65 O 3.189931488 3.189931488 6.379862975 0.000000000
66 O 3.189835404 3.189835404 6.379670807 0.000000000
67 Ti 5.620217686 5.620217686 11.240435373 0.000000000
68 Ti 5.620212729 5.620212729 11.240425458 0.000000000
69 O 3.189917492 3.189917492 6.379834983 0.000000000
70 O 3.189935429 3.189935429 6.379870858 0.000000000
71 O 3.189931488 3.189931488 6.379862976 0.000000000
72 O 3.189835404 3.189835404 6.379670807 0.000000000
73 Ti 5.620217687 5.620217687 11.240435373 0.000000000
74 Ti 5.620212729 5.620212729 11.240425459 0.000000000
75 O 3.189917491 3.189917491 6.379834983 0.000000000
76 O 3.189935429 3.189935429 6.379870858 0.000000000
77 O 3.189931488 3.189931488 6.379862976 0.000000000
78 O 3.189835403 3.189835403 6.379670807 0.000000000
79 Ti 5.620217686 5.620217686 11.240435372 0.000000000
80 Ti 5.620212729 5.620212729 11.240425459 0.000000000
81 O 3.189917492 3.189917492 6.379834984 0.000000000
82 O 3.189935429 3.189935429 6.379870858 0.000000000
83 O 3.189931488 3.189931488 6.379862975 0.000000000
84 O 3.189835404 3.189835404 6.379670808 0.000000000
85 Ti 5.620155719 5.620155719 11.240311438 0.000000000
86 Ti 5.620182221 5.620182221 11.240364442 0.000000000
87 O 3.189921455 3.189921455 6.379842910 0.000000000
88 O 3.189920313 3.189920313 6.379840625 0.000000000
89 O 3.189930207 3.189930207 6.379860413 0.000000000
90 O 3.189835494 3.189835494 6.379670988 0.000000000
91 Ti 5.620155718 5.620155718 11.240311435 0.000000000
92 Ti 5.620182221 5.620182221 11.240364442 0.000000000
93 O 3.189921455 3.189921455 6.379842911 0.000000000
94 O 3.189920313 3.189920313 6.379840625 0.000000000
95 O 3.189930207 3.189930207 6.379860414 0.000000000
96 O 3.189835494 3.189835494 6.379670988 0.000000000
97 Ti 5.620155719 5.620155719 11.240311438 0.000000000
98 Ti 5.620182221 5.620182221 11.240364443 0.000000000
99 O 3.189921455 3.189921455 6.379842911 0.000000000
100 O 3.189920313 3.189920313 6.379840626 0.000000000
101 O 3.189930207 3.189930207 6.379860415 0.000000000
102 O 3.189835494 3.189835494 6.379670988 0.000000000
103 Ti 5.620155719 5.620155719 11.240311437 0.000000000
104 Ti 5.620182221 5.620182221 11.240364442 0.000000000
105 O 3.189921455 3.189921455 6.379842910 0.000000000
106 O 3.189920313 3.189920313 6.379840625 0.000000000
107 O 3.189930207 3.189930207 6.379860413 0.000000000
108 O 3.189835494 3.189835494 6.379670988 0.000000000
109 Ti 5.620155720 5.620155720 11.240311440 0.000000000
110 Ti 5.620182221 5.620182221 11.240364443 0.000000000
111 O 3.189921455 3.189921455 6.379842910 0.000000000
112 O 3.189920313 3.189920313 6.379840625 0.000000000
113 O 3.189930207 3.189930207 6.379860414 0.000000000
114 O 3.189835494 3.189835494 6.379670988 0.000000000
115 Ti 5.620155719 5.620155719 11.240311438 0.000000000
116 Ti 5.620182222 5.620182222 11.240364444 0.000000000
117 O 3.189921455 3.189921455 6.379842910 0.000000000
118 O 3.189920313 3.189920313 6.379840626 0.000000000
119 O 3.189930207 3.189930207 6.379860414 0.000000000
120 O 3.189835494 3.189835494 6.379670987 0.000000000
121 Ti 5.620155719 5.620155719 11.240311438 0.000000000
122 Ti 5.620182222 5.620182222 11.240364444 0.000000000
123 O 3.189921455 3.189921455 6.379842910 0.000000000
124 O 3.189920313 3.189920313 6.379840625 0.000000000
125 O 3.189930207 3.189930207 6.379860414 0.000000000
126 O 3.189835494 3.189835494 6.379670987 0.000000000
127 Ti 5.620167072 5.620167072 11.240334143 0.000000000
128 Ti 5.620183783 5.620183783 11.240367565 0.000000000
129 O 3.189954430 3.189954430 6.379908859 0.000000000
130 O 3.189888568 3.189888568 6.379777135 0.000000000
131 O 3.189905458 3.189905458 6.379810917 0.000000000
132 O 3.189886164 3.189886164 6.379772327 0.000000000
133 Ti 5.620167071 5.620167071 11.240334142 0.000000000
134 Ti 5.620183782 5.620183782 11.240367564 0.000000000
135 O 3.189954430 3.189954430 6.379908859 0.000000000
136 O 3.189888568 3.189888568 6.379777136 0.000000000
137 O 3.189905459 3.189905459 6.379810917 0.000000000
138 O 3.189886163 3.189886163 6.379772326 0.000000000
139 Ti 5.620167071 5.620167071 11.240334142 0.000000000
140 Ti 5.620183782 5.620183782 11.240367564 0.000000000
141 O 3.189954430 3.189954430 6.379908859 0.000000000
142 O 3.189888567 3.189888567 6.379777135 0.000000000
143 O 3.189905459 3.189905459 6.379810917 0.000000000
144 O 3.189886163 3.189886163 6.379772327 0.000000000
145 Ti 5.620167071 5.620167071 11.240334142 0.000000000
146 Ti 5.620183783 5.620183783 11.240367566 0.000000000
147 O 3.189954430 3.189954430 6.379908859 0.000000000
148 O 3.189888568 3.189888568 6.379777135 0.000000000
149 O 3.189905458 3.189905458 6.379810916 0.000000000
150 O 3.189886163 3.189886163 6.379772327 0.000000000
151 Ti 5.620167071 5.620167071 11.240334141 0.000000000
152 Ti 5.620183783 5.620183783 11.240367567 0.000000000
153 O 3.189954430 3.189954430 6.379908859 0.000000000
154 O 3.189888567 3.189888567 6.379777135 0.000000000
155 O 3.189905458 3.189905458 6.379810916 0.000000000
156 O 3.189886164 3.189886164 6.379772327 0.000000000
157 Ti 5.620167071 5.620167071 11.240334142 0.000000000
158 Ti 5.620183783 5.620183783 11.240367565 0.000000000
159 O 3.189954430 3.189954430 6.379908859 0.000000000
160 O 3.189888568 3.189888568 6.379777135 0.000000000
161 O 3.189905458 3.189905458 6.379810916 0.000000000
162 O 3.189886163 3.189886163 6.379772327 0.000000000
163 Ti 5.620167071 5.620167071 11.240334141 0.000000000
164 Ti 5.620183782 5.620183782 11.240367565 0.000000000
165 O 3.189954430 3.189954430 6.379908860 0.000000000
166 O 3.189888567 3.189888567 6.379777135 0.000000000
167 O 3.189905458 3.189905458 6.379810916 0.000000000
168 O 3.189886164 3.189886164 6.379772327 0.000000000
169 Ti 5.620196863 5.620196863 11.240393725 0.000000000
170 Ti 5.620174130 5.620174130 11.240348260 0.000000000
171 O 3.189967335 3.189967335 6.379934671 0.000000000
172 O 3.189878654 3.189878654 6.379757308 0.000000000
173 O 3.189879187 3.189879187 6.379758374 0.000000000
174 O 3.189926021 3.189926021 6.379852042 0.000000000
175 Ti 5.620196863 5.620196863 11.240393725 0.000000000
176 Ti 5.620174130 5.620174130 11.240348260 0.000000000
177 O 3.189967336 3.189967336 6.379934672 0.000000000
178 O 3.189878654 3.189878654 6.379757309 0.000000000
179 O 3.189879187 3.189879187 6.379758375 0.000000000
180 O 3.189926021 3.189926021 6.379852042 0.000000000
181 Ti 5.620196864 5.620196864 11.240393727 0.000000000
182 Ti 5.620174130 5.620174130 11.240348259 0.000000000
183 O 3.189967336 3.189967336 6.379934672 0.000000000
184 O 3.189878654 3.189878654 6.379757309 0.000000000
185 O 3.189879188 3.189879188 6.379758375 0.000000000
186 O 3.189926021 3.189926021 6.379852042 0.000000000
187 Ti 5.620196863 5.620196863 11.240393726 0.000000000
188 Ti 5.620174130 5.620174130 11.240348259 0.000000000
189 O 3.189967336 3.189967336 6.379934672 0.000000000
190 O 3.189878654 3.189878654 6.379757309 0.000000000
191 O 3.189879187 3.189879187 6.379758375 0.000000000
192 O 3.189926021 3.189926021 6.379852042 0.000000000
193 Ti 5.620196863 5.620196863 11.240393727 0.000000000
194 Ti 5.620174130 5.620174130 11.240348260 0.000000000
195 O 3.189967336 3.189967336 6.379934672 0.000000000
196 O 3.189878654 3.189878654 6.379757309 0.000000000
197 O 3.189879188 3.189879188 6.379758375 0.000000000
198 O 3.189926021 3.189926021 6.379852042 0.000000000
199 Ti 5.620196863 5.620196863 11.240393726 0.000000000
200 Ti 5.620174130 5.620174130 11.240348260 0.000000000
201 O 3.189967336 3.189967336 6.379934672 0.000000000
202 O 3.189878654 3.189878654 6.379757308 0.000000000
203 O 3.189879187 3.189879187 6.379758375 0.000000000
204 O 3.189926021 3.189926021 6.379852042 0.000000000
205 Ti 5.620196863 5.620196863 11.240393725 0.000000000
206 Ti 5.620174130 5.620174130 11.240348261 0.000000000
207 O 3.189967336 3.189967336 6.379934672 0.000000000
208 O 3.189878654 3.189878654 6.379757308 0.000000000
209 O 3.189879187 3.189879187 6.379758375 0.000000000
210 O 3.189926021 3.189926021 6.379852041 0.000000000
211 Ti 5.620217686 5.620217686 11.240435372 0.000000000
212 Ti 5.620212730 5.620212730 11.240425460 0.000000000
213 O 3.189917491 3.189917491 6.379834983 0.000000000
214 O 3.189935429 3.189935429 6.379870858 0.000000000
215 O 3.189835404 3.189835404 6.379670808 0.000000000
216 O 3.189931488 3.189931488 6.379862975 0.000000000
217 Ti 5.620217686 5.620217686 11.240435371 0.000000000
218 Ti 5.620212729 5.620212729 11.240425458 0.000000000
219 O 3.189917491 3.189917491 6.379834982 0.000000000
220 O 3.189935429 3.189935429 6.379870858 0.000000000
221 O 3.189835404 3.189835404 6.379670808 0.000000000
222 O 3.189931488 3.189931488 6.379862976 0.000000000
223 Ti 5.620217685 5.620217685 11.240435371 0.000000000
224 Ti 5.620212729 5.620212729 11.240425458 0.000000000
225 O 3.189917492 3.189917492 6.379834983 0.000000000
226 O 3.189935430 3.189935430 6.379870859 0.000000000
227 O 3.189835404 3.189835404 6.379670808 0.000000000
228 O 3.189931487 3.189931487 6.379862975 0.000000000
229 Ti 5.620217685 5.620217685 11.240435370 0.000000000
230 Ti 5.620212729 5.620212729 11.240425458 0.000000000
231 O 3.189917492 3.189917492 6.379834983 0.000000000
232 O 3.189935430 3.189935430 6.379870859 0.000000000
233 O 3.189835404 3.189835404 6.379670808 0.000000000
234 O 3.189931487 3.189931487 6.379862975 0.000000000
235 Ti 5.620217685 5.620217685 11.240435370 0.000000000
236 Ti 5.620212729 5.620212729 11.240425457 0.000000000
237 O 3.189917492 3.189917492 6.379834983 0.000000000
238 O 3.189935429 3.189935429 6.379870858 0.000000000
239 O 3.189835404 3.189835404 6.379670808 0.000000000
240 O 3.189931488 3.189931488 6.379862976 0.000000000
241 Ti 5.620217686 5.620217686 11.240435372 0.000000000
242 Ti 5.620212729 5.620212729 11.240425457 0.000000000
243 O 3.189917491 3.189917491 6.379834983 0.000000000
244 O 3.189935430 3.189935430 6.379870859 0.000000000
245 O 3.189835404 3.189835404 6.379670808 0.000000000
246 O 3.189931488 3.189931488 6.379862976 0.000000000
247 Ti 5.620217685 5.620217685 11.240435371 0.000000000
248 Ti 5.620212729 5.620212729 11.240425458 0.000000000
249 O 3.189917492 3.189917492 6.379834983 0.000000000
250 O 3.189935429 3.189935429 6.379870858 0.000000000
251 O 3.189835404 3.189835404 6.379670808 0.000000000
252 O 3.189931488 3.189931488 6.379862976 0.000000000
253 Ti 5.620235728 5.620235728 11.240471456 0.000000000
254 Ti 5.620181258 5.620181258 11.240362516 0.000000000
255 O 3.189860655 3.189860655 6.379721309 0.000000000
256 O 3.189983693 3.189983693 6.379967387 0.000000000
257 O 3.189911478 3.189911478 6.379822955 0.000000000
258 O 3.189911477 3.189911477 6.379822954 0.000000000
259 Ti 5.620235728 5.620235728 11.240471455 0.000000000
260 Ti 5.620181259 5.620181259 11.240362518 0.000000000
261 O 3.189860655 3.189860655 6.379721309 0.000000000
262 O 3.189983693 3.189983693 6.379967387 0.000000000
263 O 3.189911477 3.189911477 6.379822954 0.000000000
264 O 3.189911477 3.189911477 6.379822954 0.000000000
265 Ti 5.620235727 5.620235727 11.240471455 0.000000000
266 Ti 5.620181259 5.620181259 11.240362517 0.000000000
267 O 3.189860655 3.189860655 6.379721309 0.000000000
268 O 3.189983693 3.189983693 6.379967386 0.000000000
269 O 3.189911477 3.189911477 6.379822954 0.000000000
270 O 3.189911477 3.189911477 6.379822955 0.000000000
271 Ti 5.620235728 5.620235728 11.240471456 0.000000000
272 Ti 5.620181259 5.620181259 11.240362517 0.000000000
273 O 3.189860654 3.189860654 6.379721308 0.000000000
274 O 3.189983693 3.189983693 6.379967387 0.000000000
275 O 3.189911477 3.189911477 6.379822954 0.000000000
276 O 3.189911477 3.189911477 6.379822954 0.000000000
277 Ti 5.620235727 5.620235727 11.240471455 0.000000000
278 Ti 5.620181259 5.620181259 11.240362518 0.000000000
279 O 3.189860655 3.189860655 6.379721309 0.000000000
280 O 3.189983693 3.189983693 6.379967387 0.000000000
281 O 3.189911477 3.189911477 6.379822954 0.000000000
282 O 3.189911477 3.189911477 6.379822954 0.000000000
283 Ti 5.620235728 5.620235728 11.240471455 0.000000000
284 Ti 5.620181259 5.620181259 11.240362517 0.000000000
285 O 3.189860654 3.189860654 6.379721309 0.000000000
286 O 3.189983693 3.189983693 6.379967387 0.000000000
287 O 3.189911477 3.189911477 6.379822954 0.000000000
288 O 3.189911477 3.189911477 6.379822954 0.000000000
289 Ti 5.620235727 5.620235727 11.240471455 0.000000000
290 Ti 5.620181259 5.620181259 11.240362517 0.000000000
291 O 3.189860654 3.189860654 6.379721309 0.000000000
292 O 3.189983693 3.189983693 6.379967387 0.000000000
293 O 3.189911478 3.189911478 6.379822955 0.000000000
294 O 3.189911477 3.189911477 6.379822954 0.000000000
295 Ti 5.620200041 5.620200041 11.240400082 0.000000000
296 Ti 5.620154196 5.620154196 11.240308393 0.000000000
297 O 3.189826348 3.189826348 6.379652697 0.000000000
298 O 3.189997065 3.189997065 6.379994130 0.000000000
299 O 3.189910795 3.189910795 6.379821589 0.000000000
300 O 3.189937485 3.189937485 6.379874969 0.000000000
301 Ti 5.620200040 5.620200040 11.240400081 0.000000000
302 Ti 5.620154196 5.620154196 11.240308393 0.000000000
303 O 3.189826349 3.189826349 6.379652698 0.000000000
304 O 3.189997065 3.189997065 6.379994130 0.000000000
305 O 3.189910795 3.189910795 6.379821590 0.000000000
306 O 3.189937485 3.189937485 6.379874969 0.000000000
307 Ti 5.620200039 5.620200039 11.240400079 0.000000000
308 Ti 5.620154196 5.620154196 11.240308393 0.000000000
309 O 3.189826349 3.189826349 6.379652697 0.000000000
310 O 3.189997065 3.189997065 6.379994129 0.000000000
311 O 3.189910795 3.189910795 6.379821589 0.000000000
312 O 3.189937485 3.189937485 6.379874969 0.000000000
313 Ti 5.620200040 5.620200040 11.240400079 0.000000000
314 Ti 5.620154196 5.620154196 11.240308393 0.000000000
315 O 3.189826349 3.189826349 6.379652698 0.000000000
316 O 3.189997065 3.189997065 6.379994131 0.000000000
317 O 3.189910795 3.189910795 6.379821589 0.000000000
318 O 3.189937485 3.189937485 6.379874969 0.000000000
319 Ti 5.620200040 5.620200040 11.240400080 0.000000000
320 Ti 5.620154196 5.620154196 11.240308392 0.000000000
321 O 3.189826348 3.189826348 6.379652697 0.000000000
322 O 3.189997065 3.189997065 6.379994130 0.000000000
323 O 3.189910795 3.189910795 6.379821590 0.000000000
324 O 3.189937485 3.189937485 6.379874970 0.000000000
325 Ti 5.620200040 5.620200040 11.240400079 0.000000000
326 Ti 5.620154197 5.620154197 11.240308394 0.000000000
327 O 3.189826349 3.189826349 6.379652697 0.000000000
328 O 3.189997065 3.189997065 6.379994130 0.000000000
329 O 3.189910795 3.189910795 6.379821589 0.000000000
330 O 3.189937485 3.189937485 6.379874969 0.000000000
331 Ti 5.620200040 5.620200040 11.240400080 0.000000000
332 Ti 5.620154197 5.620154197 11.240308394 0.000000000
333 O 3.189826349 3.189826349 6.379652698 0.000000000
334 O 3.189997065 3.189997065 6.379994129 0.000000000
335 O 3.189910794 3.189910794 6.379821589 0.000000000
336 O 3.189937484 3.189937484 6.379874969 0.000000000
337 Ti 5.620181151 5.620181151 11.240362302 0.000000000
338 Ti 5.620203384 5.620203384 11.240406767 0.000000000
339 O 3.189854237 3.189854237 6.379708474 0.000000000
340 O 3.189962510 3.189962510 6.379925021 0.000000000
341 O 3.189822032 3.189822032 6.379644063 0.000000000
342 O 3.189965445 3.189965445 6.379930890 0.000000000
343 Ti 5.620181150 5.620181150 11.240362300 0.000000000
344 Ti 5.620203384 5.620203384 11.240406768 0.000000000
345 O 3.189854237 3.189854237 6.379708474 0.000000000
346 O 3.189962510 3.189962510 6.379925020 0.000000000
347 O 3.189822031 3.189822031 6.379644062 0.000000000
348 O 3.189965444 3.189965444 6.379930889 0.000000000
349 Ti 5.620181150 5.620181150 11.240362300 0.000000000
350 Ti 5.620203384 5.620203384 11.240406768 0.000000000
351 O 3.189854237 3.189854237 6.379708474 0.000000000
352 O 3.189962510 3.189962510 6.379925020 0.000000000
353 O 3.189822032 3.189822032 6.379644063 0.000000000
354 O 3.189965445 3.189965445 6.379930889 0.000000000
355 Ti 5.620181151 5.620181151 11.240362302 0.000000000
356 Ti 5.620203384 5.620203384 11.240406767 0.000000000
357 O 3.189854237 3.189854237 6.379708474 0.000000000
358 O 3.189962510 3.189962510 6.379925020 0.000000000
359 O 3.189822031 3.189822031 6.379644062 0.000000000
360 O 3.189965444 3.189965444 6.379930889 0.000000000
361 Ti 5.620181150 5.620181150 11.240362300 0.000000000
362 Ti 5.620203384 5.620203384 11.240406768 0.000000000
363 O 3.189854237 3.189854237 6.379708473 0.000000000
364 O 3.189962510 3.189962510 6.379925020 0.000000000
365 O 3.189822031 3.189822031 6.379644062 0.000000000
366 O 3.189965445 3.189965445 6.379930889 0.000000000
367 Ti 5.620181151 5.620181151 11.240362303 0.000000000
368 Ti 5.620203384 5.620203384 11.240406768 0.000000000
369 O 3.189854237 3.189854237 6.379708474 0.000000000
370 O 3.189962510 3.189962510 6.379925020 0.000000000
371 O 3.189822031 3.189822031 6.379644063 0.000000000
372 O 3.189965445 3.189965445 6.379930889 0.000000000
373 Ti 5.620181151 5.620181151 11.240362302 0.000000000
374 Ti 5.620203383 5.620203383 11.240406765 0.000000000
375 O 3.189854237 3.189854237 6.379708474 0.000000000
376 O 3.189962510 3.189962510 6.379925020 0.000000000
377 O 3.189822032 3.189822032 6.379644063 0.000000000
378 O 3.189965445 3.189965445 6.379930889 0.000000000
379 Ti 5.620158494 5.620158494 11.240316988 0.000000000
380 Ti 5.620200108 5.620200108 11.240400216 0.000000000
381 O 3.189911576 3.189911576 6.379823151 0.000000000
382 O 3.189928129 3.189928129 6.379856257 0.000000000
383 O 3.189785428 3.189785428 6.379570855 0.000000000
384 O 3.189954798 3.189954798 6.379909596 0.000000000
385 Ti 5.620158494 5.620158494 11.240316988 0.000000000
386 Ti 5.620200108 5.620200108 11.240400215 0.000000000
387 O 3.189911576 3.189911576 6.379823152 0.000000000
388 O 3.189928129 3.189928129 6.379856258 0.000000000
389 O 3.189785427 3.189785427 6.379570855 0.000000000
390 O 3.189954798 3.189954798 6.379909597 0.000000000
391 Ti 5.620158494 5.620158494 11.240316988 0.000000000
392 Ti 5.620200107 5.620200107 11.240400213 0.000000000
393 O 3.189911576 3.189911576 6.379823152 0.000000000
394 O 3.189928129 3.189928129 6.379856259 0.000000000
395 O 3.189785428 3.189785428 6.379570855 0.000000000
396 O 3.189954798 3.189954798 6.379909597 0.000000000
397 Ti 5.620158494 5.620158494 11.240316988 0.000000000
398 Ti 5.620200108 5.620200108 11.240400216 0.000000000
399 O 3.189911576 3.189911576 6.379823152 0.000000000
400 O 3.189928129 3.189928129 6.379856257 0.000000000
401 O 3.189785428 3.189785428 6.379570855 0.000000000
402 O 3.189954798 3.189954798 6.379909597 0.000000000
403 Ti 5.620158494 5.620158494 11.240316988 0.000000000
404 Ti 5.620200108 5.620200108 11.240400216 0.000000000
405 O 3.189911576 3.189911576 6.379823152 0.000000000
406 O 3.189928129 3.189928129 6.379856258 0.000000000
407 O 3.189785428 3.189785428 6.379570855 0.000000000
408 O 3.189954798 3.189954798 6.379909596 0.000000000
409 Ti 5.620158494 5.620158494 11.240316988 0.000000000
410 Ti 5.620200108 5.620200108 11.240400216 0.000000000
411 O 3.189911576 3.189911576 6.379823151 0.000000000
412 O 3.189928129 3.189928129 6.379856258 0.000000000
413 O 3.189785428 3.189785428 6.379570855 0.000000000
414 O 3.189954798 3.189954798 6.379909596 0.000000000
415 Ti 5.620158494 5.620158494 11.240316988 0.000000000
416 Ti 5.620200107 5.620200107 11.240400214 0.000000000
417 O 3.189911576 3.189911576 6.379823152 0.000000000
418 O 3.189928129 3.189928129 6.379856258 0.000000000
419 O 3.189785428 3.189785428 6.379570855 0.000000000
420 O 3.189954798 3.189954798 6.379909597 0.000000000
421 Ti 5.620155717 5.620155717 11.240311435 0.000000000
422 Ti 5.620182222 5.620182222 11.240364443 0.000000000
423 O 3.189921455 3.189921455 6.379842910 0.000000000
424 O 3.189920312 3.189920312 6.379840625 0.000000000
425 O 3.189835494 3.189835494 6.379670988 0.000000000
426 O 3.189930207 3.189930207 6.379860414 0.000000000
427 Ti 5.620155718 5.620155718 11.240311437 0.000000000
428 Ti 5.620182222 5.620182222 11.240364444 0.000000000
429 O 3.189921455 3.189921455 6.379842910 0.000000000
430 O 3.189920313 3.189920313 6.379840625 0.000000000
431 O 3.189835494 3.189835494 6.379670988 0.000000000
432 O 3.189930207 3.189930207 6.379860413 0.000000000
433 Ti 5.620155718 5.620155718 11.240311435 0.000000000
434 Ti 5.620182221 5.620182221 11.240364442 0.000000000
435 O 3.189921456 3.189921456 6.379842911 0.000000000
436 O 3.189920313 3.189920313 6.379840625 0.000000000
437 O 3.189835494 3.189835494 6.379670988 0.000000000
438 O 3.189930207 3.189930207 6.379860413 0.000000000
439 Ti 5.620155719 5.620155719 11.240311437 0.000000000
440 Ti 5.620182221 5.620182221 11.240364442 0.000000000
441 O 3.189921455 3.189921455 6.379842910 0.000000000
442 O 3.189920313 3.189920313 6.379840626 0.000000000
443 O 3.189835494 3.189835494 6.379670988 0.000000000
444 O 3.189930207 3.189930207 6.379860414 0.000000000
445 Ti 5.620155718 5.620155718 11.240311437 0.000000000
446 Ti 5.620182222 5.620182222 11.240364444 0.000000000
447 O 3.189921455 3.189921455 6.379842910 0.000000000
448 O 3.189920312 3.189920312 6.379840625 0.000000000
449 O 3.189835494 3.189835494 6.379670987 0.000000000
450 O 3.189930206 3.189930206 6.379860413 0.000000000
451 Ti 5.620155718 5.620155718 11.240311436 0.000000000
452 Ti 5.620182222 5.620182222 11.240364444 0.000000000
453 O 3.189921455 3.189921455 6.379842909 0.000000000
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456 O 3.189930206 3.189930206 6.379860413 0.000000000
457 Ti 5.620155717 5.620155717 11.240311434 0.000000000
458 Ti 5.620182222 5.620182222 11.240364444 0.000000000
459 O 3.189921455 3.189921455 6.379842910 0.000000000
460 O 3.189920313 3.189920313 6.379840625 0.000000000
461 O 3.189835494 3.189835494 6.379670987 0.000000000
462 O 3.189930206 3.189930206 6.379860413 0.000000000
463 Ti 5.620200039 5.620200039 11.240400079 0.000000000
464 Ti 5.620154196 5.620154196 11.240308393 0.000000000
465 O 3.189826349 3.189826349 6.379652697 0.000000000
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467 O 3.189937485 3.189937485 6.379874970 0.000000000
468 O 3.189910795 3.189910795 6.379821589 0.000000000
469 Ti 5.620200040 5.620200040 11.240400080 0.000000000
470 Ti 5.620154197 5.620154197 11.240308394 0.000000000
471 O 3.189826349 3.189826349 6.379652698 0.000000000
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473 O 3.189937485 3.189937485 6.379874969 0.000000000
474 O 3.189910795 3.189910795 6.379821589 0.000000000
475 Ti 5.620200040 5.620200040 11.240400080 0.000000000
476 Ti 5.620154197 5.620154197 11.240308393 0.000000000
477 O 3.189826349 3.189826349 6.379652698 0.000000000
478 O 3.189997065 3.189997065 6.379994129 0.000000000
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480 O 3.189910795 3.189910795 6.379821590 0.000000000
481 Ti 5.620200040 5.620200040 11.240400079 0.000000000
482 Ti 5.620154196 5.620154196 11.240308393 0.000000000
483 O 3.189826349 3.189826349 6.379652697 0.000000000
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487 Ti 5.620200040 5.620200040 11.240400080 0.000000000
488 Ti 5.620154197 5.620154197 11.240308394 0.000000000
489 O 3.189826349 3.189826349 6.379652698 0.000000000
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492 O 3.189910795 3.189910795 6.379821589 0.000000000
493 Ti 5.620200040 5.620200040 11.240400080 0.000000000
494 Ti 5.620154197 5.620154197 11.240308393 0.000000000
495 O 3.189826349 3.189826349 6.379652697 0.000000000
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499 Ti 5.620200040 5.620200040 11.240400080 0.000000000
500 Ti 5.620154196 5.620154196 11.240308393 0.000000000
501 O 3.189826349 3.189826349 6.379652698 0.000000000
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504 O 3.189910795 3.189910795 6.379821590 0.000000000
505 Ti 5.620201535 5.620201535 11.240403070 0.000000000
506 Ti 5.620171275 5.620171275 11.240342550 0.000000000
507 O 3.189760920 3.189760920 6.379521840 0.000000000
508 O 3.189972904 3.189972904 6.379945808 0.000000000
509 O 3.189946696 3.189946696 6.379893393 0.000000000
510 O 3.189946696 3.189946696 6.379893392 0.000000000
511 Ti 5.620201534 5.620201534 11.240403068 0.000000000
512 Ti 5.620171275 5.620171275 11.240342550 0.000000000
513 O 3.189760920 3.189760920 6.379521840 0.000000000
514 O 3.189972904 3.189972904 6.379945807 0.000000000
515 O 3.189946697 3.189946697 6.379893394 0.000000000
516 O 3.189946696 3.189946696 6.379893393 0.000000000
517 Ti 5.620201535 5.620201535 11.240403069 0.000000000
518 Ti 5.620171275 5.620171275 11.240342550 0.000000000
519 O 3.189760920 3.189760920 6.379521841 0.000000000
520 O 3.189972904 3.189972904 6.379945808 0.000000000
521 O 3.189946697 3.189946697 6.379893394 0.000000000
522 O 3.189946696 3.189946696 6.379893392 0.000000000
523 Ti 5.620201534 5.620201534 11.240403069 0.000000000
524 Ti 5.620171275 5.620171275 11.240342551 0.000000000
525 O 3.189760920 3.189760920 6.379521840 0.000000000
526 O 3.189972903 3.189972903 6.379945807 0.000000000
527 O 3.189946696 3.189946696 6.379893393 0.000000000
528 O 3.189946697 3.189946697 6.379893393 0.000000000
529 Ti 5.620201534 5.620201534 11.240403068 0.000000000
530 Ti 5.620171275 5.620171275 11.240342551 0.000000000
531 O 3.189760920 3.189760920 6.379521840 0.000000000
532 O 3.189972903 3.189972903 6.379945807 0.000000000
533 O 3.189946696 3.189946696 6.379893393 0.000000000
534 O 3.189946697 3.189946697 6.379893393 0.000000000
535 Ti 5.620201534 5.620201534 11.240403068 0.000000000
536 Ti 5.620171275 5.620171275 11.240342550 0.000000000
537 O 3.189760920 3.189760920 6.379521840 0.000000000
538 O 3.189972904 3.189972904 6.379945807 0.000000000
539 O 3.189946696 3.189946696 6.379893393 0.000000000
540 O 3.189946696 3.189946696 6.379893393 0.000000000
541 Ti 5.620201534 5.620201534 11.240403068 0.000000000
542 Ti 5.620171275 5.620171275 11.240342550 0.000000000
543 O 3.189760921 3.189760921 6.379521841 0.000000000
544 O 3.189972904 3.189972904 6.379945808 0.000000000
545 O 3.189946697 3.189946697 6.379893393 0.000000000
546 O 3.189946696 3.189946696 6.379893393 0.000000000
547 Ti 5.620215548 5.620215548 11.240431097 0.000000000
548 Ti 5.620214434 5.620214434 11.240428869 0.000000000
549 O 3.189816379 3.189816379 6.379632759 0.000000000
550 O 3.189900108 3.189900108 6.379800216 0.000000000
551 O 3.189844030 3.189844030 6.379688061 0.000000000
552 O 3.190001238 3.190001238 6.380002476 0.000000000
553 Ti 5.620215549 5.620215549 11.240431098 0.000000000
554 Ti 5.620214435 5.620214435 11.240428869 0.000000000
555 O 3.189816380 3.189816380 6.379632760 0.000000000
556 O 3.189900108 3.189900108 6.379800217 0.000000000
557 O 3.189844031 3.189844031 6.379688061 0.000000000
558 O 3.190001238 3.190001238 6.380002476 0.000000000
559 Ti 5.620215549 5.620215549 11.240431097 0.000000000
560 Ti 5.620214434 5.620214434 11.240428868 0.000000000
561 O 3.189816380 3.189816380 6.379632760 0.000000000
562 O 3.189900108 3.189900108 6.379800216 0.000000000
563 O 3.189844030 3.189844030 6.379688061 0.000000000
564 O 3.190001238 3.190001238 6.380002476 0.000000000
565 Ti 5.620215549 5.620215549 11.240431097 0.000000000
566 Ti 5.620214434 5.620214434 11.240428868 0.000000000
567 O 3.189816380 3.189816380 6.379632760 0.000000000
568 O 3.189900108 3.189900108 6.379800216 0.000000000
569 O 3.189844030 3.189844030 6.379688061 0.000000000
570 O 3.190001238 3.190001238 6.380002477 0.000000000
571 Ti 5.620215549 5.620215549 11.240431098 0.000000000
572 Ti 5.620214434 5.620214434 11.240428869 0.000000000
573 O 3.189816380 3.189816380 6.379632760 0.000000000
574 O 3.189900108 3.189900108 6.379800217 0.000000000
575 O 3.189844030 3.189844030 6.379688061 0.000000000
576 O 3.190001238 3.190001238 6.380002476 0.000000000
577 Ti 5.620215548 5.620215548 11.240431097 0.000000000
578 Ti 5.620214434 5.620214434 11.240428868 0.000000000
579 O 3.189816380 3.189816380 6.379632759 0.000000000
580 O 3.189900108 3.189900108 6.379800217 0.000000000
581 O 3.189844031 3.189844031 6.379688061 0.000000000
582 O 3.190001238 3.190001238 6.380002476 0.000000000
583 Ti 5.620215549 5.620215549 11.240431098 0.000000000
584 Ti 5.620214434 5.620214434 11.240428869 0.000000000
585 O 3.189816380 3.189816380 6.379632760 0.000000000
586 O 3.189900108 3.189900108 6.379800216 0.000000000
587 O 3.189844030 3.189844030 6.379688061 0.000000000
588 O 3.190001238 3.190001238 6.380002475 0.000000000
589 Ti 5.620150679 5.620150679 11.240301357 0.000000000
590 Ti 5.620227304 5.620227304 11.240454609 0.000000000
591 O 3.189922800 3.189922800 6.379845600 0.000000000
592 O 3.189870697 3.189870697 6.379741395 0.000000000
593 O 3.189769550 3.189769550 6.379539101 0.000000000
594 O 3.189998015 3.189998015 6.379996030 0.000000000
595 Ti 5.620150679 5.620150679 11.240301358 0.000000000
596 Ti 5.620227304 5.620227304 11.240454607 0.000000000
597 O 3.189922800 3.189922800 6.379845599 0.000000000
598 O 3.189870698 3.189870698 6.379741395 0.000000000
599 O 3.189769551 3.189769551 6.379539102 0.000000000
600 O 3.189998015 3.189998015 6.379996031 0.000000000
601 Ti 5.620150680 5.620150680 11.240301359 0.000000000
602 Ti 5.620227304 5.620227304 11.240454608 0.000000000
603 O 3.189922800 3.189922800 6.379845599 0.000000000
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605 O 3.189769551 3.189769551 6.379539102 0.000000000
606 O 3.189998015 3.189998015 6.379996031 0.000000000
607 Ti 5.620150679 5.620150679 11.240301358 0.000000000
608 Ti 5.620227304 5.620227304 11.240454607 0.000000000
609 O 3.189922800 3.189922800 6.379845600 0.000000000
610 O 3.189870697 3.189870697 6.379741395 0.000000000
611 O 3.189769551 3.189769551 6.379539102 0.000000000
612 O 3.189998015 3.189998015 6.379996030 0.000000000
613 Ti 5.620150678 5.620150678 11.240301357 0.000000000
614 Ti 5.620227304 5.620227304 11.240454608 0.000000000
615 O 3.189922799 3.189922799 6.379845599 0.000000000
616 O 3.189870698 3.189870698 6.379741395 0.000000000
617 O 3.189769551 3.189769551 6.379539102 0.000000000
618 O 3.189998015 3.189998015 6.379996030 0.000000000
619 Ti 5.620150679 5.620150679 11.240301359 0.000000000
620 Ti 5.620227304 5.620227304 11.240454608 0.000000000
621 O 3.189922800 3.189922800 6.379845600 0.000000000
622 O 3.189870698 3.189870698 6.379741395 0.000000000
623 O 3.189769551 3.189769551 6.379539102 0.000000000
624 O 3.189998015 3.189998015 6.379996030 0.000000000
625 Ti 5.620150679 5.620150679 11.240301358 0.000000000
626 Ti 5.620227304 5.620227304 11.240454607 0.000000000
627 O 3.189922800 3.189922800 6.379845600 0.000000000
628 O 3.189870698 3.189870698 6.379741395 0.000000000
629 O 3.189769551 3.189769551 6.379539101 0.000000000
630 O 3.189998015 3.189998015 6.379996031 0.000000000
631 Ti 5.620167070 5.620167070 11.240334140 0.000000000
632 Ti 5.620183782 5.620183782 11.240367565 0.000000000
633 O 3.189954430 3.189954430 6.379908860 0.000000000
634 O 3.189888567 3.189888567 6.379777135 0.000000000
635 O 3.189886163 3.189886163 6.379772327 0.000000000
636 O 3.189905458 3.189905458 6.379810916 0.000000000
637 Ti 5.620167070 5.620167070 11.240334140 0.000000000
638 Ti 5.620183783 5.620183783 11.240367566 0.000000000
639 O 3.189954430 3.189954430 6.379908859 0.000000000
640 O 3.189888567 3.189888567 6.379777135 0.000000000
641 O 3.189886163 3.189886163 6.379772326 0.000000000
642 O 3.189905458 3.189905458 6.379810917 0.000000000
643 Ti 5.620167070 5.620167070 11.240334140 0.000000000
644 Ti 5.620183782 5.620183782 11.240367564 0.000000000
645 O 3.189954430 3.189954430 6.379908859 0.000000000
646 O 3.189888568 3.189888568 6.379777135 0.000000000
647 O 3.189886164 3.189886164 6.379772327 0.000000000
648 O 3.189905458 3.189905458 6.379810917 0.000000000
649 Ti 5.620167070 5.620167070 11.240334139 0.000000000
650 Ti 5.620183782 5.620183782 11.240367564 0.000000000
651 O 3.189954430 3.189954430 6.379908859 0.000000000
652 O 3.189888567 3.189888567 6.379777135 0.000000000
653 O 3.189886163 3.189886163 6.379772326 0.000000000
654 O 3.189905459 3.189905459 6.379810917 0.000000000
655 Ti 5.620167070 5.620167070 11.240334141 0.000000000
656 Ti 5.620183782 5.620183782 11.240367564 0.000000000
657 O 3.189954429 3.189954429 6.379908859 0.000000000
658 O 3.189888567 3.189888567 6.379777134 0.000000000
659 O 3.189886163 3.189886163 6.379772326 0.000000000
660 O 3.189905458 3.189905458 6.379810916 0.000000000
661 Ti 5.620167070 5.620167070 11.240334141 0.000000000
662 Ti 5.620183783 5.620183783 11.240367566 0.000000000
663 O 3.189954429 3.189954429 6.379908859 0.000000000
664 O 3.189888567 3.189888567 6.379777135 0.000000000
665 O 3.189886164 3.189886164 6.379772327 0.000000000
666 O 3.189905459 3.189905459 6.379810917 0.000000000
667 Ti 5.620167070 5.620167070 11.240334140 0.000000000
668 Ti 5.620183783 5.620183783 11.240367565 0.000000000
669 O 3.189954430 3.189954430 6.379908860 0.000000000
670 O 3.189888567 3.189888567 6.379777134 0.000000000
671 O 3.189886163 3.189886163 6.379772327 0.000000000
672 O 3.189905458 3.189905458 6.379810917 0.000000000
673 Ti 5.620181151 5.620181151 11.240362302 0.000000000
674 Ti 5.620203384 5.620203384 11.240406768 0.000000000
675 O 3.189854237 3.189854237 6.379708473 0.000000000
676 O 3.189962510 3.189962510 6.379925020 0.000000000
677 O 3.189965445 3.189965445 6.379930890 0.000000000
678 O 3.189822032 3.189822032 6.379644064 0.000000000
679 Ti 5.620181150 5.620181150 11.240362300 0.000000000
680 Ti 5.620203383 5.620203383 11.240406767 0.000000000
681 O 3.189854237 3.189854237 6.379708474 0.000000000
682 O 3.189962510 3.189962510 6.379925020 0.000000000
683 O 3.189965445 3.189965445 6.379930889 0.000000000
684 O 3.189822031 3.189822031 6.379644063 0.000000000
685 Ti 5.620181150 5.620181150 11.240362300 0.000000000
686 Ti 5.620203383 5.620203383 11.240406766 0.000000000
687 O 3.189854237 3.189854237 6.379708474 0.000000000
688 O 3.189962510 3.189962510 6.379925021 0.000000000
689 O 3.189965445 3.189965445 6.379930889 0.000000000
690 O 3.189822031 3.189822031 6.379644062 0.000000000
691 Ti 5.620181151 5.620181151 11.240362302 0.000000000
692 Ti 5.620203383 5.620203383 11.240406767 0.000000000
693 O 3.189854237 3.189854237 6.379708474 0.000000000
694 O 3.189962510 3.189962510 6.379925021 0.000000000
695 O 3.189965445 3.189965445 6.379930890 0.000000000
696 O 3.189822031 3.189822031 6.379644063 0.000000000
697 Ti 5.620181151 5.620181151 11.240362301 0.000000000
698 Ti 5.620203384 5.620203384 11.240406768 0.000000000
699 O 3.189854237 3.189854237 6.379708474 0.000000000
700 O 3.189962510 3.189962510 6.379925021 0.000000000
701 O 3.189965444 3.189965444 6.379930889 0.000000000
702 O 3.189822031 3.189822031 6.379644062 0.000000000
703 Ti 5.620181151 5.620181151 11.240362301 0.000000000
704 Ti 5.620203384 5.620203384 11.240406768 0.000000000
705 O 3.189854236 3.189854236 6.379708473 0.000000000
706 O 3.189962510 3.189962510 6.379925020 0.000000000
707 O 3.189965444 3.189965444 6.379930889 0.000000000
708 O 3.189822031 3.189822031 6.379644062 0.000000000
709 Ti 5.620181151 5.620181151 11.240362302 0.000000000
710 Ti 5.620203384 5.620203384 11.240406767 0.000000000
711 O 3.189854237 3.189854237 6.379708473 0.000000000
712 O 3.189962510 3.189962510 6.379925020 0.000000000
713 O 3.189965445 3.189965445 6.379930889 0.000000000
714 O 3.189822031 3.189822031 6.379644062 0.000000000
715 Ti 5.620215549 5.620215549 11.240431098 0.000000000
716 Ti 5.620214434 5.620214434 11.240428868 0.000000000
717 O 3.189816380 3.189816380 6.379632759 0.000000000
718 O 3.189900108 3.189900108 6.379800217 0.000000000
719 O 3.190001238 3.190001238 6.380002475 0.000000000
720 O 3.189844030 3.189844030 6.379688061 0.000000000
721 Ti 5.620215548 5.620215548 11.240431095 0.000000000
722 Ti 5.620214435 5.620214435 11.240428869 0.000000000
723 O 3.189816380 3.189816380 6.379632759 0.000000000
724 O 3.189900109 3.189900109 6.379800217 0.000000000
725 O 3.190001238 3.190001238 6.380002475 0.000000000
726 O 3.189844031 3.189844031 6.379688061 0.000000000
727 Ti 5.620215549 5.620215549 11.240431097 0.000000000
728 Ti 5.620214434 5.620214434 11.240428868 0.000000000
729 O 3.189816380 3.189816380 6.379632760 0.000000000
730 O 3.189900108 3.189900108 6.379800216 0.000000000
731 O 3.190001238 3.190001238 6.380002476 0.000000000
732 O 3.189844030 3.189844030 6.379688061 0.000000000
733 Ti 5.620215549 5.620215549 11.240431099 0.000000000
734 Ti 5.620214434 5.620214434 11.240428868 0.000000000
735 O 3.189816380 3.189816380 6.379632760 0.000000000
736 O 3.189900108 3.189900108 6.379800216 0.000000000
737 O 3.190001237 3.190001237 6.380002475 0.000000000
738 O 3.189844030 3.189844030 6.379688060 0.000000000
739 Ti 5.620215549 5.620215549 11.240431099 0.000000000
740 Ti 5.620214435 5.620214435 11.240428869 0.000000000
741 O 3.189816380 3.189816380 6.379632759 0.000000000
742 O 3.189900108 3.189900108 6.379800217 0.000000000
743 O 3.190001238 3.190001238 6.380002476 0.000000000
744 O 3.189844030 3.189844030 6.379688061 0.000000000
745 Ti 5.620215549 5.620215549 11.240431097 0.000000000
746 Ti 5.620214434 5.620214434 11.240428868 0.000000000
747 O 3.189816380 3.189816380 6.379632759 0.000000000
748 O 3.189900108 3.189900108 6.379800216 0.000000000
749 O 3.190001238 3.190001238 6.380002476 0.000000000
750 O 3.189844030 3.189844030 6.379688061 0.000000000
751 Ti 5.620215548 5.620215548 11.240431096 0.000000000
752 Ti 5.620214434 5.620214434 11.240428868 0.000000000
753 O 3.189816380 3.189816380 6.379632759 0.000000000
754 O 3.189900108 3.189900108 6.379800216 0.000000000
755 O 3.190001238 3.190001238 6.380002476 0.000000000
756 O 3.189844030 3.189844030 6.379688060 0.000000000
757 Ti 5.620225492 5.620225492 11.240450983 0.000000000
758 Ti 5.620208789 5.620208789 11.240417578 0.000000000
759 O 3.189884502 3.189884502 6.379769003 0.000000000
760 O 3.189792372 3.189792372 6.379584744 0.000000000
761 O 3.189936420 3.189936420 6.379872839 0.000000000
762 O 3.189936419 3.189936419 6.379872839 0.000000000
763 Ti 5.620225492 5.620225492 11.240450984 0.000000000
764 Ti 5.620208789 5.620208789 11.240417577 0.000000000
765 O 3.189884502 3.189884502 6.379769004 0.000000000
766 O 3.189792372 3.189792372 6.379584743 0.000000000
767 O 3.189936420 3.189936420 6.379872839 0.000000000
768 O 3.189936420 3.189936420 6.379872840 0.000000000
769 Ti 5.620225492 5.620225492 11.240450983 0.000000000
770 Ti 5.620208789 5.620208789 11.240417577 0.000000000
771 O 3.189884502 3.189884502 6.379769004 0.000000000
772 O 3.189792372 3.189792372 6.379584744 0.000000000
773 O 3.189936419 3.189936419 6.379872839 0.000000000
774 O 3.189936419 3.189936419 6.379872839 0.000000000
775 Ti 5.620225492 5.620225492 11.240450983 0.000000000
776 Ti 5.620208788 5.620208788 11.240417577 0.000000000
777 O 3.189884502 3.189884502 6.379769004 0.000000000
778 O 3.189792372 3.189792372 6.379584744 0.000000000
779 O 3.189936420 3.189936420 6.379872839 0.000000000
780 O 3.189936420 3.189936420 6.379872839 0.000000000
781 Ti 5.620225492 5.620225492 11.240450984 0.000000000
782 Ti 5.620208789 5.620208789 11.240417578 0.000000000
783 O 3.189884502 3.189884502 6.379769004 0.000000000
784 O 3.189792372 3.189792372 6.379584744 0.000000000
785 O 3.189936420 3.189936420 6.379872839 0.000000000
786 O 3.189936419 3.189936419 6.379872839 0.000000000
787 Ti 5.620225492 5.620225492 11.240450984 0.000000000
788 Ti 5.620208789 5.620208789 11.240417578 0.000000000
789 O 3.189884502 3.189884502 6.379769004 0.000000000
790 O 3.189792372 3.189792372 6.379584743 0.000000000
791 O 3.189936419 3.189936419 6.379872839 0.000000000
792 O 3.189936419 3.189936419 6.379872839 0.000000000
793 Ti 5.620225492 5.620225492 11.240450984 0.000000000
794 Ti 5.620208789 5.620208789 11.240417579 0.000000000
795 O 3.189884502 3.189884502 6.379769004 0.000000000
796 O 3.189792372 3.189792372 6.379584743 0.000000000
797 O 3.189936419 3.189936419 6.379872839 0.000000000
798 O 3.189936419 3.189936419 6.379872838 0.000000000
799 Ti 5.620200301 5.620200301 11.240400602 0.000000000
800 Ti 5.620183248 5.620183248 11.240366496 0.000000000
801 O 3.189974293 3.189974293 6.379948585 0.000000000
802 O 3.189788408 3.189788408 6.379576815 0.000000000
803 O 3.189877371 3.189877371 6.379754741 0.000000000
804 O 3.189982900 3.189982900 6.379965800 0.000000000
805 Ti 5.620200300 5.620200300 11.240400601 0.000000000
806 Ti 5.620183248 5.620183248 11.240366496 0.000000000
807 O 3.189974293 3.189974293 6.379948586 0.000000000
808 O 3.189788408 3.189788408 6.379576816 0.000000000
809 O 3.189877371 3.189877371 6.379754742 0.000000000
810 O 3.189982900 3.189982900 6.379965801 0.000000000
811 Ti 5.620200299 5.620200299 11.240400599 0.000000000
812 Ti 5.620183247 5.620183247 11.240366494 0.000000000
813 O 3.189974293 3.189974293 6.379948586 0.000000000
814 O 3.189788408 3.189788408 6.379576815 0.000000000
815 O 3.189877371 3.189877371 6.379754743 0.000000000
816 O 3.189982900 3.189982900 6.379965800 0.000000000
817 Ti 5.620200299 5.620200299 11.240400599 0.000000000
818 Ti 5.620183248 5.620183248 11.240366497 0.000000000
819 O 3.189974293 3.189974293 6.379948586 0.000000000
820 O 3.189788407 3.189788407 6.379576815 0.000000000
821 O 3.189877371 3.189877371 6.379754743 0.000000000
822 O 3.189982900 3.189982900 6.379965800 0.000000000
823 Ti 5.620200300 5.620200300 11.240400599 0.000000000
824 Ti 5.620183247 5.620183247 11.240366495 0.000000000
825 O 3.189974293 3.189974293 6.379948587 0.000000000
826 O 3.189788407 3.189788407 6.379576814 0.000000000
827 O 3.189877371 3.189877371 6.379754742 0.000000000
828 O 3.189982900 3.189982900 6.379965801 0.000000000
829 Ti 5.620200299 5.620200299 11.240400598 0.000000000
830 Ti 5.620183248 5.620183248 11.240366495 0.000000000
831 O 3.189974293 3.189974293 6.379948586 0.000000000
832 O 3.189788407 3.189788407 6.379576815 0.000000000
833 O 3.189877371 3.189877371 6.379754742 0.000000000
834 O 3.189982900 3.189982900 6.379965800 0.000000000
835 Ti 5.620200300 5.620200300 11.240400599 0.000000000
836 Ti 5.620183248 5.620183248 11.240366496 0.000000000
837 O 3.189974293 3.189974293 6.379948587 0.000000000
838 O 3.189788407 3.189788407 6.379576814 0.000000000
839 O 3.189877371 3.189877371 6.379754742 0.000000000
840 O 3.189982900 3.189982900 6.379965800 0.000000000
841 Ti 5.620196861 5.620196861 11.240393722 0.000000000
842 Ti 5.620174130 5.620174130 11.240348260 0.000000000
843 O 3.189967336 3.189967336 6.379934671 0.000000000
844 O 3.189878654 3.189878654 6.379757309 0.000000000
845 O 3.189926021 3.189926021 6.379852043 0.000000000
846 O 3.189879187 3.189879187 6.379758374 0.000000000
847 Ti 5.620196862 5.620196862 11.240393724 0.000000000
848 Ti 5.620174130 5.620174130 11.240348261 0.000000000
849 O 3.189967336 3.189967336 6.379934672 0.000000000
850 O 3.189878655 3.189878655 6.379757309 0.000000000
851 O 3.189926022 3.189926022 6.379852044 0.000000000
852 O 3.189879187 3.189879187 6.379758374 0.000000000
853 Ti 5.620196862 5.620196862 11.240393724 0.000000000
854 Ti 5.620174130 5.620174130 11.240348259 0.000000000
855 O 3.189967336 3.189967336 6.379934672 0.000000000
856 O 3.189878655 3.189878655 6.379757309 0.000000000
857 O 3.189926022 3.189926022 6.379852043 0.000000000
858 O 3.189879187 3.189879187 6.379758375 0.000000000
859 Ti 5.620196862 5.620196862 11.240393723 0.000000000
860 Ti 5.620174130 5.620174130 11.240348259 0.000000000
861 O 3.189967336 3.189967336 6.379934671 0.000000000
862 O 3.189878654 3.189878654 6.379757309 0.000000000
863 O 3.189926021 3.189926021 6.379852043 0.000000000
864 O 3.189879187 3.189879187 6.379758375 0.000000000
865 Ti 5.620196862 5.620196862 11.240393724 0.000000000
866 Ti 5.620174130 5.620174130 11.240348259 0.000000000
867 O 3.189967336 3.189967336 6.379934672 0.000000000
868 O 3.189878654 3.189878654 6.379757309 0.000000000
869 O 3.189926021 3.189926021 6.379852043 0.000000000
870 O 3.189879187 3.189879187 6.379758374 0.000000000
871 Ti 5.620196862 5.620196862 11.240393724 0.000000000
872 Ti 5.620174130 5.620174130 11.240348260 0.000000000
873 O 3.189967336 3.189967336 6.379934672 0.000000000
874 O 3.189878654 3.189878654 6.379757309 0.000000000
875 O 3.189926021 3.189926021 6.379852042 0.000000000
876 O 3.189879187 3.189879187 6.379758374 0.000000000
877 Ti 5.620196862 5.620196862 11.240393723 0.000000000
878 Ti 5.620174129 5.620174129 11.240348259 0.000000000
879 O 3.189967336 3.189967336 6.379934672 0.000000000
880 O 3.189878655 3.189878655 6.379757309 0.000000000
881 O 3.189926021 3.189926021 6.379852043 0.000000000
882 O 3.189879187 3.189879187 6.379758374 0.000000000
883 Ti 5.620158494 5.620158494 11.240316989 0.000000000
884 Ti 5.620200108 5.620200108 11.240400215 0.000000000
885 O 3.189911576 3.189911576 6.379823151 0.000000000
886 O 3.189928129 3.189928129 6.379856259 0.000000000
887 O 3.189954799 3.189954799 6.379909597 0.000000000
888 O 3.189785428 3.189785428 6.379570856 0.000000000
889 Ti 5.620158494 5.620158494 11.240316988 0.000000000
890 Ti 5.620200109 5.620200109 11.240400217 0.000000000
891 O 3.189911576 3.189911576 6.379823151 0.000000000
892 O 3.189928129 3.189928129 6.379856259 0.000000000
893 O 3.189954799 3.189954799 6.379909598 0.000000000
894 O 3.189785427 3.189785427 6.379570855 0.000000000
895 Ti 5.620158494 5.620158494 11.240316988 0.000000000
896 Ti 5.620200107 5.620200107 11.240400214 0.000000000
897 O 3.189911576 3.189911576 6.379823151 0.000000000
898 O 3.189928129 3.189928129 6.379856259 0.000000000
899 O 3.189954798 3.189954798 6.379909597 0.000000000
900 O 3.189785428 3.189785428 6.379570855 0.000000000
901 Ti 5.620158494 5.620158494 11.240316988 0.000000000
902 Ti 5.620200107 5.620200107 11.240400215 0.000000000
903 O 3.189911576 3.189911576 6.379823151 0.000000000
904 O 3.189928129 3.189928129 6.379856259 0.000000000
905 O 3.189954798 3.189954798 6.379909597 0.000000000
906 O 3.189785428 3.189785428 6.379570856 0.000000000
907 Ti 5.620158494 5.620158494 11.240316988 0.000000000
908 Ti 5.620200108 5.620200108 11.240400216 0.000000000
909 O 3.189911575 3.189911575 6.379823151 0.000000000
910 O 3.189928129 3.189928129 6.379856259 0.000000000
911 O 3.189954799 3.189954799 6.379909597 0.000000000
912 O 3.189785427 3.189785427 6.379570855 0.000000000
913 Ti 5.620158494 5.620158494 11.240316989 0.000000000
914 Ti 5.620200108 5.620200108 11.240400216 0.000000000
915 O 3.189911576 3.189911576 6.379823151 0.000000000
916 O 3.189928129 3.189928129 6.379856259 0.000000000
917 O 3.189954798 3.189954798 6.379909597 0.000000000
918 O 3.189785428 3.189785428 6.379570856 0.000000000
919 Ti 5.620158495 5.620158495 11.240316989 0.000000000
920 Ti 5.620200108 5.620200108 11.240400216 0.000000000
921 O 3.189911575 3.189911575 6.379823151 0.000000000
922 O 3.189928130 3.189928130 6.379856259 0.000000000
923 O 3.189954798 3.189954798 6.379909597 0.000000000
924 O 3.189785428 3.189785428 6.379570855 0.000000000
925 Ti 5.620150679 5.620150679 11.240301358 0.000000000
926 Ti 5.620227304 5.620227304 11.240454608 0.000000000
927 O 3.189922799 3.189922799 6.379845598 0.000000000
928 O 3.189870698 3.189870698 6.379741396 0.000000000
929 O 3.189998016 3.189998016 6.379996031 0.000000000
930 O 3.189769551 3.189769551 6.379539101 0.000000000
931 Ti 5.620150679 5.620150679 11.240301358 0.000000000
932 Ti 5.620227304 5.620227304 11.240454608 0.000000000
933 O 3.189922800 3.189922800 6.379845600 0.000000000
934 O 3.189870698 3.189870698 6.379741395 0.000000000
935 O 3.189998016 3.189998016 6.379996032 0.000000000
936 O 3.189769551 3.189769551 6.379539102 0.000000000
937 Ti 5.620150679 5.620150679 11.240301358 0.000000000
938 Ti 5.620227304 5.620227304 11.240454608 0.000000000
939 O 3.189922800 3.189922800 6.379845599 0.000000000
940 O 3.189870698 3.189870698 6.379741396 0.000000000
941 O 3.189998015 3.189998015 6.379996031 0.000000000
942 O 3.189769551 3.189769551 6.379539101 0.000000000
943 Ti 5.620150679 5.620150679 11.240301358 0.000000000
944 Ti 5.620227304 5.620227304 11.240454609 0.000000000
945 O 3.189922800 3.189922800 6.379845599 0.000000000
946 O 3.189870698 3.189870698 6.379741396 0.000000000
947 O 3.189998016 3.189998016 6.379996031 0.000000000
948 O 3.189769551 3.189769551 6.379539102 0.000000000
949 Ti 5.620150679 5.620150679 11.240301358 0.000000000
950 Ti 5.620227304 5.620227304 11.240454608 0.000000000
951 O 3.189922799 3.189922799 6.379845599 0.000000000
952 O 3.189870698 3.189870698 6.379741396 0.000000000
953 O 3.189998015 3.189998015 6.379996031 0.000000000
954 O 3.189769551 3.189769551 6.379539102 0.000000000
955 Ti 5.620150679 5.620150679 11.240301358 0.000000000
956 Ti 5.620227304 5.620227304 11.240454608 0.000000000
957 O 3.189922800 3.189922800 6.379845599 0.000000000
958 O 3.189870698 3.189870698 6.379741396 0.000000000
959 O 3.189998015 3.189998015 6.379996031 0.000000000
960 O 3.189769550 3.189769550 6.379539101 0.000000000
961 Ti 5.620150679 5.620150679 11.240301358 0.000000000
962 Ti 5.620227304 5.620227304 11.240454608 0.000000000
963 O 3.189922799 3.189922799 6.379845599 0.000000000
964 O 3.189870698 3.189870698 6.379741395 0.000000000
965 O 3.189998016 3.189998016 6.379996032 0.000000000
966 O 3.189769551 3.189769551 6.379539102 0.000000000
967 Ti 5.620200299 5.620200299 11.240400599 0.000000000
968 Ti 5.620183247 5.620183247 11.240366495 0.000000000
969 O 3.189974293 3.189974293 6.379948586 0.000000000
970 O 3.189788408 3.189788408 6.379576815 0.000000000
971 O 3.189982900 3.189982900 6.379965801 0.000000000
972 O 3.189877371 3.189877371 6.379754742 0.000000000
973 Ti 5.620200299 5.620200299 11.240400598 0.000000000
974 Ti 5.620183248 5.620183248 11.240366495 0.000000000
975 O 3.189974293 3.189974293 6.379948587 0.000000000
976 O 3.189788408 3.189788408 6.379576815 0.000000000
977 O 3.189982900 3.189982900 6.379965800 0.000000000
978 O 3.189877371 3.189877371 6.379754742 0.000000000
979 Ti 5.620200300 5.620200300 11.240400599 0.000000000
980 Ti 5.620183247 5.620183247 11.240366495 0.000000000
981 O 3.189974293 3.189974293 6.379948586 0.000000000
982 O 3.189788408 3.189788408 6.379576816 0.000000000
983 O 3.189982900 3.189982900 6.379965801 0.000000000
984 O 3.189877371 3.189877371 6.379754742 0.000000000
985 Ti 5.620200299 5.620200299 11.240400599 0.000000000
986 Ti 5.620183248 5.620183248 11.240366496 0.000000000
987 O 3.189974293 3.189974293 6.379948586 0.000000000
988 O 3.189788408 3.189788408 6.379576816 0.000000000
989 O 3.189982901 3.189982901 6.379965801 0.000000000
990 O 3.189877371 3.189877371 6.379754743 0.000000000
991 Ti 5.620200300 5.620200300 11.240400599 0.000000000
992 Ti 5.620183248 5.620183248 11.240366496 0.000000000
993 O 3.189974293 3.189974293 6.379948586 0.000000000
994 O 3.189788408 3.189788408 6.379576815 0.000000000
995 O 3.189982901 3.189982901 6.379965801 0.000000000
996 O 3.189877371 3.189877371 6.379754742 0.000000000
997 Ti 5.620200300 5.620200300 11.240400599 0.000000000
998 Ti 5.620183247 5.620183247 11.240366494 0.000000000
999 O 3.189974293 3.189974293 6.379948587 0.000000000
1000 O 3.189788408 3.189788408 6.379576815 0.000000000
1001 O 3.189982901 3.189982901 6.379965802 0.000000000
1002 O 3.189877371 3.189877371 6.379754743 0.000000000
1003 Ti 5.620200300 5.620200300 11.240400600 0.000000000
1004 Ti 5.620183248 5.620183248 11.240366496 0.000000000
1005 O 3.189974293 3.189974293 6.379948586 0.000000000
1006 O 3.189788408 3.189788408 6.379576816 0.000000000
1007 O 3.189982900 3.189982900 6.379965801 0.000000000
1008 O 3.189877371 3.189877371 6.379754742 0.000000000
1009 Ti 5.620232667 5.620232667 11.240465334 0.000000000
1010 Ti 5.620132598 5.620132598 11.240265195 0.000000000
1011 O 3.190012424 3.190012424 6.380024849 0.000000000
1012 O 3.189803201 3.189803201 6.379606402 0.000000000
1013 O 3.189939647 3.189939647 6.379879295 0.000000000
1014 O 3.189939647 3.189939647 6.379879293 0.000000000
1015 Ti 5.620232667 5.620232667 11.240465335 0.000000000
1016 Ti 5.620132598 5.620132598 11.240265197 0.000000000
1017 O 3.190012424 3.190012424 6.380024848 0.000000000
1018 O 3.189803201 3.189803201 6.379606402 0.000000000
1019 O 3.189939647 3.189939647 6.379879294 0.000000000
1020 O 3.189939647 3.189939647 6.379879293 0.000000000
1021 Ti 5.620232667 5.620232667 11.240465334 0.000000000
1022 Ti 5.620132598 5.620132598 11.240265197 0.000000000
1023 O 3.190012424 3.190012424 6.380024848 0.000000000
1024 O 3.189803201 3.189803201 6.379606402 0.000000000
1025 O 3.189939647 3.189939647 6.379879293 0.000000000
1026 O 3.189939647 3.189939647 6.379879294 0.000000000
1027 Ti 5.620232667 5.620232667 11.240465334 0.000000000
1028 Ti 5.620132599 5.620132599 11.240265198 0.000000000
1029 O 3.190012424 3.190012424 6.380024847 0.000000000
1030 O 3.189803202 3.189803202 6.379606403 0.000000000
1031 O 3.189939647 3.189939647 6.379879294 0.000000000
1032 O 3.189939647 3.189939647 6.379879293 0.000000000
1033 Ti 5.620232667 5.620232667 11.240465333 0.000000000
1034 Ti 5.620132598 5.620132598 11.240265197 0.000000000
1035 O 3.190012424 3.190012424 6.380024847 0.000000000
1036 O 3.189803201 3.189803201 6.379606402 0.000000000
1037 O 3.189939647 3.189939647 6.379879294 0.000000000
1038 O 3.189939647 3.189939647 6.379879293 0.000000000
1039 Ti 5.620232667 5.620232667 11.240465335 0.000000000
1040 Ti 5.620132598 5.620132598 11.240265196 0.000000000
1041 O 3.190012424 3.190012424 6.380024848 0.000000000
1042 O 3.189803201 3.189803201 6.379606402 0.000000000
1043 O 3.189939647 3.189939647 6.379879294 0.000000000
1044 O 3.189939647 3.189939647 6.379879294 0.000000000
1045 Ti 5.620232667 5.620232667 11.240465335 0.000000000
1046 Ti 5.620132598 5.620132598 11.240265196 0.000000000
1047 O 3.190012424 3.190012424 6.380024848 0.000000000
1048 O 3.189803201 3.189803201 6.379606402 0.000000000
1049 O 3.189939647 3.189939647 6.379879294 0.000000000
1050 O 3.189939647 3.189939647 6.379879294 0.000000000
Sum of MulP: up = 4200.00000 down = 4200.00000
total= 8400.00000 ideal(neutral)= 8400.00000
Decomposed Mulliken populations
1 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000792710 1.000792710 2.001585420 0.000000000
sum over m 1.000792710 1.000792710 2.001585420 0.000000000
s 1 0.207394236 0.207394236 0.414788472 0.000000000
sum over m 0.207394236 0.207394236 0.414788472 0.000000000
s 2 0.014719817 0.014719817 0.029439634 0.000000000
sum over m 0.014719817 0.014719817 0.029439634 0.000000000
sum over m+mul 1.222906763 1.222906763 2.445813526 0.000000000
px 0 1.006382750 1.006382750 2.012765500 0.000000000
py 0 1.006382750 1.006382750 2.012765500 0.000000000
pz 0 1.006206037 1.006206037 2.012412075 0.000000000
sum over m 3.018971538 3.018971538 6.037943075 0.000000000
px 1 0.065444368 0.065444368 0.130888736 0.000000000
py 1 0.065444368 0.065444368 0.130888736 0.000000000
pz 1 0.040353509 0.040353509 0.080707018 0.000000000
sum over m 0.171242245 0.171242245 0.342484489 0.000000000
sum over m+mul 3.190213782 3.190213782 6.380427564 0.000000000
d3z^2-r^2 0 0.196323991 0.196323991 0.392647981 0.000000000
dx^2-y^2 0 0.201543820 0.201543820 0.403087641 0.000000000
dxy 0 0.250927765 0.250927765 0.501855531 0.000000000
dxz 0 0.268484750 0.268484750 0.536969500 0.000000000
dyz 0 0.268484750 0.268484750 0.536969500 0.000000000
sum over m 1.185765076 1.185765076 2.371530152 0.000000000
d3z^2-r^2 1 0.003471724 0.003471724 0.006943449 0.000000000
dx^2-y^2 1 -0.004484891 -0.004484891 -0.008969782 0.000000000
dxy 1 0.015347963 0.015347963 0.030695926 0.000000000
dxz 1 0.003492393 0.003492393 0.006984785 0.000000000
dyz 1 0.003492393 0.003492393 0.006984785 0.000000000
sum over m 0.021319582 0.021319582 0.042639163 0.000000000
sum over m+mul 1.207084658 1.207084658 2.414169316 0.000000000
2 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798791 1.000798791 2.001597581 0.000000000
sum over m 1.000798791 1.000798791 2.001597581 0.000000000
s 1 0.207373702 0.207373702 0.414747404 0.000000000
sum over m 0.207373702 0.207373702 0.414747404 0.000000000
s 2 0.014715434 0.014715434 0.029430869 0.000000000
sum over m 0.014715434 0.014715434 0.029430869 0.000000000
sum over m+mul 1.222887927 1.222887927 2.445775854 0.000000000
px 0 1.006403717 1.006403717 2.012807434 0.000000000
py 0 1.006403717 1.006403717 2.012807434 0.000000000
pz 0 1.006202264 1.006202264 2.012404528 0.000000000
sum over m 3.019009698 3.019009698 6.038019395 0.000000000
px 1 0.065467383 0.065467383 0.130934766 0.000000000
py 1 0.065467383 0.065467383 0.130934766 0.000000000
pz 1 0.040336776 0.040336776 0.080673552 0.000000000
sum over m 0.171271542 0.171271542 0.342543084 0.000000000
sum over m+mul 3.190281240 3.190281240 6.380562479 0.000000000
d3z^2-r^2 0 0.196311880 0.196311880 0.392623760 0.000000000
dx^2-y^2 0 0.201562748 0.201562748 0.403125496 0.000000000
dxy 0 0.250908224 0.250908224 0.501816449 0.000000000
dxz 0 0.268492804 0.268492804 0.536985609 0.000000000
dyz 0 0.268492804 0.268492804 0.536985609 0.000000000
sum over m 1.185768462 1.185768462 2.371536923 0.000000000
d3z^2-r^2 1 0.003467202 0.003467202 0.006934403 0.000000000
dx^2-y^2 1 -0.004488671 -0.004488671 -0.008977342 0.000000000
dxy 1 0.015350486 0.015350486 0.030700972 0.000000000
dxz 1 0.003486282 0.003486282 0.006972564 0.000000000
dyz 1 0.003486282 0.003486282 0.006972565 0.000000000
sum over m 0.021301581 0.021301581 0.042603162 0.000000000
sum over m+mul 1.207070043 1.207070043 2.414140085 0.000000000
3 O Up spin Down spin Sum Diff
multiple
s 0 0.893916460 0.893916460 1.787832921 0.000000000
sum over m 0.893916460 0.893916460 1.787832921 0.000000000
s 1 -0.003041483 -0.003041483 -0.006082966 0.000000000
sum over m -0.003041483 -0.003041483 -0.006082966 0.000000000
sum over m+mul 0.890874977 0.890874977 1.781749955 0.000000000
px 0 0.787015782 0.787015782 1.574031564 0.000000000
py 0 0.787015782 0.787015782 1.574031565 0.000000000
pz 0 0.779712215 0.779712215 1.559424430 0.000000000
sum over m 2.353743779 2.353743779 4.707487559 0.000000000
px 1 -0.008737627 -0.008737627 -0.017475254 0.000000000
py 1 -0.008737627 -0.008737627 -0.017475254 0.000000000
pz 1 -0.006463561 -0.006463561 -0.012927122 0.000000000
sum over m -0.023938815 -0.023938815 -0.047877630 0.000000000
sum over m+mul 2.329804964 2.329804964 4.659609929 0.000000000
d3z^2-r^2 0 -0.006392408 -0.006392408 -0.012784817 0.000000000
dx^2-y^2 0 -0.005054666 -0.005054666 -0.010109331 0.000000000
dxy 0 -0.005435110 -0.005435110 -0.010870221 0.000000000
dxz 0 -0.006925821 -0.006925821 -0.013851641 0.000000000
dyz 0 -0.006925821 -0.006925821 -0.013851641 0.000000000
sum over m -0.030733826 -0.030733826 -0.061467651 0.000000000
sum over m+mul -0.030733826 -0.030733826 -0.061467651 0.000000000
4 O Up spin Down spin Sum Diff
multiple
s 0 0.893917064 0.893917064 1.787834128 0.000000000
sum over m 0.893917064 0.893917064 1.787834128 0.000000000
s 1 -0.003040083 -0.003040083 -0.006080166 0.000000000
sum over m -0.003040083 -0.003040083 -0.006080166 0.000000000
sum over m+mul 0.890876981 0.890876981 1.781753961 0.000000000
px 0 0.786976422 0.786976422 1.573952843 0.000000000
py 0 0.786976421 0.786976421 1.573952843 0.000000000
pz 0 0.779775183 0.779775183 1.559550366 0.000000000
sum over m 2.353728026 2.353728026 4.707456052 0.000000000
px 1 -0.008740451 -0.008740451 -0.017480902 0.000000000
py 1 -0.008740451 -0.008740451 -0.017480902 0.000000000
pz 1 -0.006464374 -0.006464374 -0.012928749 0.000000000
sum over m -0.023945276 -0.023945276 -0.047890552 0.000000000
sum over m+mul 2.329782750 2.329782750 4.659565500 0.000000000
d3z^2-r^2 0 -0.006392823 -0.006392823 -0.012785645 0.000000000
dx^2-y^2 0 -0.005058424 -0.005058424 -0.010116847 0.000000000
dxy 0 -0.005435268 -0.005435268 -0.010870535 0.000000000
dxz 0 -0.006929225 -0.006929225 -0.013858451 0.000000000
dyz 0 -0.006929225 -0.006929225 -0.013858451 0.000000000
sum over m -0.030744965 -0.030744965 -0.061489930 0.000000000
sum over m+mul -0.030744965 -0.030744965 -0.061489930 0.000000000
5 O Up spin Down spin Sum Diff
multiple
s 0 0.893904549 0.893904549 1.787809098 0.000000000
sum over m 0.893904549 0.893904549 1.787809098 0.000000000
s 1 -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m+mul 0.890864301 0.890864301 1.781728602 0.000000000
px 0 0.787007928 0.787007928 1.574015856 0.000000000
py 0 0.786908049 0.786908049 1.573816098 0.000000000
pz 0 0.779806732 0.779806732 1.559613464 0.000000000
sum over m 2.353722709 2.353722709 4.707445418 0.000000000
px 1 -0.008743770 -0.008743770 -0.017487540 0.000000000
py 1 -0.008738770 -0.008738770 -0.017477540 0.000000000
pz 1 -0.006466011 -0.006466011 -0.012932023 0.000000000
sum over m -0.023948552 -0.023948552 -0.047897103 0.000000000
sum over m+mul 2.329774158 2.329774158 4.659548315 0.000000000
d3z^2-r^2 0 -0.006392501 -0.006392501 -0.012785003 0.000000000
dx^2-y^2 0 -0.005059917 -0.005059917 -0.010119835 0.000000000
dxy 0 -0.005434716 -0.005434716 -0.010869432 0.000000000
dxz 0 -0.006930121 -0.006930121 -0.013860241 0.000000000
dyz 0 -0.006931920 -0.006931920 -0.013863839 0.000000000
sum over m -0.030749175 -0.030749175 -0.061498350 0.000000000
sum over m+mul -0.030749175 -0.030749175 -0.061498350 0.000000000
6 O Up spin Down spin Sum Diff
multiple
s 0 0.893904549 0.893904549 1.787809098 0.000000000
sum over m 0.893904549 0.893904549 1.787809098 0.000000000
s 1 -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m+mul 0.890864301 0.890864301 1.781728602 0.000000000
px 0 0.786908049 0.786908049 1.573816098 0.000000000
py 0 0.787007929 0.787007929 1.574015857 0.000000000
pz 0 0.779806732 0.779806732 1.559613464 0.000000000
sum over m 2.353722709 2.353722709 4.707445418 0.000000000
px 1 -0.008738770 -0.008738770 -0.017477540 0.000000000
py 1 -0.008743770 -0.008743770 -0.017487540 0.000000000
pz 1 -0.006466012 -0.006466012 -0.012932023 0.000000000
sum over m -0.023948552 -0.023948552 -0.047897103 0.000000000
sum over m+mul 2.329774158 2.329774158 4.659548315 0.000000000
d3z^2-r^2 0 -0.006392502 -0.006392502 -0.012785003 0.000000000
dx^2-y^2 0 -0.005059917 -0.005059917 -0.010119835 0.000000000
dxy 0 -0.005434716 -0.005434716 -0.010869432 0.000000000
dxz 0 -0.006931920 -0.006931920 -0.013863839 0.000000000
dyz 0 -0.006930121 -0.006930121 -0.013860241 0.000000000
sum over m -0.030749175 -0.030749175 -0.061498350 0.000000000
sum over m+mul -0.030749175 -0.030749175 -0.061498350 0.000000000
7 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000792710 1.000792710 2.001585420 0.000000000
sum over m 1.000792710 1.000792710 2.001585420 0.000000000
s 1 0.207394236 0.207394236 0.414788471 0.000000000
sum over m 0.207394236 0.207394236 0.414788471 0.000000000
s 2 0.014719817 0.014719817 0.029439634 0.000000000
sum over m 0.014719817 0.014719817 0.029439634 0.000000000
sum over m+mul 1.222906763 1.222906763 2.445813525 0.000000000
px 0 1.006382750 1.006382750 2.012765500 0.000000000
py 0 1.006382750 1.006382750 2.012765500 0.000000000
pz 0 1.006206037 1.006206037 2.012412074 0.000000000
sum over m 3.018971538 3.018971538 6.037943075 0.000000000
px 1 0.065444368 0.065444368 0.130888736 0.000000000
py 1 0.065444368 0.065444368 0.130888736 0.000000000
pz 1 0.040353509 0.040353509 0.080707018 0.000000000
sum over m 0.171242245 0.171242245 0.342484490 0.000000000
sum over m+mul 3.190213782 3.190213782 6.380427565 0.000000000
d3z^2-r^2 0 0.196323991 0.196323991 0.392647981 0.000000000
dx^2-y^2 0 0.201543820 0.201543820 0.403087641 0.000000000
dxy 0 0.250927765 0.250927765 0.501855531 0.000000000
dxz 0 0.268484750 0.268484750 0.536969500 0.000000000
dyz 0 0.268484750 0.268484750 0.536969500 0.000000000
sum over m 1.185765076 1.185765076 2.371530152 0.000000000
d3z^2-r^2 1 0.003471724 0.003471724 0.006943449 0.000000000
dx^2-y^2 1 -0.004484891 -0.004484891 -0.008969782 0.000000000
dxy 1 0.015347963 0.015347963 0.030695926 0.000000000
dxz 1 0.003492393 0.003492393 0.006984785 0.000000000
dyz 1 0.003492393 0.003492393 0.006984785 0.000000000
sum over m 0.021319582 0.021319582 0.042639163 0.000000000
sum over m+mul 1.207084658 1.207084658 2.414169315 0.000000000
8 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798791 1.000798791 2.001597581 0.000000000
sum over m 1.000798791 1.000798791 2.001597581 0.000000000
s 1 0.207373702 0.207373702 0.414747405 0.000000000
sum over m 0.207373702 0.207373702 0.414747405 0.000000000
s 2 0.014715434 0.014715434 0.029430869 0.000000000
sum over m 0.014715434 0.014715434 0.029430869 0.000000000
sum over m+mul 1.222887927 1.222887927 2.445775854 0.000000000
px 0 1.006403717 1.006403717 2.012807434 0.000000000
py 0 1.006403717 1.006403717 2.012807434 0.000000000
pz 0 1.006202264 1.006202264 2.012404528 0.000000000
sum over m 3.019009698 3.019009698 6.038019395 0.000000000
px 1 0.065467383 0.065467383 0.130934766 0.000000000
py 1 0.065467383 0.065467383 0.130934766 0.000000000
pz 1 0.040336776 0.040336776 0.080673553 0.000000000
sum over m 0.171271542 0.171271542 0.342543085 0.000000000
sum over m+mul 3.190281240 3.190281240 6.380562480 0.000000000
d3z^2-r^2 0 0.196311880 0.196311880 0.392623760 0.000000000
dx^2-y^2 0 0.201562748 0.201562748 0.403125497 0.000000000
dxy 0 0.250908225 0.250908225 0.501816450 0.000000000
dxz 0 0.268492805 0.268492805 0.536985609 0.000000000
dyz 0 0.268492804 0.268492804 0.536985609 0.000000000
sum over m 1.185768462 1.185768462 2.371536924 0.000000000
d3z^2-r^2 1 0.003467202 0.003467202 0.006934403 0.000000000
dx^2-y^2 1 -0.004488671 -0.004488671 -0.008977342 0.000000000
dxy 1 0.015350486 0.015350486 0.030700972 0.000000000
dxz 1 0.003486282 0.003486282 0.006972565 0.000000000
dyz 1 0.003486282 0.003486282 0.006972565 0.000000000
sum over m 0.021301581 0.021301581 0.042603162 0.000000000
sum over m+mul 1.207070043 1.207070043 2.414140086 0.000000000
9 O Up spin Down spin Sum Diff
multiple
s 0 0.893916460 0.893916460 1.787832921 0.000000000
sum over m 0.893916460 0.893916460 1.787832921 0.000000000
s 1 -0.003041483 -0.003041483 -0.006082966 0.000000000
sum over m -0.003041483 -0.003041483 -0.006082966 0.000000000
sum over m+mul 0.890874978 0.890874978 1.781749955 0.000000000
px 0 0.787015782 0.787015782 1.574031564 0.000000000
py 0 0.787015782 0.787015782 1.574031564 0.000000000
pz 0 0.779712215 0.779712215 1.559424431 0.000000000
sum over m 2.353743780 2.353743780 4.707487559 0.000000000
px 1 -0.008737627 -0.008737627 -0.017475254 0.000000000
py 1 -0.008737627 -0.008737627 -0.017475254 0.000000000
pz 1 -0.006463561 -0.006463561 -0.012927122 0.000000000
sum over m -0.023938815 -0.023938815 -0.047877630 0.000000000
sum over m+mul 2.329804965 2.329804965 4.659609929 0.000000000
d3z^2-r^2 0 -0.006392408 -0.006392408 -0.012784817 0.000000000
dx^2-y^2 0 -0.005054666 -0.005054666 -0.010109331 0.000000000
dxy 0 -0.005435110 -0.005435110 -0.010870221 0.000000000
dxz 0 -0.006925821 -0.006925821 -0.013851641 0.000000000
dyz 0 -0.006925821 -0.006925821 -0.013851641 0.000000000
sum over m -0.030733826 -0.030733826 -0.061467651 0.000000000
sum over m+mul -0.030733826 -0.030733826 -0.061467651 0.000000000
10 O Up spin Down spin Sum Diff
multiple
s 0 0.893917064 0.893917064 1.787834128 0.000000000
sum over m 0.893917064 0.893917064 1.787834128 0.000000000
s 1 -0.003040083 -0.003040083 -0.006080166 0.000000000
sum over m -0.003040083 -0.003040083 -0.006080166 0.000000000
sum over m+mul 0.890876981 0.890876981 1.781753962 0.000000000
px 0 0.786976421 0.786976421 1.573952843 0.000000000
py 0 0.786976421 0.786976421 1.573952843 0.000000000
pz 0 0.779775183 0.779775183 1.559550366 0.000000000
sum over m 2.353728026 2.353728026 4.707456051 0.000000000
px 1 -0.008740451 -0.008740451 -0.017480902 0.000000000
py 1 -0.008740451 -0.008740451 -0.017480902 0.000000000
pz 1 -0.006464374 -0.006464374 -0.012928749 0.000000000
sum over m -0.023945276 -0.023945276 -0.047890552 0.000000000
sum over m+mul 2.329782750 2.329782750 4.659565499 0.000000000
d3z^2-r^2 0 -0.006392823 -0.006392823 -0.012785645 0.000000000
dx^2-y^2 0 -0.005058424 -0.005058424 -0.010116847 0.000000000
dxy 0 -0.005435268 -0.005435268 -0.010870535 0.000000000
dxz 0 -0.006929225 -0.006929225 -0.013858451 0.000000000
dyz 0 -0.006929225 -0.006929225 -0.013858451 0.000000000
sum over m -0.030744965 -0.030744965 -0.061489930 0.000000000
sum over m+mul -0.030744965 -0.030744965 -0.061489930 0.000000000
11 O Up spin Down spin Sum Diff
multiple
s 0 0.893904549 0.893904549 1.787809098 0.000000000
sum over m 0.893904549 0.893904549 1.787809098 0.000000000
s 1 -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m+mul 0.890864301 0.890864301 1.781728602 0.000000000
px 0 0.787007928 0.787007928 1.574015857 0.000000000
py 0 0.786908049 0.786908049 1.573816098 0.000000000
pz 0 0.779806732 0.779806732 1.559613464 0.000000000
sum over m 2.353722709 2.353722709 4.707445419 0.000000000
px 1 -0.008743770 -0.008743770 -0.017487540 0.000000000
py 1 -0.008738770 -0.008738770 -0.017477540 0.000000000
pz 1 -0.006466011 -0.006466011 -0.012932023 0.000000000
sum over m -0.023948552 -0.023948552 -0.047897103 0.000000000
sum over m+mul 2.329774158 2.329774158 4.659548316 0.000000000
d3z^2-r^2 0 -0.006392501 -0.006392501 -0.012785003 0.000000000
dx^2-y^2 0 -0.005059917 -0.005059917 -0.010119835 0.000000000
dxy 0 -0.005434716 -0.005434716 -0.010869432 0.000000000
dxz 0 -0.006930121 -0.006930121 -0.013860241 0.000000000
dyz 0 -0.006931920 -0.006931920 -0.013863839 0.000000000
sum over m -0.030749175 -0.030749175 -0.061498350 0.000000000
sum over m+mul -0.030749175 -0.030749175 -0.061498350 0.000000000
12 O Up spin Down spin Sum Diff
multiple
s 0 0.893904549 0.893904549 1.787809098 0.000000000
sum over m 0.893904549 0.893904549 1.787809098 0.000000000
s 1 -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m+mul 0.890864301 0.890864301 1.781728602 0.000000000
px 0 0.786908049 0.786908049 1.573816098 0.000000000
py 0 0.787007929 0.787007929 1.574015857 0.000000000
pz 0 0.779806732 0.779806732 1.559613463 0.000000000
sum over m 2.353722709 2.353722709 4.707445419 0.000000000
px 1 -0.008738770 -0.008738770 -0.017477540 0.000000000
py 1 -0.008743770 -0.008743770 -0.017487540 0.000000000
pz 1 -0.006466012 -0.006466012 -0.012932023 0.000000000
sum over m -0.023948552 -0.023948552 -0.047897103 0.000000000
sum over m+mul 2.329774158 2.329774158 4.659548315 0.000000000
d3z^2-r^2 0 -0.006392501 -0.006392501 -0.012785003 0.000000000
dx^2-y^2 0 -0.005059917 -0.005059917 -0.010119835 0.000000000
dxy 0 -0.005434716 -0.005434716 -0.010869432 0.000000000
dxz 0 -0.006931920 -0.006931920 -0.013863839 0.000000000
dyz 0 -0.006930121 -0.006930121 -0.013860241 0.000000000
sum over m -0.030749175 -0.030749175 -0.061498350 0.000000000
sum over m+mul -0.030749175 -0.030749175 -0.061498350 0.000000000
13 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000792710 1.000792710 2.001585420 0.000000000
sum over m 1.000792710 1.000792710 2.001585420 0.000000000
s 1 0.207394236 0.207394236 0.414788472 0.000000000
sum over m 0.207394236 0.207394236 0.414788472 0.000000000
s 2 0.014719817 0.014719817 0.029439634 0.000000000
sum over m 0.014719817 0.014719817 0.029439634 0.000000000
sum over m+mul 1.222906763 1.222906763 2.445813526 0.000000000
px 0 1.006382750 1.006382750 2.012765500 0.000000000
py 0 1.006382750 1.006382750 2.012765500 0.000000000
pz 0 1.006206037 1.006206037 2.012412074 0.000000000
sum over m 3.018971537 3.018971537 6.037943075 0.000000000
px 1 0.065444368 0.065444368 0.130888736 0.000000000
py 1 0.065444368 0.065444368 0.130888736 0.000000000
pz 1 0.040353509 0.040353509 0.080707018 0.000000000
sum over m 0.171242245 0.171242245 0.342484490 0.000000000
sum over m+mul 3.190213782 3.190213782 6.380427565 0.000000000
d3z^2-r^2 0 0.196323991 0.196323991 0.392647981 0.000000000
dx^2-y^2 0 0.201543820 0.201543820 0.403087641 0.000000000
dxy 0 0.250927765 0.250927765 0.501855531 0.000000000
dxz 0 0.268484750 0.268484750 0.536969499 0.000000000
dyz 0 0.268484750 0.268484750 0.536969499 0.000000000
sum over m 1.185765076 1.185765076 2.371530151 0.000000000
d3z^2-r^2 1 0.003471724 0.003471724 0.006943449 0.000000000
dx^2-y^2 1 -0.004484891 -0.004484891 -0.008969782 0.000000000
dxy 1 0.015347963 0.015347963 0.030695926 0.000000000
dxz 1 0.003492393 0.003492393 0.006984785 0.000000000
dyz 1 0.003492393 0.003492393 0.006984785 0.000000000
sum over m 0.021319582 0.021319582 0.042639163 0.000000000
sum over m+mul 1.207084657 1.207084657 2.414169314 0.000000000
14 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798791 1.000798791 2.001597581 0.000000000
sum over m 1.000798791 1.000798791 2.001597581 0.000000000
s 1 0.207373702 0.207373702 0.414747404 0.000000000
sum over m 0.207373702 0.207373702 0.414747404 0.000000000
s 2 0.014715434 0.014715434 0.029430869 0.000000000
sum over m 0.014715434 0.014715434 0.029430869 0.000000000
sum over m+mul 1.222887927 1.222887927 2.445775854 0.000000000
px 0 1.006403717 1.006403717 2.012807434 0.000000000
py 0 1.006403717 1.006403717 2.012807434 0.000000000
pz 0 1.006202264 1.006202264 2.012404528 0.000000000
sum over m 3.019009698 3.019009698 6.038019395 0.000000000
px 1 0.065467383 0.065467383 0.130934766 0.000000000
py 1 0.065467383 0.065467383 0.130934766 0.000000000
pz 1 0.040336776 0.040336776 0.080673553 0.000000000
sum over m 0.171271542 0.171271542 0.342543085 0.000000000
sum over m+mul 3.190281240 3.190281240 6.380562480 0.000000000
d3z^2-r^2 0 0.196311880 0.196311880 0.392623760 0.000000000
dx^2-y^2 0 0.201562748 0.201562748 0.403125497 0.000000000
dxy 0 0.250908225 0.250908225 0.501816449 0.000000000
dxz 0 0.268492804 0.268492804 0.536985609 0.000000000
dyz 0 0.268492804 0.268492804 0.536985608 0.000000000
sum over m 1.185768462 1.185768462 2.371536923 0.000000000
d3z^2-r^2 1 0.003467202 0.003467202 0.006934403 0.000000000
dx^2-y^2 1 -0.004488671 -0.004488671 -0.008977342 0.000000000
dxy 1 0.015350486 0.015350486 0.030700972 0.000000000
dxz 1 0.003486282 0.003486282 0.006972564 0.000000000
dyz 1 0.003486282 0.003486282 0.006972564 0.000000000
sum over m 0.021301581 0.021301581 0.042603162 0.000000000
sum over m+mul 1.207070043 1.207070043 2.414140085 0.000000000
15 O Up spin Down spin Sum Diff
multiple
s 0 0.893916460 0.893916460 1.787832921 0.000000000
sum over m 0.893916460 0.893916460 1.787832921 0.000000000
s 1 -0.003041483 -0.003041483 -0.006082966 0.000000000
sum over m -0.003041483 -0.003041483 -0.006082966 0.000000000
sum over m+mul 0.890874978 0.890874978 1.781749955 0.000000000
px 0 0.787015782 0.787015782 1.574031565 0.000000000
py 0 0.787015782 0.787015782 1.574031564 0.000000000
pz 0 0.779712215 0.779712215 1.559424430 0.000000000
sum over m 2.353743780 2.353743780 4.707487559 0.000000000
px 1 -0.008737627 -0.008737627 -0.017475254 0.000000000
py 1 -0.008737627 -0.008737627 -0.017475254 0.000000000
pz 1 -0.006463561 -0.006463561 -0.012927122 0.000000000
sum over m -0.023938815 -0.023938815 -0.047877630 0.000000000
sum over m+mul 2.329804965 2.329804965 4.659609929 0.000000000
d3z^2-r^2 0 -0.006392408 -0.006392408 -0.012784817 0.000000000
dx^2-y^2 0 -0.005054666 -0.005054666 -0.010109331 0.000000000
dxy 0 -0.005435110 -0.005435110 -0.010870221 0.000000000
dxz 0 -0.006925821 -0.006925821 -0.013851641 0.000000000
dyz 0 -0.006925821 -0.006925821 -0.013851641 0.000000000
sum over m -0.030733826 -0.030733826 -0.061467651 0.000000000
sum over m+mul -0.030733826 -0.030733826 -0.061467651 0.000000000
16 O Up spin Down spin Sum Diff
multiple
s 0 0.893917064 0.893917064 1.787834128 0.000000000
sum over m 0.893917064 0.893917064 1.787834128 0.000000000
s 1 -0.003040083 -0.003040083 -0.006080166 0.000000000
sum over m -0.003040083 -0.003040083 -0.006080166 0.000000000
sum over m+mul 0.890876981 0.890876981 1.781753961 0.000000000
px 0 0.786976421 0.786976421 1.573952843 0.000000000
py 0 0.786976421 0.786976421 1.573952843 0.000000000
pz 0 0.779775183 0.779775183 1.559550366 0.000000000
sum over m 2.353728026 2.353728026 4.707456052 0.000000000
px 1 -0.008740451 -0.008740451 -0.017480902 0.000000000
py 1 -0.008740451 -0.008740451 -0.017480902 0.000000000
pz 1 -0.006464374 -0.006464374 -0.012928749 0.000000000
sum over m -0.023945276 -0.023945276 -0.047890552 0.000000000
sum over m+mul 2.329782750 2.329782750 4.659565500 0.000000000
d3z^2-r^2 0 -0.006392823 -0.006392823 -0.012785645 0.000000000
dx^2-y^2 0 -0.005058424 -0.005058424 -0.010116847 0.000000000
dxy 0 -0.005435268 -0.005435268 -0.010870535 0.000000000
dxz 0 -0.006929225 -0.006929225 -0.013858451 0.000000000
dyz 0 -0.006929225 -0.006929225 -0.013858451 0.000000000
sum over m -0.030744965 -0.030744965 -0.061489929 0.000000000
sum over m+mul -0.030744965 -0.030744965 -0.061489929 0.000000000
17 O Up spin Down spin Sum Diff
multiple
s 0 0.893904549 0.893904549 1.787809098 0.000000000
sum over m 0.893904549 0.893904549 1.787809098 0.000000000
s 1 -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m+mul 0.890864301 0.890864301 1.781728602 0.000000000
px 0 0.787007928 0.787007928 1.574015857 0.000000000
py 0 0.786908049 0.786908049 1.573816098 0.000000000
pz 0 0.779806732 0.779806732 1.559613464 0.000000000
sum over m 2.353722710 2.353722710 4.707445419 0.000000000
px 1 -0.008743770 -0.008743770 -0.017487540 0.000000000
py 1 -0.008738770 -0.008738770 -0.017477540 0.000000000
pz 1 -0.006466011 -0.006466011 -0.012932023 0.000000000
sum over m -0.023948552 -0.023948552 -0.047897103 0.000000000
sum over m+mul 2.329774158 2.329774158 4.659548316 0.000000000
d3z^2-r^2 0 -0.006392501 -0.006392501 -0.012785003 0.000000000
dx^2-y^2 0 -0.005059917 -0.005059917 -0.010119835 0.000000000
dxy 0 -0.005434716 -0.005434716 -0.010869432 0.000000000
dxz 0 -0.006930121 -0.006930121 -0.013860241 0.000000000
dyz 0 -0.006931920 -0.006931920 -0.013863839 0.000000000
sum over m -0.030749175 -0.030749175 -0.061498350 0.000000000
sum over m+mul -0.030749175 -0.030749175 -0.061498350 0.000000000
18 O Up spin Down spin Sum Diff
multiple
s 0 0.893904549 0.893904549 1.787809098 0.000000000
sum over m 0.893904549 0.893904549 1.787809098 0.000000000
s 1 -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m+mul 0.890864301 0.890864301 1.781728602 0.000000000
px 0 0.786908049 0.786908049 1.573816098 0.000000000
py 0 0.787007929 0.787007929 1.574015857 0.000000000
pz 0 0.779806732 0.779806732 1.559613464 0.000000000
sum over m 2.353722709 2.353722709 4.707445419 0.000000000
px 1 -0.008738770 -0.008738770 -0.017477540 0.000000000
py 1 -0.008743770 -0.008743770 -0.017487540 0.000000000
pz 1 -0.006466012 -0.006466012 -0.012932023 0.000000000
sum over m -0.023948552 -0.023948552 -0.047897103 0.000000000
sum over m+mul 2.329774158 2.329774158 4.659548316 0.000000000
d3z^2-r^2 0 -0.006392501 -0.006392501 -0.012785003 0.000000000
dx^2-y^2 0 -0.005059917 -0.005059917 -0.010119835 0.000000000
dxy 0 -0.005434716 -0.005434716 -0.010869432 0.000000000
dxz 0 -0.006931920 -0.006931920 -0.013863839 0.000000000
dyz 0 -0.006930121 -0.006930121 -0.013860241 0.000000000
sum over m -0.030749175 -0.030749175 -0.061498351 0.000000000
sum over m+mul -0.030749175 -0.030749175 -0.061498351 0.000000000
19 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000792710 1.000792710 2.001585420 0.000000000
sum over m 1.000792710 1.000792710 2.001585420 0.000000000
s 1 0.207394236 0.207394236 0.414788472 0.000000000
sum over m 0.207394236 0.207394236 0.414788472 0.000000000
s 2 0.014719817 0.014719817 0.029439634 0.000000000
sum over m 0.014719817 0.014719817 0.029439634 0.000000000
sum over m+mul 1.222906763 1.222906763 2.445813526 0.000000000
px 0 1.006382750 1.006382750 2.012765500 0.000000000
py 0 1.006382750 1.006382750 2.012765500 0.000000000
pz 0 1.006206037 1.006206037 2.012412075 0.000000000
sum over m 3.018971537 3.018971537 6.037943075 0.000000000
px 1 0.065444368 0.065444368 0.130888736 0.000000000
py 1 0.065444368 0.065444368 0.130888736 0.000000000
pz 1 0.040353509 0.040353509 0.080707018 0.000000000
sum over m 0.171242245 0.171242245 0.342484490 0.000000000
sum over m+mul 3.190213783 3.190213783 6.380427565 0.000000000
d3z^2-r^2 0 0.196323990 0.196323990 0.392647981 0.000000000
dx^2-y^2 0 0.201543820 0.201543820 0.403087641 0.000000000
dxy 0 0.250927765 0.250927765 0.501855531 0.000000000
dxz 0 0.268484750 0.268484750 0.536969499 0.000000000
dyz 0 0.268484750 0.268484750 0.536969500 0.000000000
sum over m 1.185765076 1.185765076 2.371530151 0.000000000
d3z^2-r^2 1 0.003471724 0.003471724 0.006943449 0.000000000
dx^2-y^2 1 -0.004484891 -0.004484891 -0.008969782 0.000000000
dxy 1 0.015347963 0.015347963 0.030695926 0.000000000
dxz 1 0.003492393 0.003492393 0.006984785 0.000000000
dyz 1 0.003492393 0.003492393 0.006984785 0.000000000
sum over m 0.021319582 0.021319582 0.042639163 0.000000000
sum over m+mul 1.207084657 1.207084657 2.414169315 0.000000000
20 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798791 1.000798791 2.001597581 0.000000000
sum over m 1.000798791 1.000798791 2.001597581 0.000000000
s 1 0.207373702 0.207373702 0.414747404 0.000000000
sum over m 0.207373702 0.207373702 0.414747404 0.000000000
s 2 0.014715434 0.014715434 0.029430869 0.000000000
sum over m 0.014715434 0.014715434 0.029430869 0.000000000
sum over m+mul 1.222887927 1.222887927 2.445775854 0.000000000
px 0 1.006403717 1.006403717 2.012807434 0.000000000
py 0 1.006403717 1.006403717 2.012807434 0.000000000
pz 0 1.006202264 1.006202264 2.012404528 0.000000000
sum over m 3.019009698 3.019009698 6.038019395 0.000000000
px 1 0.065467383 0.065467383 0.130934766 0.000000000
py 1 0.065467383 0.065467383 0.130934766 0.000000000
pz 1 0.040336776 0.040336776 0.080673552 0.000000000
sum over m 0.171271542 0.171271542 0.342543084 0.000000000
sum over m+mul 3.190281240 3.190281240 6.380562480 0.000000000
d3z^2-r^2 0 0.196311880 0.196311880 0.392623760 0.000000000
dx^2-y^2 0 0.201562748 0.201562748 0.403125497 0.000000000
dxy 0 0.250908225 0.250908225 0.501816450 0.000000000
dxz 0 0.268492804 0.268492804 0.536985609 0.000000000
dyz 0 0.268492804 0.268492804 0.536985609 0.000000000
sum over m 1.185768462 1.185768462 2.371536924 0.000000000
d3z^2-r^2 1 0.003467202 0.003467202 0.006934403 0.000000000
dx^2-y^2 1 -0.004488671 -0.004488671 -0.008977342 0.000000000
dxy 1 0.015350486 0.015350486 0.030700972 0.000000000
dxz 1 0.003486282 0.003486282 0.006972564 0.000000000
dyz 1 0.003486282 0.003486282 0.006972564 0.000000000
sum over m 0.021301581 0.021301581 0.042603162 0.000000000
sum over m+mul 1.207070043 1.207070043 2.414140086 0.000000000
21 O Up spin Down spin Sum Diff
multiple
s 0 0.893916460 0.893916460 1.787832921 0.000000000
sum over m 0.893916460 0.893916460 1.787832921 0.000000000
s 1 -0.003041483 -0.003041483 -0.006082966 0.000000000
sum over m -0.003041483 -0.003041483 -0.006082966 0.000000000
sum over m+mul 0.890874978 0.890874978 1.781749955 0.000000000
px 0 0.787015782 0.787015782 1.574031564 0.000000000
py 0 0.787015782 0.787015782 1.574031565 0.000000000
pz 0 0.779712215 0.779712215 1.559424430 0.000000000
sum over m 2.353743780 2.353743780 4.707487559 0.000000000
px 1 -0.008737627 -0.008737627 -0.017475254 0.000000000
py 1 -0.008737627 -0.008737627 -0.017475254 0.000000000
pz 1 -0.006463561 -0.006463561 -0.012927122 0.000000000
sum over m -0.023938815 -0.023938815 -0.047877630 0.000000000
sum over m+mul 2.329804965 2.329804965 4.659609929 0.000000000
d3z^2-r^2 0 -0.006392408 -0.006392408 -0.012784817 0.000000000
dx^2-y^2 0 -0.005054666 -0.005054666 -0.010109331 0.000000000
dxy 0 -0.005435110 -0.005435110 -0.010870221 0.000000000
dxz 0 -0.006925821 -0.006925821 -0.013851641 0.000000000
dyz 0 -0.006925821 -0.006925821 -0.013851641 0.000000000
sum over m -0.030733826 -0.030733826 -0.061467651 0.000000000
sum over m+mul -0.030733826 -0.030733826 -0.061467651 0.000000000
22 O Up spin Down spin Sum Diff
multiple
s 0 0.893917064 0.893917064 1.787834128 0.000000000
sum over m 0.893917064 0.893917064 1.787834128 0.000000000
s 1 -0.003040083 -0.003040083 -0.006080166 0.000000000
sum over m -0.003040083 -0.003040083 -0.006080166 0.000000000
sum over m+mul 0.890876981 0.890876981 1.781753962 0.000000000
px 0 0.786976422 0.786976422 1.573952844 0.000000000
py 0 0.786976422 0.786976422 1.573952843 0.000000000
pz 0 0.779775183 0.779775183 1.559550366 0.000000000
sum over m 2.353728026 2.353728026 4.707456053 0.000000000
px 1 -0.008740451 -0.008740451 -0.017480902 0.000000000
py 1 -0.008740451 -0.008740451 -0.017480902 0.000000000
pz 1 -0.006464374 -0.006464374 -0.012928749 0.000000000
sum over m -0.023945276 -0.023945276 -0.047890552 0.000000000
sum over m+mul 2.329782750 2.329782750 4.659565501 0.000000000
d3z^2-r^2 0 -0.006392823 -0.006392823 -0.012785645 0.000000000
dx^2-y^2 0 -0.005058424 -0.005058424 -0.010116847 0.000000000
dxy 0 -0.005435268 -0.005435268 -0.010870535 0.000000000
dxz 0 -0.006929225 -0.006929225 -0.013858451 0.000000000
dyz 0 -0.006929225 -0.006929225 -0.013858451 0.000000000
sum over m -0.030744965 -0.030744965 -0.061489930 0.000000000
sum over m+mul -0.030744965 -0.030744965 -0.061489930 0.000000000
23 O Up spin Down spin Sum Diff
multiple
s 0 0.893904549 0.893904549 1.787809098 0.000000000
sum over m 0.893904549 0.893904549 1.787809098 0.000000000
s 1 -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m+mul 0.890864301 0.890864301 1.781728602 0.000000000
px 0 0.787007928 0.787007928 1.574015857 0.000000000
py 0 0.786908049 0.786908049 1.573816097 0.000000000
pz 0 0.779806732 0.779806732 1.559613464 0.000000000
sum over m 2.353722709 2.353722709 4.707445418 0.000000000
px 1 -0.008743770 -0.008743770 -0.017487540 0.000000000
py 1 -0.008738770 -0.008738770 -0.017477540 0.000000000
pz 1 -0.006466011 -0.006466011 -0.012932023 0.000000000
sum over m -0.023948552 -0.023948552 -0.047897103 0.000000000
sum over m+mul 2.329774158 2.329774158 4.659548315 0.000000000
d3z^2-r^2 0 -0.006392501 -0.006392501 -0.012785003 0.000000000
dx^2-y^2 0 -0.005059917 -0.005059917 -0.010119835 0.000000000
dxy 0 -0.005434716 -0.005434716 -0.010869432 0.000000000
dxz 0 -0.006930121 -0.006930121 -0.013860241 0.000000000
dyz 0 -0.006931920 -0.006931920 -0.013863839 0.000000000
sum over m -0.030749175 -0.030749175 -0.061498350 0.000000000
sum over m+mul -0.030749175 -0.030749175 -0.061498350 0.000000000
24 O Up spin Down spin Sum Diff
multiple
s 0 0.893904549 0.893904549 1.787809098 0.000000000
sum over m 0.893904549 0.893904549 1.787809098 0.000000000
s 1 -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m+mul 0.890864301 0.890864301 1.781728602 0.000000000
px 0 0.786908049 0.786908049 1.573816098 0.000000000
py 0 0.787007929 0.787007929 1.574015857 0.000000000
pz 0 0.779806732 0.779806732 1.559613463 0.000000000
sum over m 2.353722709 2.353722709 4.707445418 0.000000000
px 1 -0.008738770 -0.008738770 -0.017477540 0.000000000
py 1 -0.008743770 -0.008743770 -0.017487540 0.000000000
pz 1 -0.006466012 -0.006466012 -0.012932023 0.000000000
sum over m -0.023948552 -0.023948552 -0.047897103 0.000000000
sum over m+mul 2.329774157 2.329774157 4.659548315 0.000000000
d3z^2-r^2 0 -0.006392501 -0.006392501 -0.012785003 0.000000000
dx^2-y^2 0 -0.005059917 -0.005059917 -0.010119835 0.000000000
dxy 0 -0.005434716 -0.005434716 -0.010869432 0.000000000
dxz 0 -0.006931920 -0.006931920 -0.013863839 0.000000000
dyz 0 -0.006930121 -0.006930121 -0.013860241 0.000000000
sum over m -0.030749175 -0.030749175 -0.061498351 0.000000000
sum over m+mul -0.030749175 -0.030749175 -0.061498351 0.000000000
25 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000792710 1.000792710 2.001585420 0.000000000
sum over m 1.000792710 1.000792710 2.001585420 0.000000000
s 1 0.207394236 0.207394236 0.414788472 0.000000000
sum over m 0.207394236 0.207394236 0.414788472 0.000000000
s 2 0.014719817 0.014719817 0.029439634 0.000000000
sum over m 0.014719817 0.014719817 0.029439634 0.000000000
sum over m+mul 1.222906763 1.222906763 2.445813526 0.000000000
px 0 1.006382750 1.006382750 2.012765500 0.000000000
py 0 1.006382750 1.006382750 2.012765500 0.000000000
pz 0 1.006206037 1.006206037 2.012412074 0.000000000
sum over m 3.018971537 3.018971537 6.037943075 0.000000000
px 1 0.065444368 0.065444368 0.130888735 0.000000000
py 1 0.065444368 0.065444368 0.130888736 0.000000000
pz 1 0.040353509 0.040353509 0.080707018 0.000000000
sum over m 0.171242245 0.171242245 0.342484489 0.000000000
sum over m+mul 3.190213782 3.190213782 6.380427564 0.000000000
d3z^2-r^2 0 0.196323991 0.196323991 0.392647981 0.000000000
dx^2-y^2 0 0.201543821 0.201543821 0.403087641 0.000000000
dxy 0 0.250927765 0.250927765 0.501855531 0.000000000
dxz 0 0.268484750 0.268484750 0.536969499 0.000000000
dyz 0 0.268484750 0.268484750 0.536969500 0.000000000
sum over m 1.185765076 1.185765076 2.371530153 0.000000000
d3z^2-r^2 1 0.003471724 0.003471724 0.006943449 0.000000000
dx^2-y^2 1 -0.004484891 -0.004484891 -0.008969782 0.000000000
dxy 1 0.015347963 0.015347963 0.030695926 0.000000000
dxz 1 0.003492393 0.003492393 0.006984785 0.000000000
dyz 1 0.003492393 0.003492393 0.006984785 0.000000000
sum over m 0.021319582 0.021319582 0.042639163 0.000000000
sum over m+mul 1.207084658 1.207084658 2.414169316 0.000000000
26 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798791 1.000798791 2.001597581 0.000000000
sum over m 1.000798791 1.000798791 2.001597581 0.000000000
s 1 0.207373702 0.207373702 0.414747404 0.000000000
sum over m 0.207373702 0.207373702 0.414747404 0.000000000
s 2 0.014715434 0.014715434 0.029430869 0.000000000
sum over m 0.014715434 0.014715434 0.029430869 0.000000000
sum over m+mul 1.222887927 1.222887927 2.445775854 0.000000000
px 0 1.006403717 1.006403717 2.012807434 0.000000000
py 0 1.006403717 1.006403717 2.012807434 0.000000000
pz 0 1.006202264 1.006202264 2.012404528 0.000000000
sum over m 3.019009698 3.019009698 6.038019395 0.000000000
px 1 0.065467383 0.065467383 0.130934766 0.000000000
py 1 0.065467383 0.065467383 0.130934766 0.000000000
pz 1 0.040336776 0.040336776 0.080673553 0.000000000
sum over m 0.171271542 0.171271542 0.342543084 0.000000000
sum over m+mul 3.190281240 3.190281240 6.380562479 0.000000000
d3z^2-r^2 0 0.196311880 0.196311880 0.392623760 0.000000000
dx^2-y^2 0 0.201562748 0.201562748 0.403125497 0.000000000
dxy 0 0.250908225 0.250908225 0.501816449 0.000000000
dxz 0 0.268492804 0.268492804 0.536985609 0.000000000
dyz 0 0.268492804 0.268492804 0.536985608 0.000000000
sum over m 1.185768462 1.185768462 2.371536923 0.000000000
d3z^2-r^2 1 0.003467202 0.003467202 0.006934403 0.000000000
dx^2-y^2 1 -0.004488671 -0.004488671 -0.008977342 0.000000000
dxy 1 0.015350486 0.015350486 0.030700972 0.000000000
dxz 1 0.003486282 0.003486282 0.006972564 0.000000000
dyz 1 0.003486282 0.003486282 0.006972564 0.000000000
sum over m 0.021301581 0.021301581 0.042603162 0.000000000
sum over m+mul 1.207070043 1.207070043 2.414140085 0.000000000
27 O Up spin Down spin Sum Diff
multiple
s 0 0.893916460 0.893916460 1.787832921 0.000000000
sum over m 0.893916460 0.893916460 1.787832921 0.000000000
s 1 -0.003041483 -0.003041483 -0.006082966 0.000000000
sum over m -0.003041483 -0.003041483 -0.006082966 0.000000000
sum over m+mul 0.890874978 0.890874978 1.781749955 0.000000000
px 0 0.787015782 0.787015782 1.574031565 0.000000000
py 0 0.787015782 0.787015782 1.574031565 0.000000000
pz 0 0.779712215 0.779712215 1.559424430 0.000000000
sum over m 2.353743780 2.353743780 4.707487559 0.000000000
px 1 -0.008737627 -0.008737627 -0.017475254 0.000000000
py 1 -0.008737627 -0.008737627 -0.017475254 0.000000000
pz 1 -0.006463561 -0.006463561 -0.012927122 0.000000000
sum over m -0.023938815 -0.023938815 -0.047877630 0.000000000
sum over m+mul 2.329804965 2.329804965 4.659609929 0.000000000
d3z^2-r^2 0 -0.006392408 -0.006392408 -0.012784817 0.000000000
dx^2-y^2 0 -0.005054666 -0.005054666 -0.010109331 0.000000000
dxy 0 -0.005435110 -0.005435110 -0.010870221 0.000000000
dxz 0 -0.006925821 -0.006925821 -0.013851641 0.000000000
dyz 0 -0.006925821 -0.006925821 -0.013851641 0.000000000
sum over m -0.030733826 -0.030733826 -0.061467651 0.000000000
sum over m+mul -0.030733826 -0.030733826 -0.061467651 0.000000000
28 O Up spin Down spin Sum Diff
multiple
s 0 0.893917064 0.893917064 1.787834128 0.000000000
sum over m 0.893917064 0.893917064 1.787834128 0.000000000
s 1 -0.003040083 -0.003040083 -0.006080166 0.000000000
sum over m -0.003040083 -0.003040083 -0.006080166 0.000000000
sum over m+mul 0.890876981 0.890876981 1.781753961 0.000000000
px 0 0.786976422 0.786976422 1.573952843 0.000000000
py 0 0.786976422 0.786976422 1.573952843 0.000000000
pz 0 0.779775183 0.779775183 1.559550366 0.000000000
sum over m 2.353728026 2.353728026 4.707456052 0.000000000
px 1 -0.008740451 -0.008740451 -0.017480902 0.000000000
py 1 -0.008740451 -0.008740451 -0.017480902 0.000000000
pz 1 -0.006464374 -0.006464374 -0.012928749 0.000000000
sum over m -0.023945276 -0.023945276 -0.047890552 0.000000000
sum over m+mul 2.329782750 2.329782750 4.659565500 0.000000000
d3z^2-r^2 0 -0.006392823 -0.006392823 -0.012785645 0.000000000
dx^2-y^2 0 -0.005058424 -0.005058424 -0.010116847 0.000000000
dxy 0 -0.005435268 -0.005435268 -0.010870535 0.000000000
dxz 0 -0.006929225 -0.006929225 -0.013858451 0.000000000
dyz 0 -0.006929225 -0.006929225 -0.013858451 0.000000000
sum over m -0.030744965 -0.030744965 -0.061489930 0.000000000
sum over m+mul -0.030744965 -0.030744965 -0.061489930 0.000000000
29 O Up spin Down spin Sum Diff
multiple
s 0 0.893904549 0.893904549 1.787809098 0.000000000
sum over m 0.893904549 0.893904549 1.787809098 0.000000000
s 1 -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m+mul 0.890864301 0.890864301 1.781728602 0.000000000
px 0 0.787007928 0.787007928 1.574015857 0.000000000
py 0 0.786908049 0.786908049 1.573816098 0.000000000
pz 0 0.779806732 0.779806732 1.559613464 0.000000000
sum over m 2.353722709 2.353722709 4.707445419 0.000000000
px 1 -0.008743770 -0.008743770 -0.017487540 0.000000000
py 1 -0.008738770 -0.008738770 -0.017477540 0.000000000
pz 1 -0.006466011 -0.006466011 -0.012932023 0.000000000
sum over m -0.023948551 -0.023948551 -0.047897103 0.000000000
sum over m+mul 2.329774158 2.329774158 4.659548316 0.000000000
d3z^2-r^2 0 -0.006392501 -0.006392501 -0.012785003 0.000000000
dx^2-y^2 0 -0.005059917 -0.005059917 -0.010119835 0.000000000
dxy 0 -0.005434716 -0.005434716 -0.010869432 0.000000000
dxz 0 -0.006930121 -0.006930121 -0.013860241 0.000000000
dyz 0 -0.006931920 -0.006931920 -0.013863839 0.000000000
sum over m -0.030749175 -0.030749175 -0.061498350 0.000000000
sum over m+mul -0.030749175 -0.030749175 -0.061498350 0.000000000
30 O Up spin Down spin Sum Diff
multiple
s 0 0.893904549 0.893904549 1.787809098 0.000000000
sum over m 0.893904549 0.893904549 1.787809098 0.000000000
s 1 -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m+mul 0.890864301 0.890864301 1.781728602 0.000000000
px 0 0.786908049 0.786908049 1.573816098 0.000000000
py 0 0.787007929 0.787007929 1.574015857 0.000000000
pz 0 0.779806732 0.779806732 1.559613463 0.000000000
sum over m 2.353722709 2.353722709 4.707445418 0.000000000
px 1 -0.008738770 -0.008738770 -0.017477540 0.000000000
py 1 -0.008743770 -0.008743770 -0.017487540 0.000000000
pz 1 -0.006466012 -0.006466012 -0.012932023 0.000000000
sum over m -0.023948552 -0.023948552 -0.047897103 0.000000000
sum over m+mul 2.329774157 2.329774157 4.659548315 0.000000000
d3z^2-r^2 0 -0.006392502 -0.006392502 -0.012785003 0.000000000
dx^2-y^2 0 -0.005059917 -0.005059917 -0.010119835 0.000000000
dxy 0 -0.005434716 -0.005434716 -0.010869432 0.000000000
dxz 0 -0.006931920 -0.006931920 -0.013863839 0.000000000
dyz 0 -0.006930121 -0.006930121 -0.013860241 0.000000000
sum over m -0.030749175 -0.030749175 -0.061498350 0.000000000
sum over m+mul -0.030749175 -0.030749175 -0.061498350 0.000000000
31 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000792710 1.000792710 2.001585420 0.000000000
sum over m 1.000792710 1.000792710 2.001585420 0.000000000
s 1 0.207394236 0.207394236 0.414788472 0.000000000
sum over m 0.207394236 0.207394236 0.414788472 0.000000000
s 2 0.014719817 0.014719817 0.029439634 0.000000000
sum over m 0.014719817 0.014719817 0.029439634 0.000000000
sum over m+mul 1.222906763 1.222906763 2.445813526 0.000000000
px 0 1.006382750 1.006382750 2.012765500 0.000000000
py 0 1.006382750 1.006382750 2.012765500 0.000000000
pz 0 1.006206037 1.006206037 2.012412074 0.000000000
sum over m 3.018971537 3.018971537 6.037943075 0.000000000
px 1 0.065444368 0.065444368 0.130888736 0.000000000
py 1 0.065444368 0.065444368 0.130888736 0.000000000
pz 1 0.040353509 0.040353509 0.080707018 0.000000000
sum over m 0.171242245 0.171242245 0.342484490 0.000000000
sum over m+mul 3.190213782 3.190213782 6.380427564 0.000000000
d3z^2-r^2 0 0.196323991 0.196323991 0.392647981 0.000000000
dx^2-y^2 0 0.201543821 0.201543821 0.403087641 0.000000000
dxy 0 0.250927765 0.250927765 0.501855531 0.000000000
dxz 0 0.268484750 0.268484750 0.536969500 0.000000000
dyz 0 0.268484750 0.268484750 0.536969500 0.000000000
sum over m 1.185765076 1.185765076 2.371530153 0.000000000
d3z^2-r^2 1 0.003471724 0.003471724 0.006943449 0.000000000
dx^2-y^2 1 -0.004484891 -0.004484891 -0.008969782 0.000000000
dxy 1 0.015347963 0.015347963 0.030695926 0.000000000
dxz 1 0.003492393 0.003492393 0.006984785 0.000000000
dyz 1 0.003492393 0.003492393 0.006984785 0.000000000
sum over m 0.021319582 0.021319582 0.042639163 0.000000000
sum over m+mul 1.207084658 1.207084658 2.414169316 0.000000000
32 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798791 1.000798791 2.001597581 0.000000000
sum over m 1.000798791 1.000798791 2.001597581 0.000000000
s 1 0.207373702 0.207373702 0.414747404 0.000000000
sum over m 0.207373702 0.207373702 0.414747404 0.000000000
s 2 0.014715434 0.014715434 0.029430869 0.000000000
sum over m 0.014715434 0.014715434 0.029430869 0.000000000
sum over m+mul 1.222887927 1.222887927 2.445775854 0.000000000
px 0 1.006403717 1.006403717 2.012807434 0.000000000
py 0 1.006403717 1.006403717 2.012807434 0.000000000
pz 0 1.006202264 1.006202264 2.012404528 0.000000000
sum over m 3.019009698 3.019009698 6.038019396 0.000000000
px 1 0.065467383 0.065467383 0.130934766 0.000000000
py 1 0.065467383 0.065467383 0.130934766 0.000000000
pz 1 0.040336776 0.040336776 0.080673552 0.000000000
sum over m 0.171271542 0.171271542 0.342543084 0.000000000
sum over m+mul 3.190281240 3.190281240 6.380562480 0.000000000
d3z^2-r^2 0 0.196311880 0.196311880 0.392623760 0.000000000
dx^2-y^2 0 0.201562748 0.201562748 0.403125497 0.000000000
dxy 0 0.250908225 0.250908225 0.501816450 0.000000000
dxz 0 0.268492804 0.268492804 0.536985609 0.000000000
dyz 0 0.268492804 0.268492804 0.536985609 0.000000000
sum over m 1.185768462 1.185768462 2.371536924 0.000000000
d3z^2-r^2 1 0.003467202 0.003467202 0.006934403 0.000000000
dx^2-y^2 1 -0.004488671 -0.004488671 -0.008977342 0.000000000
dxy 1 0.015350486 0.015350486 0.030700972 0.000000000
dxz 1 0.003486282 0.003486282 0.006972565 0.000000000
dyz 1 0.003486282 0.003486282 0.006972564 0.000000000
sum over m 0.021301581 0.021301581 0.042603162 0.000000000
sum over m+mul 1.207070043 1.207070043 2.414140086 0.000000000
33 O Up spin Down spin Sum Diff
multiple
s 0 0.893916460 0.893916460 1.787832921 0.000000000
sum over m 0.893916460 0.893916460 1.787832921 0.000000000
s 1 -0.003041483 -0.003041483 -0.006082966 0.000000000
sum over m -0.003041483 -0.003041483 -0.006082966 0.000000000
sum over m+mul 0.890874977 0.890874977 1.781749955 0.000000000
px 0 0.787015782 0.787015782 1.574031565 0.000000000
py 0 0.787015782 0.787015782 1.574031565 0.000000000
pz 0 0.779712215 0.779712215 1.559424430 0.000000000
sum over m 2.353743780 2.353743780 4.707487559 0.000000000
px 1 -0.008737627 -0.008737627 -0.017475254 0.000000000
py 1 -0.008737627 -0.008737627 -0.017475254 0.000000000
pz 1 -0.006463561 -0.006463561 -0.012927122 0.000000000
sum over m -0.023938815 -0.023938815 -0.047877630 0.000000000
sum over m+mul 2.329804965 2.329804965 4.659609929 0.000000000
d3z^2-r^2 0 -0.006392408 -0.006392408 -0.012784817 0.000000000
dx^2-y^2 0 -0.005054666 -0.005054666 -0.010109331 0.000000000
dxy 0 -0.005435110 -0.005435110 -0.010870221 0.000000000
dxz 0 -0.006925821 -0.006925821 -0.013851641 0.000000000
dyz 0 -0.006925821 -0.006925821 -0.013851641 0.000000000
sum over m -0.030733826 -0.030733826 -0.061467651 0.000000000
sum over m+mul -0.030733826 -0.030733826 -0.061467651 0.000000000
34 O Up spin Down spin Sum Diff
multiple
s 0 0.893917064 0.893917064 1.787834128 0.000000000
sum over m 0.893917064 0.893917064 1.787834128 0.000000000
s 1 -0.003040083 -0.003040083 -0.006080166 0.000000000
sum over m -0.003040083 -0.003040083 -0.006080166 0.000000000
sum over m+mul 0.890876981 0.890876981 1.781753962 0.000000000
px 0 0.786976422 0.786976422 1.573952843 0.000000000
py 0 0.786976421 0.786976421 1.573952843 0.000000000
pz 0 0.779775183 0.779775183 1.559550366 0.000000000
sum over m 2.353728026 2.353728026 4.707456052 0.000000000
px 1 -0.008740451 -0.008740451 -0.017480902 0.000000000
py 1 -0.008740451 -0.008740451 -0.017480902 0.000000000
pz 1 -0.006464374 -0.006464374 -0.012928749 0.000000000
sum over m -0.023945276 -0.023945276 -0.047890552 0.000000000
sum over m+mul 2.329782750 2.329782750 4.659565500 0.000000000
d3z^2-r^2 0 -0.006392823 -0.006392823 -0.012785645 0.000000000
dx^2-y^2 0 -0.005058424 -0.005058424 -0.010116847 0.000000000
dxy 0 -0.005435268 -0.005435268 -0.010870535 0.000000000
dxz 0 -0.006929225 -0.006929225 -0.013858451 0.000000000
dyz 0 -0.006929225 -0.006929225 -0.013858451 0.000000000
sum over m -0.030744965 -0.030744965 -0.061489930 0.000000000
sum over m+mul -0.030744965 -0.030744965 -0.061489930 0.000000000
35 O Up spin Down spin Sum Diff
multiple
s 0 0.893904549 0.893904549 1.787809098 0.000000000
sum over m 0.893904549 0.893904549 1.787809098 0.000000000
s 1 -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m+mul 0.890864301 0.890864301 1.781728602 0.000000000
px 0 0.787007928 0.787007928 1.574015857 0.000000000
py 0 0.786908049 0.786908049 1.573816098 0.000000000
pz 0 0.779806732 0.779806732 1.559613464 0.000000000
sum over m 2.353722709 2.353722709 4.707445419 0.000000000
px 1 -0.008743770 -0.008743770 -0.017487540 0.000000000
py 1 -0.008738770 -0.008738770 -0.017477540 0.000000000
pz 1 -0.006466011 -0.006466011 -0.012932023 0.000000000
sum over m -0.023948552 -0.023948552 -0.047897103 0.000000000
sum over m+mul 2.329774158 2.329774158 4.659548316 0.000000000
d3z^2-r^2 0 -0.006392501 -0.006392501 -0.012785003 0.000000000
dx^2-y^2 0 -0.005059917 -0.005059917 -0.010119835 0.000000000
dxy 0 -0.005434716 -0.005434716 -0.010869432 0.000000000
dxz 0 -0.006930121 -0.006930121 -0.013860241 0.000000000
dyz 0 -0.006931920 -0.006931920 -0.013863839 0.000000000
sum over m -0.030749175 -0.030749175 -0.061498350 0.000000000
sum over m+mul -0.030749175 -0.030749175 -0.061498350 0.000000000
36 O Up spin Down spin Sum Diff
multiple
s 0 0.893904549 0.893904549 1.787809098 0.000000000
sum over m 0.893904549 0.893904549 1.787809098 0.000000000
s 1 -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m+mul 0.890864301 0.890864301 1.781728602 0.000000000
px 0 0.786908049 0.786908049 1.573816097 0.000000000
py 0 0.787007929 0.787007929 1.574015857 0.000000000
pz 0 0.779806732 0.779806732 1.559613464 0.000000000
sum over m 2.353722709 2.353722709 4.707445419 0.000000000
px 1 -0.008738770 -0.008738770 -0.017477540 0.000000000
py 1 -0.008743770 -0.008743770 -0.017487540 0.000000000
pz 1 -0.006466012 -0.006466012 -0.012932023 0.000000000
sum over m -0.023948552 -0.023948552 -0.047897103 0.000000000
sum over m+mul 2.329774158 2.329774158 4.659548315 0.000000000
d3z^2-r^2 0 -0.006392502 -0.006392502 -0.012785003 0.000000000
dx^2-y^2 0 -0.005059917 -0.005059917 -0.010119835 0.000000000
dxy 0 -0.005434716 -0.005434716 -0.010869432 0.000000000
dxz 0 -0.006931920 -0.006931920 -0.013863839 0.000000000
dyz 0 -0.006930121 -0.006930121 -0.013860241 0.000000000
sum over m -0.030749175 -0.030749175 -0.061498351 0.000000000
sum over m+mul -0.030749175 -0.030749175 -0.061498351 0.000000000
37 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000792710 1.000792710 2.001585420 0.000000000
sum over m 1.000792710 1.000792710 2.001585420 0.000000000
s 1 0.207394236 0.207394236 0.414788472 0.000000000
sum over m 0.207394236 0.207394236 0.414788472 0.000000000
s 2 0.014719817 0.014719817 0.029439634 0.000000000
sum over m 0.014719817 0.014719817 0.029439634 0.000000000
sum over m+mul 1.222906763 1.222906763 2.445813526 0.000000000
px 0 1.006382750 1.006382750 2.012765500 0.000000000
py 0 1.006382750 1.006382750 2.012765500 0.000000000
pz 0 1.006206037 1.006206037 2.012412074 0.000000000
sum over m 3.018971537 3.018971537 6.037943075 0.000000000
px 1 0.065444368 0.065444368 0.130888735 0.000000000
py 1 0.065444368 0.065444368 0.130888736 0.000000000
pz 1 0.040353509 0.040353509 0.080707018 0.000000000
sum over m 0.171242245 0.171242245 0.342484489 0.000000000
sum over m+mul 3.190213782 3.190213782 6.380427564 0.000000000
d3z^2-r^2 0 0.196323990 0.196323990 0.392647981 0.000000000
dx^2-y^2 0 0.201543821 0.201543821 0.403087641 0.000000000
dxy 0 0.250927765 0.250927765 0.501855531 0.000000000
dxz 0 0.268484750 0.268484750 0.536969499 0.000000000
dyz 0 0.268484750 0.268484750 0.536969500 0.000000000
sum over m 1.185765076 1.185765076 2.371530152 0.000000000
d3z^2-r^2 1 0.003471724 0.003471724 0.006943449 0.000000000
dx^2-y^2 1 -0.004484891 -0.004484891 -0.008969782 0.000000000
dxy 1 0.015347963 0.015347963 0.030695926 0.000000000
dxz 1 0.003492393 0.003492393 0.006984785 0.000000000
dyz 1 0.003492393 0.003492393 0.006984785 0.000000000
sum over m 0.021319582 0.021319582 0.042639163 0.000000000
sum over m+mul 1.207084658 1.207084658 2.414169315 0.000000000
38 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798791 1.000798791 2.001597581 0.000000000
sum over m 1.000798791 1.000798791 2.001597581 0.000000000
s 1 0.207373702 0.207373702 0.414747404 0.000000000
sum over m 0.207373702 0.207373702 0.414747404 0.000000000
s 2 0.014715434 0.014715434 0.029430869 0.000000000
sum over m 0.014715434 0.014715434 0.029430869 0.000000000
sum over m+mul 1.222887927 1.222887927 2.445775854 0.000000000
px 0 1.006403717 1.006403717 2.012807434 0.000000000
py 0 1.006403717 1.006403717 2.012807434 0.000000000
pz 0 1.006202264 1.006202264 2.012404527 0.000000000
sum over m 3.019009698 3.019009698 6.038019395 0.000000000
px 1 0.065467383 0.065467383 0.130934766 0.000000000
py 1 0.065467383 0.065467383 0.130934766 0.000000000
pz 1 0.040336776 0.040336776 0.080673552 0.000000000
sum over m 0.171271542 0.171271542 0.342543084 0.000000000
sum over m+mul 3.190281240 3.190281240 6.380562480 0.000000000
d3z^2-r^2 0 0.196311880 0.196311880 0.392623760 0.000000000
dx^2-y^2 0 0.201562749 0.201562749 0.403125497 0.000000000
dxy 0 0.250908225 0.250908225 0.501816449 0.000000000
dxz 0 0.268492804 0.268492804 0.536985609 0.000000000
dyz 0 0.268492804 0.268492804 0.536985609 0.000000000
sum over m 1.185768462 1.185768462 2.371536925 0.000000000
d3z^2-r^2 1 0.003467202 0.003467202 0.006934403 0.000000000
dx^2-y^2 1 -0.004488671 -0.004488671 -0.008977342 0.000000000
dxy 1 0.015350486 0.015350486 0.030700972 0.000000000
dxz 1 0.003486282 0.003486282 0.006972565 0.000000000
dyz 1 0.003486282 0.003486282 0.006972564 0.000000000
sum over m 0.021301581 0.021301581 0.042603162 0.000000000
sum over m+mul 1.207070043 1.207070043 2.414140087 0.000000000
39 O Up spin Down spin Sum Diff
multiple
s 0 0.893916461 0.893916461 1.787832921 0.000000000
sum over m 0.893916461 0.893916461 1.787832921 0.000000000
s 1 -0.003041483 -0.003041483 -0.006082966 0.000000000
sum over m -0.003041483 -0.003041483 -0.006082966 0.000000000
sum over m+mul 0.890874978 0.890874978 1.781749955 0.000000000
px 0 0.787015782 0.787015782 1.574031564 0.000000000
py 0 0.787015782 0.787015782 1.574031565 0.000000000
pz 0 0.779712215 0.779712215 1.559424430 0.000000000
sum over m 2.353743779 2.353743779 4.707487559 0.000000000
px 1 -0.008737627 -0.008737627 -0.017475254 0.000000000
py 1 -0.008737627 -0.008737627 -0.017475254 0.000000000
pz 1 -0.006463561 -0.006463561 -0.012927122 0.000000000
sum over m -0.023938815 -0.023938815 -0.047877630 0.000000000
sum over m+mul 2.329804964 2.329804964 4.659609929 0.000000000
d3z^2-r^2 0 -0.006392408 -0.006392408 -0.012784817 0.000000000
dx^2-y^2 0 -0.005054666 -0.005054666 -0.010109331 0.000000000
dxy 0 -0.005435110 -0.005435110 -0.010870221 0.000000000
dxz 0 -0.006925821 -0.006925821 -0.013851641 0.000000000
dyz 0 -0.006925821 -0.006925821 -0.013851641 0.000000000
sum over m -0.030733826 -0.030733826 -0.061467651 0.000000000
sum over m+mul -0.030733826 -0.030733826 -0.061467651 0.000000000
40 O Up spin Down spin Sum Diff
multiple
s 0 0.893917064 0.893917064 1.787834128 0.000000000
sum over m 0.893917064 0.893917064 1.787834128 0.000000000
s 1 -0.003040083 -0.003040083 -0.006080166 0.000000000
sum over m -0.003040083 -0.003040083 -0.006080166 0.000000000
sum over m+mul 0.890876981 0.890876981 1.781753961 0.000000000
px 0 0.786976422 0.786976422 1.573952843 0.000000000
py 0 0.786976421 0.786976421 1.573952843 0.000000000
pz 0 0.779775183 0.779775183 1.559550365 0.000000000
sum over m 2.353728026 2.353728026 4.707456051 0.000000000
px 1 -0.008740451 -0.008740451 -0.017480902 0.000000000
py 1 -0.008740451 -0.008740451 -0.017480902 0.000000000
pz 1 -0.006464374 -0.006464374 -0.012928749 0.000000000
sum over m -0.023945276 -0.023945276 -0.047890552 0.000000000
sum over m+mul 2.329782750 2.329782750 4.659565499 0.000000000
d3z^2-r^2 0 -0.006392823 -0.006392823 -0.012785645 0.000000000
dx^2-y^2 0 -0.005058424 -0.005058424 -0.010116847 0.000000000
dxy 0 -0.005435268 -0.005435268 -0.010870535 0.000000000
dxz 0 -0.006929225 -0.006929225 -0.013858451 0.000000000
dyz 0 -0.006929225 -0.006929225 -0.013858451 0.000000000
sum over m -0.030744965 -0.030744965 -0.061489930 0.000000000
sum over m+mul -0.030744965 -0.030744965 -0.061489930 0.000000000
41 O Up spin Down spin Sum Diff
multiple
s 0 0.893904549 0.893904549 1.787809098 0.000000000
sum over m 0.893904549 0.893904549 1.787809098 0.000000000
s 1 -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m+mul 0.890864301 0.890864301 1.781728602 0.000000000
px 0 0.787007928 0.787007928 1.574015857 0.000000000
py 0 0.786908049 0.786908049 1.573816098 0.000000000
pz 0 0.779806732 0.779806732 1.559613464 0.000000000
sum over m 2.353722709 2.353722709 4.707445419 0.000000000
px 1 -0.008743770 -0.008743770 -0.017487540 0.000000000
py 1 -0.008738770 -0.008738770 -0.017477540 0.000000000
pz 1 -0.006466011 -0.006466011 -0.012932023 0.000000000
sum over m -0.023948552 -0.023948552 -0.047897103 0.000000000
sum over m+mul 2.329774158 2.329774158 4.659548316 0.000000000
d3z^2-r^2 0 -0.006392501 -0.006392501 -0.012785003 0.000000000
dx^2-y^2 0 -0.005059917 -0.005059917 -0.010119835 0.000000000
dxy 0 -0.005434716 -0.005434716 -0.010869432 0.000000000
dxz 0 -0.006930121 -0.006930121 -0.013860241 0.000000000
dyz 0 -0.006931920 -0.006931920 -0.013863839 0.000000000
sum over m -0.030749175 -0.030749175 -0.061498350 0.000000000
sum over m+mul -0.030749175 -0.030749175 -0.061498350 0.000000000
42 O Up spin Down spin Sum Diff
multiple
s 0 0.893904549 0.893904549 1.787809098 0.000000000
sum over m 0.893904549 0.893904549 1.787809098 0.000000000
s 1 -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m -0.003040248 -0.003040248 -0.006080496 0.000000000
sum over m+mul 0.890864301 0.890864301 1.781728602 0.000000000
px 0 0.786908049 0.786908049 1.573816098 0.000000000
py 0 0.787007929 0.787007929 1.574015857 0.000000000
pz 0 0.779806732 0.779806732 1.559613463 0.000000000
sum over m 2.353722709 2.353722709 4.707445418 0.000000000
px 1 -0.008738770 -0.008738770 -0.017477540 0.000000000
py 1 -0.008743770 -0.008743770 -0.017487540 0.000000000
pz 1 -0.006466012 -0.006466012 -0.012932023 0.000000000
sum over m -0.023948552 -0.023948552 -0.047897103 0.000000000
sum over m+mul 2.329774158 2.329774158 4.659548315 0.000000000
d3z^2-r^2 0 -0.006392501 -0.006392501 -0.012785003 0.000000000
dx^2-y^2 0 -0.005059917 -0.005059917 -0.010119835 0.000000000
dxy 0 -0.005434716 -0.005434716 -0.010869432 0.000000000
dxz 0 -0.006931920 -0.006931920 -0.013863839 0.000000000
dyz 0 -0.006930121 -0.006930121 -0.013860241 0.000000000
sum over m -0.030749175 -0.030749175 -0.061498350 0.000000000
sum over m+mul -0.030749175 -0.030749175 -0.061498350 0.000000000
43 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798134 1.000798134 2.001596268 0.000000000
sum over m 1.000798134 1.000798134 2.001596268 0.000000000
s 1 0.207380313 0.207380313 0.414760626 0.000000000
sum over m 0.207380313 0.207380313 0.414760626 0.000000000
s 2 0.014717122 0.014717122 0.029434244 0.000000000
sum over m 0.014717122 0.014717122 0.029434244 0.000000000
sum over m+mul 1.222895569 1.222895569 2.445791138 0.000000000
px 0 1.006395472 1.006395472 2.012790943 0.000000000
py 0 1.006399840 1.006399840 2.012799680 0.000000000
pz 0 1.006210919 1.006210919 2.012421838 0.000000000
sum over m 3.019006230 3.019006230 6.038012461 0.000000000
px 1 0.065458011 0.065458011 0.130916022 0.000000000
py 1 0.065452116 0.065452116 0.130904232 0.000000000
pz 1 0.040344786 0.040344786 0.080689573 0.000000000
sum over m 0.171254913 0.171254913 0.342509827 0.000000000
sum over m+mul 3.190261144 3.190261144 6.380522288 0.000000000
d3z^2-r^2 0 0.196308818 0.196308818 0.392617635 0.000000000
dx^2-y^2 0 0.201552618 0.201552618 0.403105236 0.000000000
dxy 0 0.250913136 0.250913136 0.501826272 0.000000000
dxz 0 0.268494472 0.268494472 0.536988944 0.000000000
dyz 0 0.268491880 0.268491880 0.536983759 0.000000000
sum over m 1.185760923 1.185760923 2.371521845 0.000000000
d3z^2-r^2 1 0.003468385 0.003468385 0.006936771 0.000000000
dx^2-y^2 1 -0.004487731 -0.004487731 -0.008975462 0.000000000
dxy 1 0.015348016 0.015348016 0.030696032 0.000000000
dxz 1 0.003485835 0.003485835 0.006971671 0.000000000
dyz 1 0.003485545 0.003485545 0.006971091 0.000000000
sum over m 0.021300051 0.021300051 0.042600102 0.000000000
sum over m+mul 1.207060974 1.207060974 2.414121948 0.000000000
44 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000799076 1.000799076 2.001598152 0.000000000
sum over m 1.000799076 1.000799076 2.001598152 0.000000000
s 1 0.207385090 0.207385090 0.414770180 0.000000000
sum over m 0.207385090 0.207385090 0.414770180 0.000000000
s 2 0.014717895 0.014717895 0.029435790 0.000000000
sum over m 0.014717895 0.014717895 0.029435790 0.000000000
sum over m+mul 1.222902061 1.222902061 2.445804122 0.000000000
px 0 1.006391330 1.006391330 2.012782660 0.000000000
py 0 1.006390549 1.006390549 2.012781099 0.000000000
pz 0 1.006204320 1.006204320 2.012408639 0.000000000
sum over m 3.018986199 3.018986199 6.037972398 0.000000000
px 1 0.065451380 0.065451380 0.130902760 0.000000000
py 1 0.065449797 0.065449797 0.130899594 0.000000000
pz 1 0.040353482 0.040353482 0.080706963 0.000000000
sum over m 0.171254659 0.171254659 0.342509318 0.000000000
sum over m+mul 3.190240858 3.190240858 6.380481716 0.000000000
d3z^2-r^2 0 0.196317011 0.196317011 0.392634022 0.000000000
dx^2-y^2 0 0.201551362 0.201551362 0.403102725 0.000000000
dxy 0 0.250916975 0.250916975 0.501833950 0.000000000
dxz 0 0.268486420 0.268486420 0.536972840 0.000000000
dyz 0 0.268489531 0.268489531 0.536979062 0.000000000
sum over m 1.185761300 1.185761300 2.371522599 0.000000000
d3z^2-r^2 1 0.003469509 0.003469509 0.006939018 0.000000000
dx^2-y^2 1 -0.004486722 -0.004486722 -0.008973445 0.000000000
dxy 1 0.015348878 0.015348878 0.030697755 0.000000000
dxz 1 0.003488438 0.003488438 0.006976875 0.000000000
dyz 1 0.003488409 0.003488409 0.006976818 0.000000000
sum over m 0.021308511 0.021308511 0.042617021 0.000000000
sum over m+mul 1.207069810 1.207069810 2.414139621 0.000000000
45 O Up spin Down spin Sum Diff
multiple
s 0 0.893914047 0.893914047 1.787828094 0.000000000
sum over m 0.893914047 0.893914047 1.787828094 0.000000000
s 1 -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m+mul 0.890873559 0.890873559 1.781747118 0.000000000
px 0 0.787076034 0.787076034 1.574152068 0.000000000
py 0 0.786884071 0.786884071 1.573768142 0.000000000
pz 0 0.779774738 0.779774738 1.559549477 0.000000000
sum over m 2.353734844 2.353734844 4.707469687 0.000000000
px 1 -0.008745347 -0.008745347 -0.017490694 0.000000000
py 1 -0.008736786 -0.008736786 -0.017473571 0.000000000
pz 1 -0.006463925 -0.006463925 -0.012927850 0.000000000
sum over m -0.023946058 -0.023946058 -0.047892115 0.000000000
sum over m+mul 2.329788786 2.329788786 4.659577572 0.000000000
d3z^2-r^2 0 -0.006392667 -0.006392667 -0.012785333 0.000000000
dx^2-y^2 0 -0.005058377 -0.005058377 -0.010116753 0.000000000
dxy 0 -0.005435601 -0.005435601 -0.010871202 0.000000000
dxz 0 -0.006927428 -0.006927428 -0.013854856 0.000000000
dyz 0 -0.006930782 -0.006930782 -0.013861564 0.000000000
sum over m -0.030744854 -0.030744854 -0.061489708 0.000000000
sum over m+mul -0.030744854 -0.030744854 -0.061489708 0.000000000
46 O Up spin Down spin Sum Diff
multiple
s 0 0.893913386 0.893913386 1.787826773 0.000000000
sum over m 0.893913386 0.893913386 1.787826773 0.000000000
s 1 -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m+mul 0.890871876 0.890871876 1.781743752 0.000000000
px 0 0.786936799 0.786936799 1.573873598 0.000000000
py 0 0.787082983 0.787082983 1.574165965 0.000000000
pz 0 0.779721609 0.779721609 1.559443219 0.000000000
sum over m 2.353741391 2.353741391 4.707482782 0.000000000
px 1 -0.008738465 -0.008738465 -0.017476931 0.000000000
py 1 -0.008740597 -0.008740597 -0.017481195 0.000000000
pz 1 -0.006462880 -0.006462880 -0.012925760 0.000000000
sum over m -0.023941942 -0.023941942 -0.047883885 0.000000000
sum over m+mul 2.329799449 2.329799449 4.659598897 0.000000000
d3z^2-r^2 0 -0.006391999 -0.006391999 -0.012783997 0.000000000
dx^2-y^2 0 -0.005055370 -0.005055370 -0.010110741 0.000000000
dxy 0 -0.005435327 -0.005435327 -0.010870653 0.000000000
dxz 0 -0.006927532 -0.006927532 -0.013855065 0.000000000
dyz 0 -0.006925668 -0.006925668 -0.013851335 0.000000000
sum over m -0.030735896 -0.030735896 -0.061471791 0.000000000
sum over m+mul -0.030735896 -0.030735896 -0.061471791 0.000000000
47 O Up spin Down spin Sum Diff
multiple
s 0 0.893919403 0.893919403 1.787838806 0.000000000
sum over m 0.893919403 0.893919403 1.787838806 0.000000000
s 1 -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m+mul 0.890878531 0.890878531 1.781757063 0.000000000
px 0 0.786951811 0.786951811 1.573903621 0.000000000
py 0 0.787043897 0.787043897 1.574087794 0.000000000
pz 0 0.779741404 0.779741404 1.559482809 0.000000000
sum over m 2.353737112 2.353737112 4.707474224 0.000000000
px 1 -0.008739215 -0.008739215 -0.017478430 0.000000000
py 1 -0.008740843 -0.008740843 -0.017481686 0.000000000
pz 1 -0.006464071 -0.006464071 -0.012928141 0.000000000
sum over m -0.023944129 -0.023944129 -0.047888257 0.000000000
sum over m+mul 2.329792983 2.329792983 4.659585966 0.000000000
d3z^2-r^2 0 -0.006392789 -0.006392789 -0.012785577 0.000000000
dx^2-y^2 0 -0.005056673 -0.005056673 -0.010113346 0.000000000
dxy 0 -0.005435497 -0.005435497 -0.010870994 0.000000000
dxz 0 -0.006928318 -0.006928318 -0.013856635 0.000000000
dyz 0 -0.006926750 -0.006926750 -0.013853500 0.000000000
sum over m -0.030740026 -0.030740026 -0.061480053 0.000000000
sum over m+mul -0.030740026 -0.030740026 -0.061480053 0.000000000
48 O Up spin Down spin Sum Diff
multiple
s 0 0.893869394 0.893869394 1.787738788 0.000000000
sum over m 0.893869394 0.893869394 1.787738788 0.000000000
s 1 -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m+mul 0.890828733 0.890828733 1.781657466 0.000000000
px 0 0.786946663 0.786946663 1.573893326 0.000000000
py 0 0.786883501 0.786883501 1.573767003 0.000000000
pz 0 0.779866122 0.779866122 1.559732244 0.000000000
sum over m 2.353696287 2.353696287 4.707392573 0.000000000
px 1 -0.008736912 -0.008736912 -0.017473824 0.000000000
py 1 -0.008730798 -0.008730798 -0.017461596 0.000000000
pz 1 -0.006468956 -0.006468956 -0.012937912 0.000000000
sum over m -0.023936666 -0.023936666 -0.047873332 0.000000000
sum over m+mul 2.329759621 2.329759621 4.659519242 0.000000000
d3z^2-r^2 0 -0.006391283 -0.006391283 -0.012782565 0.000000000
dx^2-y^2 0 -0.005060925 -0.005060925 -0.010121850 0.000000000
dxy 0 -0.005434026 -0.005434026 -0.010868052 0.000000000
dxz 0 -0.006932730 -0.006932730 -0.013865459 0.000000000
dyz 0 -0.006933987 -0.006933987 -0.013867973 0.000000000
sum over m -0.030752950 -0.030752950 -0.061505900 0.000000000
sum over m+mul -0.030752950 -0.030752950 -0.061505900 0.000000000
49 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798134 1.000798134 2.001596268 0.000000000
sum over m 1.000798134 1.000798134 2.001596268 0.000000000
s 1 0.207380313 0.207380313 0.414760626 0.000000000
sum over m 0.207380313 0.207380313 0.414760626 0.000000000
s 2 0.014717122 0.014717122 0.029434244 0.000000000
sum over m 0.014717122 0.014717122 0.029434244 0.000000000
sum over m+mul 1.222895569 1.222895569 2.445791138 0.000000000
px 0 1.006395472 1.006395472 2.012790943 0.000000000
py 0 1.006399840 1.006399840 2.012799680 0.000000000
pz 0 1.006210919 1.006210919 2.012421838 0.000000000
sum over m 3.019006230 3.019006230 6.038012461 0.000000000
px 1 0.065458011 0.065458011 0.130916022 0.000000000
py 1 0.065452116 0.065452116 0.130904232 0.000000000
pz 1 0.040344786 0.040344786 0.080689573 0.000000000
sum over m 0.171254913 0.171254913 0.342509826 0.000000000
sum over m+mul 3.190261144 3.190261144 6.380522287 0.000000000
d3z^2-r^2 0 0.196308817 0.196308817 0.392617635 0.000000000
dx^2-y^2 0 0.201552617 0.201552617 0.403105235 0.000000000
dxy 0 0.250913136 0.250913136 0.501826272 0.000000000
dxz 0 0.268494472 0.268494472 0.536988945 0.000000000
dyz 0 0.268491880 0.268491880 0.536983760 0.000000000
sum over m 1.185760922 1.185760922 2.371521845 0.000000000
d3z^2-r^2 1 0.003468385 0.003468385 0.006936771 0.000000000
dx^2-y^2 1 -0.004487731 -0.004487731 -0.008975462 0.000000000
dxy 1 0.015348016 0.015348016 0.030696032 0.000000000
dxz 1 0.003485835 0.003485835 0.006971671 0.000000000
dyz 1 0.003485545 0.003485545 0.006971091 0.000000000
sum over m 0.021300051 0.021300051 0.042600102 0.000000000
sum over m+mul 1.207060974 1.207060974 2.414121947 0.000000000
50 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000799076 1.000799076 2.001598152 0.000000000
sum over m 1.000799076 1.000799076 2.001598152 0.000000000
s 1 0.207385090 0.207385090 0.414770180 0.000000000
sum over m 0.207385090 0.207385090 0.414770180 0.000000000
s 2 0.014717895 0.014717895 0.029435790 0.000000000
sum over m 0.014717895 0.014717895 0.029435790 0.000000000
sum over m+mul 1.222902061 1.222902061 2.445804121 0.000000000
px 0 1.006391330 1.006391330 2.012782660 0.000000000
py 0 1.006390549 1.006390549 2.012781099 0.000000000
pz 0 1.006204320 1.006204320 2.012408639 0.000000000
sum over m 3.018986199 3.018986199 6.037972398 0.000000000
px 1 0.065451380 0.065451380 0.130902760 0.000000000
py 1 0.065449797 0.065449797 0.130899594 0.000000000
pz 1 0.040353482 0.040353482 0.080706963 0.000000000
sum over m 0.171254659 0.171254659 0.342509317 0.000000000
sum over m+mul 3.190240858 3.190240858 6.380481715 0.000000000
d3z^2-r^2 0 0.196317011 0.196317011 0.392634021 0.000000000
dx^2-y^2 0 0.201551363 0.201551363 0.403102726 0.000000000
dxy 0 0.250916975 0.250916975 0.501833950 0.000000000
dxz 0 0.268486420 0.268486420 0.536972840 0.000000000
dyz 0 0.268489531 0.268489531 0.536979062 0.000000000
sum over m 1.185761300 1.185761300 2.371522600 0.000000000
d3z^2-r^2 1 0.003469509 0.003469509 0.006939018 0.000000000
dx^2-y^2 1 -0.004486722 -0.004486722 -0.008973445 0.000000000
dxy 1 0.015348878 0.015348878 0.030697756 0.000000000
dxz 1 0.003488438 0.003488438 0.006976875 0.000000000
dyz 1 0.003488409 0.003488409 0.006976818 0.000000000
sum over m 0.021308511 0.021308511 0.042617021 0.000000000
sum over m+mul 1.207069811 1.207069811 2.414139622 0.000000000
51 O Up spin Down spin Sum Diff
multiple
s 0 0.893914047 0.893914047 1.787828094 0.000000000
sum over m 0.893914047 0.893914047 1.787828094 0.000000000
s 1 -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m+mul 0.890873559 0.890873559 1.781747118 0.000000000
px 0 0.787076034 0.787076034 1.574152068 0.000000000
py 0 0.786884071 0.786884071 1.573768142 0.000000000
pz 0 0.779774739 0.779774739 1.559549477 0.000000000
sum over m 2.353734844 2.353734844 4.707469688 0.000000000
px 1 -0.008745347 -0.008745347 -0.017490694 0.000000000
py 1 -0.008736786 -0.008736786 -0.017473571 0.000000000
pz 1 -0.006463925 -0.006463925 -0.012927850 0.000000000
sum over m -0.023946058 -0.023946058 -0.047892115 0.000000000
sum over m+mul 2.329788786 2.329788786 4.659577572 0.000000000
d3z^2-r^2 0 -0.006392667 -0.006392667 -0.012785333 0.000000000
dx^2-y^2 0 -0.005058377 -0.005058377 -0.010116753 0.000000000
dxy 0 -0.005435601 -0.005435601 -0.010871202 0.000000000
dxz 0 -0.006927428 -0.006927428 -0.013854856 0.000000000
dyz 0 -0.006930782 -0.006930782 -0.013861564 0.000000000
sum over m -0.030744854 -0.030744854 -0.061489708 0.000000000
sum over m+mul -0.030744854 -0.030744854 -0.061489708 0.000000000
52 O Up spin Down spin Sum Diff
multiple
s 0 0.893913386 0.893913386 1.787826773 0.000000000
sum over m 0.893913386 0.893913386 1.787826773 0.000000000
s 1 -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m+mul 0.890871876 0.890871876 1.781743752 0.000000000
px 0 0.786936799 0.786936799 1.573873598 0.000000000
py 0 0.787082983 0.787082983 1.574165965 0.000000000
pz 0 0.779721609 0.779721609 1.559443219 0.000000000
sum over m 2.353741391 2.353741391 4.707482782 0.000000000
px 1 -0.008738465 -0.008738465 -0.017476931 0.000000000
py 1 -0.008740597 -0.008740597 -0.017481195 0.000000000
pz 1 -0.006462880 -0.006462880 -0.012925760 0.000000000
sum over m -0.023941942 -0.023941942 -0.047883885 0.000000000
sum over m+mul 2.329799449 2.329799449 4.659598897 0.000000000
d3z^2-r^2 0 -0.006391999 -0.006391999 -0.012783997 0.000000000
dx^2-y^2 0 -0.005055370 -0.005055370 -0.010110741 0.000000000
dxy 0 -0.005435327 -0.005435327 -0.010870653 0.000000000
dxz 0 -0.006927532 -0.006927532 -0.013855065 0.000000000
dyz 0 -0.006925668 -0.006925668 -0.013851335 0.000000000
sum over m -0.030735896 -0.030735896 -0.061471791 0.000000000
sum over m+mul -0.030735896 -0.030735896 -0.061471791 0.000000000
53 O Up spin Down spin Sum Diff
multiple
s 0 0.893919403 0.893919403 1.787838806 0.000000000
sum over m 0.893919403 0.893919403 1.787838806 0.000000000
s 1 -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m+mul 0.890878531 0.890878531 1.781757063 0.000000000
px 0 0.786951810 0.786951810 1.573903621 0.000000000
py 0 0.787043897 0.787043897 1.574087793 0.000000000
pz 0 0.779741404 0.779741404 1.559482809 0.000000000
sum over m 2.353737111 2.353737111 4.707474223 0.000000000
px 1 -0.008739215 -0.008739215 -0.017478430 0.000000000
py 1 -0.008740843 -0.008740843 -0.017481686 0.000000000
pz 1 -0.006464071 -0.006464071 -0.012928141 0.000000000
sum over m -0.023944129 -0.023944129 -0.047888257 0.000000000
sum over m+mul 2.329792983 2.329792983 4.659585966 0.000000000
d3z^2-r^2 0 -0.006392789 -0.006392789 -0.012785577 0.000000000
dx^2-y^2 0 -0.005056673 -0.005056673 -0.010113346 0.000000000
dxy 0 -0.005435497 -0.005435497 -0.010870994 0.000000000
dxz 0 -0.006928318 -0.006928318 -0.013856635 0.000000000
dyz 0 -0.006926750 -0.006926750 -0.013853500 0.000000000
sum over m -0.030740026 -0.030740026 -0.061480053 0.000000000
sum over m+mul -0.030740026 -0.030740026 -0.061480053 0.000000000
54 O Up spin Down spin Sum Diff
multiple
s 0 0.893869394 0.893869394 1.787738788 0.000000000
sum over m 0.893869394 0.893869394 1.787738788 0.000000000
s 1 -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m+mul 0.890828733 0.890828733 1.781657466 0.000000000
px 0 0.786946663 0.786946663 1.573893326 0.000000000
py 0 0.786883501 0.786883501 1.573767002 0.000000000
pz 0 0.779866122 0.779866122 1.559732245 0.000000000
sum over m 2.353696287 2.353696287 4.707392573 0.000000000
px 1 -0.008736912 -0.008736912 -0.017473824 0.000000000
py 1 -0.008730798 -0.008730798 -0.017461596 0.000000000
pz 1 -0.006468956 -0.006468956 -0.012937912 0.000000000
sum over m -0.023936666 -0.023936666 -0.047873332 0.000000000
sum over m+mul 2.329759621 2.329759621 4.659519242 0.000000000
d3z^2-r^2 0 -0.006391283 -0.006391283 -0.012782565 0.000000000
dx^2-y^2 0 -0.005060925 -0.005060925 -0.010121850 0.000000000
dxy 0 -0.005434026 -0.005434026 -0.010868052 0.000000000
dxz 0 -0.006932730 -0.006932730 -0.013865459 0.000000000
dyz 0 -0.006933987 -0.006933987 -0.013867973 0.000000000
sum over m -0.030752950 -0.030752950 -0.061505900 0.000000000
sum over m+mul -0.030752950 -0.030752950 -0.061505900 0.000000000
55 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798134 1.000798134 2.001596268 0.000000000
sum over m 1.000798134 1.000798134 2.001596268 0.000000000
s 1 0.207380313 0.207380313 0.414760625 0.000000000
sum over m 0.207380313 0.207380313 0.414760625 0.000000000
s 2 0.014717122 0.014717122 0.029434244 0.000000000
sum over m 0.014717122 0.014717122 0.029434244 0.000000000
sum over m+mul 1.222895569 1.222895569 2.445791137 0.000000000
px 0 1.006395472 1.006395472 2.012790943 0.000000000
py 0 1.006399840 1.006399840 2.012799680 0.000000000
pz 0 1.006210919 1.006210919 2.012421838 0.000000000
sum over m 3.019006230 3.019006230 6.038012461 0.000000000
px 1 0.065458011 0.065458011 0.130916022 0.000000000
py 1 0.065452116 0.065452116 0.130904232 0.000000000
pz 1 0.040344786 0.040344786 0.080689573 0.000000000
sum over m 0.171254914 0.171254914 0.342509827 0.000000000
sum over m+mul 3.190261144 3.190261144 6.380522288 0.000000000
d3z^2-r^2 0 0.196308817 0.196308817 0.392617635 0.000000000
dx^2-y^2 0 0.201552618 0.201552618 0.403105235 0.000000000
dxy 0 0.250913136 0.250913136 0.501826271 0.000000000
dxz 0 0.268494472 0.268494472 0.536988944 0.000000000
dyz 0 0.268491880 0.268491880 0.536983760 0.000000000
sum over m 1.185760922 1.185760922 2.371521845 0.000000000
d3z^2-r^2 1 0.003468385 0.003468385 0.006936771 0.000000000
dx^2-y^2 1 -0.004487731 -0.004487731 -0.008975462 0.000000000
dxy 1 0.015348016 0.015348016 0.030696032 0.000000000
dxz 1 0.003485835 0.003485835 0.006971671 0.000000000
dyz 1 0.003485545 0.003485545 0.006971091 0.000000000
sum over m 0.021300051 0.021300051 0.042600102 0.000000000
sum over m+mul 1.207060974 1.207060974 2.414121947 0.000000000
56 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000799076 1.000799076 2.001598152 0.000000000
sum over m 1.000799076 1.000799076 2.001598152 0.000000000
s 1 0.207385090 0.207385090 0.414770180 0.000000000
sum over m 0.207385090 0.207385090 0.414770180 0.000000000
s 2 0.014717895 0.014717895 0.029435790 0.000000000
sum over m 0.014717895 0.014717895 0.029435790 0.000000000
sum over m+mul 1.222902061 1.222902061 2.445804121 0.000000000
px 0 1.006391330 1.006391330 2.012782660 0.000000000
py 0 1.006390549 1.006390549 2.012781099 0.000000000
pz 0 1.006204320 1.006204320 2.012408639 0.000000000
sum over m 3.018986199 3.018986199 6.037972398 0.000000000
px 1 0.065451380 0.065451380 0.130902760 0.000000000
py 1 0.065449797 0.065449797 0.130899594 0.000000000
pz 1 0.040353482 0.040353482 0.080706963 0.000000000
sum over m 0.171254659 0.171254659 0.342509317 0.000000000
sum over m+mul 3.190240857 3.190240857 6.380481715 0.000000000
d3z^2-r^2 0 0.196317011 0.196317011 0.392634022 0.000000000
dx^2-y^2 0 0.201551363 0.201551363 0.403102726 0.000000000
dxy 0 0.250916975 0.250916975 0.501833951 0.000000000
dxz 0 0.268486420 0.268486420 0.536972840 0.000000000
dyz 0 0.268489531 0.268489531 0.536979063 0.000000000
sum over m 1.185761301 1.185761301 2.371522602 0.000000000
d3z^2-r^2 1 0.003469509 0.003469509 0.006939018 0.000000000
dx^2-y^2 1 -0.004486722 -0.004486722 -0.008973445 0.000000000
dxy 1 0.015348878 0.015348878 0.030697755 0.000000000
dxz 1 0.003488438 0.003488438 0.006976875 0.000000000
dyz 1 0.003488409 0.003488409 0.006976818 0.000000000
sum over m 0.021308511 0.021308511 0.042617021 0.000000000
sum over m+mul 1.207069811 1.207069811 2.414139623 0.000000000
57 O Up spin Down spin Sum Diff
multiple
s 0 0.893914047 0.893914047 1.787828094 0.000000000
sum over m 0.893914047 0.893914047 1.787828094 0.000000000
s 1 -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m+mul 0.890873559 0.890873559 1.781747118 0.000000000
px 0 0.787076034 0.787076034 1.574152068 0.000000000
py 0 0.786884071 0.786884071 1.573768142 0.000000000
pz 0 0.779774739 0.779774739 1.559549477 0.000000000
sum over m 2.353734844 2.353734844 4.707469688 0.000000000
px 1 -0.008745347 -0.008745347 -0.017490695 0.000000000
py 1 -0.008736786 -0.008736786 -0.017473571 0.000000000
pz 1 -0.006463925 -0.006463925 -0.012927850 0.000000000
sum over m -0.023946058 -0.023946058 -0.047892115 0.000000000
sum over m+mul 2.329788786 2.329788786 4.659577572 0.000000000
d3z^2-r^2 0 -0.006392667 -0.006392667 -0.012785333 0.000000000
dx^2-y^2 0 -0.005058377 -0.005058377 -0.010116753 0.000000000
dxy 0 -0.005435601 -0.005435601 -0.010871202 0.000000000
dxz 0 -0.006927428 -0.006927428 -0.013854856 0.000000000
dyz 0 -0.006930782 -0.006930782 -0.013861564 0.000000000
sum over m -0.030744854 -0.030744854 -0.061489708 0.000000000
sum over m+mul -0.030744854 -0.030744854 -0.061489708 0.000000000
58 O Up spin Down spin Sum Diff
multiple
s 0 0.893913386 0.893913386 1.787826773 0.000000000
sum over m 0.893913386 0.893913386 1.787826773 0.000000000
s 1 -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m+mul 0.890871876 0.890871876 1.781743752 0.000000000
px 0 0.786936799 0.786936799 1.573873598 0.000000000
py 0 0.787082983 0.787082983 1.574165965 0.000000000
pz 0 0.779721609 0.779721609 1.559443218 0.000000000
sum over m 2.353741391 2.353741391 4.707482782 0.000000000
px 1 -0.008738465 -0.008738465 -0.017476931 0.000000000
py 1 -0.008740597 -0.008740597 -0.017481194 0.000000000
pz 1 -0.006462880 -0.006462880 -0.012925760 0.000000000
sum over m -0.023941942 -0.023941942 -0.047883885 0.000000000
sum over m+mul 2.329799449 2.329799449 4.659598897 0.000000000
d3z^2-r^2 0 -0.006391999 -0.006391999 -0.012783997 0.000000000
dx^2-y^2 0 -0.005055370 -0.005055370 -0.010110741 0.000000000
dxy 0 -0.005435327 -0.005435327 -0.010870653 0.000000000
dxz 0 -0.006927532 -0.006927532 -0.013855065 0.000000000
dyz 0 -0.006925668 -0.006925668 -0.013851335 0.000000000
sum over m -0.030735896 -0.030735896 -0.061471791 0.000000000
sum over m+mul -0.030735896 -0.030735896 -0.061471791 0.000000000
59 O Up spin Down spin Sum Diff
multiple
s 0 0.893919403 0.893919403 1.787838806 0.000000000
sum over m 0.893919403 0.893919403 1.787838806 0.000000000
s 1 -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m+mul 0.890878531 0.890878531 1.781757063 0.000000000
px 0 0.786951810 0.786951810 1.573903621 0.000000000
py 0 0.787043897 0.787043897 1.574087793 0.000000000
pz 0 0.779741404 0.779741404 1.559482809 0.000000000
sum over m 2.353737112 2.353737112 4.707474223 0.000000000
px 1 -0.008739215 -0.008739215 -0.017478430 0.000000000
py 1 -0.008740843 -0.008740843 -0.017481686 0.000000000
pz 1 -0.006464071 -0.006464071 -0.012928141 0.000000000
sum over m -0.023944129 -0.023944129 -0.047888257 0.000000000
sum over m+mul 2.329792983 2.329792983 4.659585966 0.000000000
d3z^2-r^2 0 -0.006392789 -0.006392789 -0.012785577 0.000000000
dx^2-y^2 0 -0.005056673 -0.005056673 -0.010113346 0.000000000
dxy 0 -0.005435497 -0.005435497 -0.010870994 0.000000000
dxz 0 -0.006928318 -0.006928318 -0.013856635 0.000000000
dyz 0 -0.006926750 -0.006926750 -0.013853500 0.000000000
sum over m -0.030740026 -0.030740026 -0.061480053 0.000000000
sum over m+mul -0.030740026 -0.030740026 -0.061480053 0.000000000
60 O Up spin Down spin Sum Diff
multiple
s 0 0.893869394 0.893869394 1.787738788 0.000000000
sum over m 0.893869394 0.893869394 1.787738788 0.000000000
s 1 -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m+mul 0.890828733 0.890828733 1.781657466 0.000000000
px 0 0.786946663 0.786946663 1.573893326 0.000000000
py 0 0.786883501 0.786883501 1.573767003 0.000000000
pz 0 0.779866123 0.779866123 1.559732245 0.000000000
sum over m 2.353696287 2.353696287 4.707392573 0.000000000
px 1 -0.008736912 -0.008736912 -0.017473824 0.000000000
py 1 -0.008730798 -0.008730798 -0.017461596 0.000000000
pz 1 -0.006468956 -0.006468956 -0.012937912 0.000000000
sum over m -0.023936666 -0.023936666 -0.047873332 0.000000000
sum over m+mul 2.329759621 2.329759621 4.659519242 0.000000000
d3z^2-r^2 0 -0.006391283 -0.006391283 -0.012782565 0.000000000
dx^2-y^2 0 -0.005060925 -0.005060925 -0.010121850 0.000000000
dxy 0 -0.005434026 -0.005434026 -0.010868052 0.000000000
dxz 0 -0.006932730 -0.006932730 -0.013865459 0.000000000
dyz 0 -0.006933987 -0.006933987 -0.013867973 0.000000000
sum over m -0.030752950 -0.030752950 -0.061505900 0.000000000
sum over m+mul -0.030752950 -0.030752950 -0.061505900 0.000000000
61 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798134 1.000798134 2.001596268 0.000000000
sum over m 1.000798134 1.000798134 2.001596268 0.000000000
s 1 0.207380313 0.207380313 0.414760626 0.000000000
sum over m 0.207380313 0.207380313 0.414760626 0.000000000
s 2 0.014717122 0.014717122 0.029434244 0.000000000
sum over m 0.014717122 0.014717122 0.029434244 0.000000000
sum over m+mul 1.222895569 1.222895569 2.445791137 0.000000000
px 0 1.006395472 1.006395472 2.012790943 0.000000000
py 0 1.006399840 1.006399840 2.012799680 0.000000000
pz 0 1.006210919 1.006210919 2.012421838 0.000000000
sum over m 3.019006230 3.019006230 6.038012461 0.000000000
px 1 0.065458011 0.065458011 0.130916022 0.000000000
py 1 0.065452116 0.065452116 0.130904233 0.000000000
pz 1 0.040344786 0.040344786 0.080689572 0.000000000
sum over m 0.171254913 0.171254913 0.342509827 0.000000000
sum over m+mul 3.190261144 3.190261144 6.380522288 0.000000000
d3z^2-r^2 0 0.196308817 0.196308817 0.392617635 0.000000000
dx^2-y^2 0 0.201552617 0.201552617 0.403105235 0.000000000
dxy 0 0.250913136 0.250913136 0.501826271 0.000000000
dxz 0 0.268494472 0.268494472 0.536988944 0.000000000
dyz 0 0.268491880 0.268491880 0.536983760 0.000000000
sum over m 1.185760922 1.185760922 2.371521845 0.000000000
d3z^2-r^2 1 0.003468385 0.003468385 0.006936771 0.000000000
dx^2-y^2 1 -0.004487731 -0.004487731 -0.008975462 0.000000000
dxy 1 0.015348016 0.015348016 0.030696032 0.000000000
dxz 1 0.003485835 0.003485835 0.006971671 0.000000000
dyz 1 0.003485545 0.003485545 0.006971091 0.000000000
sum over m 0.021300051 0.021300051 0.042600102 0.000000000
sum over m+mul 1.207060974 1.207060974 2.414121947 0.000000000
62 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000799076 1.000799076 2.001598152 0.000000000
sum over m 1.000799076 1.000799076 2.001598152 0.000000000
s 1 0.207385090 0.207385090 0.414770180 0.000000000
sum over m 0.207385090 0.207385090 0.414770180 0.000000000
s 2 0.014717895 0.014717895 0.029435790 0.000000000
sum over m 0.014717895 0.014717895 0.029435790 0.000000000
sum over m+mul 1.222902061 1.222902061 2.445804121 0.000000000
px 0 1.006391330 1.006391330 2.012782660 0.000000000
py 0 1.006390550 1.006390550 2.012781099 0.000000000
pz 0 1.006204320 1.006204320 2.012408639 0.000000000
sum over m 3.018986199 3.018986199 6.037972398 0.000000000
px 1 0.065451380 0.065451380 0.130902760 0.000000000
py 1 0.065449797 0.065449797 0.130899594 0.000000000
pz 1 0.040353482 0.040353482 0.080706963 0.000000000
sum over m 0.171254659 0.171254659 0.342509317 0.000000000
sum over m+mul 3.190240858 3.190240858 6.380481715 0.000000000
d3z^2-r^2 0 0.196317011 0.196317011 0.392634022 0.000000000
dx^2-y^2 0 0.201551363 0.201551363 0.403102726 0.000000000
dxy 0 0.250916975 0.250916975 0.501833951 0.000000000
dxz 0 0.268486420 0.268486420 0.536972841 0.000000000
dyz 0 0.268489531 0.268489531 0.536979062 0.000000000
sum over m 1.185761301 1.185761301 2.371522601 0.000000000
d3z^2-r^2 1 0.003469509 0.003469509 0.006939018 0.000000000
dx^2-y^2 1 -0.004486722 -0.004486722 -0.008973445 0.000000000
dxy 1 0.015348878 0.015348878 0.030697755 0.000000000
dxz 1 0.003488438 0.003488438 0.006976875 0.000000000
dyz 1 0.003488409 0.003488409 0.006976818 0.000000000
sum over m 0.021308511 0.021308511 0.042617021 0.000000000
sum over m+mul 1.207069811 1.207069811 2.414139623 0.000000000
63 O Up spin Down spin Sum Diff
multiple
s 0 0.893914047 0.893914047 1.787828094 0.000000000
sum over m 0.893914047 0.893914047 1.787828094 0.000000000
s 1 -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m+mul 0.890873559 0.890873559 1.781747118 0.000000000
px 0 0.787076034 0.787076034 1.574152068 0.000000000
py 0 0.786884071 0.786884071 1.573768142 0.000000000
pz 0 0.779774738 0.779774738 1.559549477 0.000000000
sum over m 2.353734844 2.353734844 4.707469687 0.000000000
px 1 -0.008745347 -0.008745347 -0.017490694 0.000000000
py 1 -0.008736786 -0.008736786 -0.017473571 0.000000000
pz 1 -0.006463925 -0.006463925 -0.012927850 0.000000000
sum over m -0.023946058 -0.023946058 -0.047892115 0.000000000
sum over m+mul 2.329788786 2.329788786 4.659577572 0.000000000
d3z^2-r^2 0 -0.006392667 -0.006392667 -0.012785333 0.000000000
dx^2-y^2 0 -0.005058377 -0.005058377 -0.010116753 0.000000000
dxy 0 -0.005435601 -0.005435601 -0.010871202 0.000000000
dxz 0 -0.006927428 -0.006927428 -0.013854856 0.000000000
dyz 0 -0.006930782 -0.006930782 -0.013861564 0.000000000
sum over m -0.030744854 -0.030744854 -0.061489708 0.000000000
sum over m+mul -0.030744854 -0.030744854 -0.061489708 0.000000000
64 O Up spin Down spin Sum Diff
multiple
s 0 0.893913386 0.893913386 1.787826773 0.000000000
sum over m 0.893913386 0.893913386 1.787826773 0.000000000
s 1 -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m+mul 0.890871876 0.890871876 1.781743752 0.000000000
px 0 0.786936799 0.786936799 1.573873599 0.000000000
py 0 0.787082983 0.787082983 1.574165966 0.000000000
pz 0 0.779721609 0.779721609 1.559443219 0.000000000
sum over m 2.353741392 2.353741392 4.707482783 0.000000000
px 1 -0.008738465 -0.008738465 -0.017476931 0.000000000
py 1 -0.008740597 -0.008740597 -0.017481195 0.000000000
pz 1 -0.006462880 -0.006462880 -0.012925760 0.000000000
sum over m -0.023941942 -0.023941942 -0.047883885 0.000000000
sum over m+mul 2.329799449 2.329799449 4.659598898 0.000000000
d3z^2-r^2 0 -0.006391999 -0.006391999 -0.012783997 0.000000000
dx^2-y^2 0 -0.005055370 -0.005055370 -0.010110741 0.000000000
dxy 0 -0.005435327 -0.005435327 -0.010870653 0.000000000
dxz 0 -0.006927532 -0.006927532 -0.013855065 0.000000000
dyz 0 -0.006925668 -0.006925668 -0.013851335 0.000000000
sum over m -0.030735896 -0.030735896 -0.061471791 0.000000000
sum over m+mul -0.030735896 -0.030735896 -0.061471791 0.000000000
65 O Up spin Down spin Sum Diff
multiple
s 0 0.893919403 0.893919403 1.787838806 0.000000000
sum over m 0.893919403 0.893919403 1.787838806 0.000000000
s 1 -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m+mul 0.890878531 0.890878531 1.781757063 0.000000000
px 0 0.786951810 0.786951810 1.573903620 0.000000000
py 0 0.787043897 0.787043897 1.574087794 0.000000000
pz 0 0.779741404 0.779741404 1.559482809 0.000000000
sum over m 2.353737112 2.353737112 4.707474223 0.000000000
px 1 -0.008739215 -0.008739215 -0.017478430 0.000000000
py 1 -0.008740843 -0.008740843 -0.017481686 0.000000000
pz 1 -0.006464071 -0.006464071 -0.012928141 0.000000000
sum over m -0.023944129 -0.023944129 -0.047888257 0.000000000
sum over m+mul 2.329792983 2.329792983 4.659585966 0.000000000
d3z^2-r^2 0 -0.006392789 -0.006392789 -0.012785577 0.000000000
dx^2-y^2 0 -0.005056673 -0.005056673 -0.010113346 0.000000000
dxy 0 -0.005435497 -0.005435497 -0.010870994 0.000000000
dxz 0 -0.006928318 -0.006928318 -0.013856635 0.000000000
dyz 0 -0.006926750 -0.006926750 -0.013853500 0.000000000
sum over m -0.030740026 -0.030740026 -0.061480053 0.000000000
sum over m+mul -0.030740026 -0.030740026 -0.061480053 0.000000000
66 O Up spin Down spin Sum Diff
multiple
s 0 0.893869394 0.893869394 1.787738788 0.000000000
sum over m 0.893869394 0.893869394 1.787738788 0.000000000
s 1 -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m+mul 0.890828733 0.890828733 1.781657466 0.000000000
px 0 0.786946663 0.786946663 1.573893326 0.000000000
py 0 0.786883501 0.786883501 1.573767003 0.000000000
pz 0 0.779866122 0.779866122 1.559732245 0.000000000
sum over m 2.353696286 2.353696286 4.707392573 0.000000000
px 1 -0.008736912 -0.008736912 -0.017473824 0.000000000
py 1 -0.008730798 -0.008730798 -0.017461596 0.000000000
pz 1 -0.006468956 -0.006468956 -0.012937912 0.000000000
sum over m -0.023936666 -0.023936666 -0.047873331 0.000000000
sum over m+mul 2.329759621 2.329759621 4.659519241 0.000000000
d3z^2-r^2 0 -0.006391283 -0.006391283 -0.012782565 0.000000000
dx^2-y^2 0 -0.005060925 -0.005060925 -0.010121850 0.000000000
dxy 0 -0.005434026 -0.005434026 -0.010868052 0.000000000
dxz 0 -0.006932730 -0.006932730 -0.013865459 0.000000000
dyz 0 -0.006933987 -0.006933987 -0.013867973 0.000000000
sum over m -0.030752950 -0.030752950 -0.061505900 0.000000000
sum over m+mul -0.030752950 -0.030752950 -0.061505900 0.000000000
67 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798134 1.000798134 2.001596268 0.000000000
sum over m 1.000798134 1.000798134 2.001596268 0.000000000
s 1 0.207380313 0.207380313 0.414760626 0.000000000
sum over m 0.207380313 0.207380313 0.414760626 0.000000000
s 2 0.014717122 0.014717122 0.029434244 0.000000000
sum over m 0.014717122 0.014717122 0.029434244 0.000000000
sum over m+mul 1.222895569 1.222895569 2.445791138 0.000000000
px 0 1.006395472 1.006395472 2.012790943 0.000000000
py 0 1.006399840 1.006399840 2.012799680 0.000000000
pz 0 1.006210919 1.006210919 2.012421838 0.000000000
sum over m 3.019006230 3.019006230 6.038012461 0.000000000
px 1 0.065458011 0.065458011 0.130916022 0.000000000
py 1 0.065452116 0.065452116 0.130904233 0.000000000
pz 1 0.040344786 0.040344786 0.080689573 0.000000000
sum over m 0.171254914 0.171254914 0.342509827 0.000000000
sum over m+mul 3.190261144 3.190261144 6.380522288 0.000000000
d3z^2-r^2 0 0.196308817 0.196308817 0.392617635 0.000000000
dx^2-y^2 0 0.201552617 0.201552617 0.403105235 0.000000000
dxy 0 0.250913136 0.250913136 0.501826271 0.000000000
dxz 0 0.268494472 0.268494472 0.536988944 0.000000000
dyz 0 0.268491880 0.268491880 0.536983759 0.000000000
sum over m 1.185760922 1.185760922 2.371521844 0.000000000
d3z^2-r^2 1 0.003468385 0.003468385 0.006936771 0.000000000
dx^2-y^2 1 -0.004487731 -0.004487731 -0.008975462 0.000000000
dxy 1 0.015348016 0.015348016 0.030696032 0.000000000
dxz 1 0.003485835 0.003485835 0.006971671 0.000000000
dyz 1 0.003485545 0.003485545 0.006971091 0.000000000
sum over m 0.021300051 0.021300051 0.042600102 0.000000000
sum over m+mul 1.207060973 1.207060973 2.414121947 0.000000000
68 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000799076 1.000799076 2.001598152 0.000000000
sum over m 1.000799076 1.000799076 2.001598152 0.000000000
s 1 0.207385090 0.207385090 0.414770180 0.000000000
sum over m 0.207385090 0.207385090 0.414770180 0.000000000
s 2 0.014717895 0.014717895 0.029435790 0.000000000
sum over m 0.014717895 0.014717895 0.029435790 0.000000000
sum over m+mul 1.222902061 1.222902061 2.445804121 0.000000000
px 0 1.006391330 1.006391330 2.012782660 0.000000000
py 0 1.006390549 1.006390549 2.012781099 0.000000000
pz 0 1.006204320 1.006204320 2.012408639 0.000000000
sum over m 3.018986199 3.018986199 6.037972398 0.000000000
px 1 0.065451380 0.065451380 0.130902760 0.000000000
py 1 0.065449797 0.065449797 0.130899594 0.000000000
pz 1 0.040353482 0.040353482 0.080706963 0.000000000
sum over m 0.171254659 0.171254659 0.342509317 0.000000000
sum over m+mul 3.190240858 3.190240858 6.380481715 0.000000000
d3z^2-r^2 0 0.196317011 0.196317011 0.392634022 0.000000000
dx^2-y^2 0 0.201551363 0.201551363 0.403102726 0.000000000
dxy 0 0.250916975 0.250916975 0.501833950 0.000000000
dxz 0 0.268486420 0.268486420 0.536972840 0.000000000
dyz 0 0.268489531 0.268489531 0.536979062 0.000000000
sum over m 1.185761300 1.185761300 2.371522600 0.000000000
d3z^2-r^2 1 0.003469509 0.003469509 0.006939018 0.000000000
dx^2-y^2 1 -0.004486723 -0.004486723 -0.008973445 0.000000000
dxy 1 0.015348878 0.015348878 0.030697755 0.000000000
dxz 1 0.003488438 0.003488438 0.006976875 0.000000000
dyz 1 0.003488409 0.003488409 0.006976818 0.000000000
sum over m 0.021308511 0.021308511 0.042617021 0.000000000
sum over m+mul 1.207069811 1.207069811 2.414139622 0.000000000
69 O Up spin Down spin Sum Diff
multiple
s 0 0.893914047 0.893914047 1.787828094 0.000000000
sum over m 0.893914047 0.893914047 1.787828094 0.000000000
s 1 -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m+mul 0.890873559 0.890873559 1.781747118 0.000000000
px 0 0.787076034 0.787076034 1.574152068 0.000000000
py 0 0.786884071 0.786884071 1.573768142 0.000000000
pz 0 0.779774739 0.779774739 1.559549477 0.000000000
sum over m 2.353734844 2.353734844 4.707469688 0.000000000
px 1 -0.008745347 -0.008745347 -0.017490695 0.000000000
py 1 -0.008736785 -0.008736785 -0.017473571 0.000000000
pz 1 -0.006463925 -0.006463925 -0.012927850 0.000000000
sum over m -0.023946058 -0.023946058 -0.047892115 0.000000000
sum over m+mul 2.329788786 2.329788786 4.659577572 0.000000000
d3z^2-r^2 0 -0.006392667 -0.006392667 -0.012785333 0.000000000
dx^2-y^2 0 -0.005058377 -0.005058377 -0.010116753 0.000000000
dxy 0 -0.005435601 -0.005435601 -0.010871202 0.000000000
dxz 0 -0.006927428 -0.006927428 -0.013854856 0.000000000
dyz 0 -0.006930782 -0.006930782 -0.013861564 0.000000000
sum over m -0.030744854 -0.030744854 -0.061489708 0.000000000
sum over m+mul -0.030744854 -0.030744854 -0.061489708 0.000000000
70 O Up spin Down spin Sum Diff
multiple
s 0 0.893913386 0.893913386 1.787826773 0.000000000
sum over m 0.893913386 0.893913386 1.787826773 0.000000000
s 1 -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m+mul 0.890871876 0.890871876 1.781743752 0.000000000
px 0 0.786936799 0.786936799 1.573873599 0.000000000
py 0 0.787082983 0.787082983 1.574165965 0.000000000
pz 0 0.779721609 0.779721609 1.559443219 0.000000000
sum over m 2.353741391 2.353741391 4.707482783 0.000000000
px 1 -0.008738465 -0.008738465 -0.017476931 0.000000000
py 1 -0.008740597 -0.008740597 -0.017481195 0.000000000
pz 1 -0.006462880 -0.006462880 -0.012925760 0.000000000
sum over m -0.023941942 -0.023941942 -0.047883885 0.000000000
sum over m+mul 2.329799449 2.329799449 4.659598898 0.000000000
d3z^2-r^2 0 -0.006391999 -0.006391999 -0.012783997 0.000000000
dx^2-y^2 0 -0.005055370 -0.005055370 -0.010110741 0.000000000
dxy 0 -0.005435327 -0.005435327 -0.010870653 0.000000000
dxz 0 -0.006927532 -0.006927532 -0.013855065 0.000000000
dyz 0 -0.006925668 -0.006925668 -0.013851335 0.000000000
sum over m -0.030735896 -0.030735896 -0.061471791 0.000000000
sum over m+mul -0.030735896 -0.030735896 -0.061471791 0.000000000
71 O Up spin Down spin Sum Diff
multiple
s 0 0.893919403 0.893919403 1.787838806 0.000000000
sum over m 0.893919403 0.893919403 1.787838806 0.000000000
s 1 -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m+mul 0.890878531 0.890878531 1.781757063 0.000000000
px 0 0.786951810 0.786951810 1.573903621 0.000000000
py 0 0.787043897 0.787043897 1.574087793 0.000000000
pz 0 0.779741404 0.779741404 1.559482809 0.000000000
sum over m 2.353737112 2.353737112 4.707474223 0.000000000
px 1 -0.008739215 -0.008739215 -0.017478430 0.000000000
py 1 -0.008740843 -0.008740843 -0.017481686 0.000000000
pz 1 -0.006464071 -0.006464071 -0.012928141 0.000000000
sum over m -0.023944129 -0.023944129 -0.047888257 0.000000000
sum over m+mul 2.329792983 2.329792983 4.659585966 0.000000000
d3z^2-r^2 0 -0.006392789 -0.006392789 -0.012785577 0.000000000
dx^2-y^2 0 -0.005056673 -0.005056673 -0.010113346 0.000000000
dxy 0 -0.005435497 -0.005435497 -0.010870994 0.000000000
dxz 0 -0.006928318 -0.006928318 -0.013856635 0.000000000
dyz 0 -0.006926750 -0.006926750 -0.013853500 0.000000000
sum over m -0.030740027 -0.030740027 -0.061480053 0.000000000
sum over m+mul -0.030740027 -0.030740027 -0.061480053 0.000000000
72 O Up spin Down spin Sum Diff
multiple
s 0 0.893869394 0.893869394 1.787738788 0.000000000
sum over m 0.893869394 0.893869394 1.787738788 0.000000000
s 1 -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m+mul 0.890828733 0.890828733 1.781657466 0.000000000
px 0 0.786946663 0.786946663 1.573893326 0.000000000
py 0 0.786883501 0.786883501 1.573767003 0.000000000
pz 0 0.779866122 0.779866122 1.559732244 0.000000000
sum over m 2.353696286 2.353696286 4.707392573 0.000000000
px 1 -0.008736912 -0.008736912 -0.017473824 0.000000000
py 1 -0.008730798 -0.008730798 -0.017461596 0.000000000
pz 1 -0.006468956 -0.006468956 -0.012937912 0.000000000
sum over m -0.023936666 -0.023936666 -0.047873332 0.000000000
sum over m+mul 2.329759621 2.329759621 4.659519241 0.000000000
d3z^2-r^2 0 -0.006391283 -0.006391283 -0.012782565 0.000000000
dx^2-y^2 0 -0.005060925 -0.005060925 -0.010121850 0.000000000
dxy 0 -0.005434026 -0.005434026 -0.010868052 0.000000000
dxz 0 -0.006932730 -0.006932730 -0.013865459 0.000000000
dyz 0 -0.006933987 -0.006933987 -0.013867973 0.000000000
sum over m -0.030752950 -0.030752950 -0.061505900 0.000000000
sum over m+mul -0.030752950 -0.030752950 -0.061505900 0.000000000
73 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798134 1.000798134 2.001596268 0.000000000
sum over m 1.000798134 1.000798134 2.001596268 0.000000000
s 1 0.207380313 0.207380313 0.414760625 0.000000000
sum over m 0.207380313 0.207380313 0.414760625 0.000000000
s 2 0.014717122 0.014717122 0.029434244 0.000000000
sum over m 0.014717122 0.014717122 0.029434244 0.000000000
sum over m+mul 1.222895569 1.222895569 2.445791137 0.000000000
px 0 1.006395472 1.006395472 2.012790943 0.000000000
py 0 1.006399840 1.006399840 2.012799680 0.000000000
pz 0 1.006210919 1.006210919 2.012421838 0.000000000
sum over m 3.019006231 3.019006231 6.038012461 0.000000000
px 1 0.065458011 0.065458011 0.130916022 0.000000000
py 1 0.065452116 0.065452116 0.130904233 0.000000000
pz 1 0.040344786 0.040344786 0.080689573 0.000000000
sum over m 0.171254914 0.171254914 0.342509828 0.000000000
sum over m+mul 3.190261144 3.190261144 6.380522289 0.000000000
d3z^2-r^2 0 0.196308817 0.196308817 0.392617635 0.000000000
dx^2-y^2 0 0.201552618 0.201552618 0.403105235 0.000000000
dxy 0 0.250913136 0.250913136 0.501826272 0.000000000
dxz 0 0.268494472 0.268494472 0.536988944 0.000000000
dyz 0 0.268491880 0.268491880 0.536983759 0.000000000
sum over m 1.185760922 1.185760922 2.371521845 0.000000000
d3z^2-r^2 1 0.003468385 0.003468385 0.006936771 0.000000000
dx^2-y^2 1 -0.004487731 -0.004487731 -0.008975462 0.000000000
dxy 1 0.015348016 0.015348016 0.030696032 0.000000000
dxz 1 0.003485835 0.003485835 0.006971671 0.000000000
dyz 1 0.003485545 0.003485545 0.006971091 0.000000000
sum over m 0.021300051 0.021300051 0.042600102 0.000000000
sum over m+mul 1.207060974 1.207060974 2.414121947 0.000000000
74 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000799076 1.000799076 2.001598152 0.000000000
sum over m 1.000799076 1.000799076 2.001598152 0.000000000
s 1 0.207385090 0.207385090 0.414770180 0.000000000
sum over m 0.207385090 0.207385090 0.414770180 0.000000000
s 2 0.014717895 0.014717895 0.029435790 0.000000000
sum over m 0.014717895 0.014717895 0.029435790 0.000000000
sum over m+mul 1.222902061 1.222902061 2.445804122 0.000000000
px 0 1.006391330 1.006391330 2.012782660 0.000000000
py 0 1.006390549 1.006390549 2.012781099 0.000000000
pz 0 1.006204320 1.006204320 2.012408639 0.000000000
sum over m 3.018986199 3.018986199 6.037972398 0.000000000
px 1 0.065451380 0.065451380 0.130902760 0.000000000
py 1 0.065449797 0.065449797 0.130899594 0.000000000
pz 1 0.040353481 0.040353481 0.080706963 0.000000000
sum over m 0.171254658 0.171254658 0.342509317 0.000000000
sum over m+mul 3.190240857 3.190240857 6.380481715 0.000000000
d3z^2-r^2 0 0.196317011 0.196317011 0.392634022 0.000000000
dx^2-y^2 0 0.201551363 0.201551363 0.403102726 0.000000000
dxy 0 0.250916975 0.250916975 0.501833951 0.000000000
dxz 0 0.268486420 0.268486420 0.536972840 0.000000000
dyz 0 0.268489531 0.268489531 0.536979063 0.000000000
sum over m 1.185761301 1.185761301 2.371522601 0.000000000
d3z^2-r^2 1 0.003469509 0.003469509 0.006939018 0.000000000
dx^2-y^2 1 -0.004486723 -0.004486723 -0.008973445 0.000000000
dxy 1 0.015348878 0.015348878 0.030697755 0.000000000
dxz 1 0.003488438 0.003488438 0.006976875 0.000000000
dyz 1 0.003488409 0.003488409 0.006976818 0.000000000
sum over m 0.021308511 0.021308511 0.042617021 0.000000000
sum over m+mul 1.207069811 1.207069811 2.414139622 0.000000000
75 O Up spin Down spin Sum Diff
multiple
s 0 0.893914047 0.893914047 1.787828094 0.000000000
sum over m 0.893914047 0.893914047 1.787828094 0.000000000
s 1 -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m+mul 0.890873559 0.890873559 1.781747118 0.000000000
px 0 0.787076034 0.787076034 1.574152068 0.000000000
py 0 0.786884071 0.786884071 1.573768142 0.000000000
pz 0 0.779774738 0.779774738 1.559549477 0.000000000
sum over m 2.353734844 2.353734844 4.707469688 0.000000000
px 1 -0.008745347 -0.008745347 -0.017490694 0.000000000
py 1 -0.008736786 -0.008736786 -0.017473571 0.000000000
pz 1 -0.006463925 -0.006463925 -0.012927850 0.000000000
sum over m -0.023946058 -0.023946058 -0.047892115 0.000000000
sum over m+mul 2.329788786 2.329788786 4.659577572 0.000000000
d3z^2-r^2 0 -0.006392667 -0.006392667 -0.012785333 0.000000000
dx^2-y^2 0 -0.005058377 -0.005058377 -0.010116753 0.000000000
dxy 0 -0.005435601 -0.005435601 -0.010871202 0.000000000
dxz 0 -0.006927428 -0.006927428 -0.013854856 0.000000000
dyz 0 -0.006930782 -0.006930782 -0.013861564 0.000000000
sum over m -0.030744854 -0.030744854 -0.061489708 0.000000000
sum over m+mul -0.030744854 -0.030744854 -0.061489708 0.000000000
76 O Up spin Down spin Sum Diff
multiple
s 0 0.893913386 0.893913386 1.787826773 0.000000000
sum over m 0.893913386 0.893913386 1.787826773 0.000000000
s 1 -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m+mul 0.890871876 0.890871876 1.781743752 0.000000000
px 0 0.786936799 0.786936799 1.573873599 0.000000000
py 0 0.787082983 0.787082983 1.574165965 0.000000000
pz 0 0.779721609 0.779721609 1.559443219 0.000000000
sum over m 2.353741391 2.353741391 4.707482782 0.000000000
px 1 -0.008738465 -0.008738465 -0.017476931 0.000000000
py 1 -0.008740597 -0.008740597 -0.017481195 0.000000000
pz 1 -0.006462880 -0.006462880 -0.012925760 0.000000000
sum over m -0.023941942 -0.023941942 -0.047883885 0.000000000
sum over m+mul 2.329799449 2.329799449 4.659598898 0.000000000
d3z^2-r^2 0 -0.006391999 -0.006391999 -0.012783997 0.000000000
dx^2-y^2 0 -0.005055370 -0.005055370 -0.010110741 0.000000000
dxy 0 -0.005435327 -0.005435327 -0.010870653 0.000000000
dxz 0 -0.006927532 -0.006927532 -0.013855065 0.000000000
dyz 0 -0.006925668 -0.006925668 -0.013851335 0.000000000
sum over m -0.030735896 -0.030735896 -0.061471791 0.000000000
sum over m+mul -0.030735896 -0.030735896 -0.061471791 0.000000000
77 O Up spin Down spin Sum Diff
multiple
s 0 0.893919403 0.893919403 1.787838806 0.000000000
sum over m 0.893919403 0.893919403 1.787838806 0.000000000
s 1 -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m+mul 0.890878531 0.890878531 1.781757063 0.000000000
px 0 0.786951810 0.786951810 1.573903620 0.000000000
py 0 0.787043897 0.787043897 1.574087794 0.000000000
pz 0 0.779741405 0.779741405 1.559482809 0.000000000
sum over m 2.353737112 2.353737112 4.707474223 0.000000000
px 1 -0.008739215 -0.008739215 -0.017478430 0.000000000
py 1 -0.008740843 -0.008740843 -0.017481686 0.000000000
pz 1 -0.006464071 -0.006464071 -0.012928141 0.000000000
sum over m -0.023944129 -0.023944129 -0.047888257 0.000000000
sum over m+mul 2.329792983 2.329792983 4.659585966 0.000000000
d3z^2-r^2 0 -0.006392789 -0.006392789 -0.012785577 0.000000000
dx^2-y^2 0 -0.005056673 -0.005056673 -0.010113346 0.000000000
dxy 0 -0.005435497 -0.005435497 -0.010870994 0.000000000
dxz 0 -0.006928318 -0.006928318 -0.013856635 0.000000000
dyz 0 -0.006926750 -0.006926750 -0.013853500 0.000000000
sum over m -0.030740026 -0.030740026 -0.061480053 0.000000000
sum over m+mul -0.030740026 -0.030740026 -0.061480053 0.000000000
78 O Up spin Down spin Sum Diff
multiple
s 0 0.893869394 0.893869394 1.787738788 0.000000000
sum over m 0.893869394 0.893869394 1.787738788 0.000000000
s 1 -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m+mul 0.890828733 0.890828733 1.781657466 0.000000000
px 0 0.786946663 0.786946663 1.573893326 0.000000000
py 0 0.786883501 0.786883501 1.573767003 0.000000000
pz 0 0.779866122 0.779866122 1.559732244 0.000000000
sum over m 2.353696286 2.353696286 4.707392573 0.000000000
px 1 -0.008736912 -0.008736912 -0.017473824 0.000000000
py 1 -0.008730798 -0.008730798 -0.017461596 0.000000000
pz 1 -0.006468956 -0.006468956 -0.012937912 0.000000000
sum over m -0.023936666 -0.023936666 -0.047873332 0.000000000
sum over m+mul 2.329759620 2.329759620 4.659519241 0.000000000
d3z^2-r^2 0 -0.006391283 -0.006391283 -0.012782565 0.000000000
dx^2-y^2 0 -0.005060925 -0.005060925 -0.010121850 0.000000000
dxy 0 -0.005434026 -0.005434026 -0.010868052 0.000000000
dxz 0 -0.006932730 -0.006932730 -0.013865459 0.000000000
dyz 0 -0.006933987 -0.006933987 -0.013867973 0.000000000
sum over m -0.030752950 -0.030752950 -0.061505900 0.000000000
sum over m+mul -0.030752950 -0.030752950 -0.061505900 0.000000000
79 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798134 1.000798134 2.001596268 0.000000000
sum over m 1.000798134 1.000798134 2.001596268 0.000000000
s 1 0.207380313 0.207380313 0.414760625 0.000000000
sum over m 0.207380313 0.207380313 0.414760625 0.000000000
s 2 0.014717122 0.014717122 0.029434244 0.000000000
sum over m 0.014717122 0.014717122 0.029434244 0.000000000
sum over m+mul 1.222895569 1.222895569 2.445791137 0.000000000
px 0 1.006395472 1.006395472 2.012790943 0.000000000
py 0 1.006399840 1.006399840 2.012799680 0.000000000
pz 0 1.006210919 1.006210919 2.012421838 0.000000000
sum over m 3.019006230 3.019006230 6.038012461 0.000000000
px 1 0.065458011 0.065458011 0.130916022 0.000000000
py 1 0.065452116 0.065452116 0.130904233 0.000000000
pz 1 0.040344786 0.040344786 0.080689573 0.000000000
sum over m 0.171254914 0.171254914 0.342509827 0.000000000
sum over m+mul 3.190261144 3.190261144 6.380522288 0.000000000
d3z^2-r^2 0 0.196308817 0.196308817 0.392617635 0.000000000
dx^2-y^2 0 0.201552617 0.201552617 0.403105235 0.000000000
dxy 0 0.250913136 0.250913136 0.501826272 0.000000000
dxz 0 0.268494472 0.268494472 0.536988945 0.000000000
dyz 0 0.268491880 0.268491880 0.536983760 0.000000000
sum over m 1.185760923 1.185760923 2.371521845 0.000000000
d3z^2-r^2 1 0.003468385 0.003468385 0.006936771 0.000000000
dx^2-y^2 1 -0.004487731 -0.004487731 -0.008975462 0.000000000
dxy 1 0.015348016 0.015348016 0.030696032 0.000000000
dxz 1 0.003485835 0.003485835 0.006971671 0.000000000
dyz 1 0.003485545 0.003485545 0.006971091 0.000000000
sum over m 0.021300051 0.021300051 0.042600102 0.000000000
sum over m+mul 1.207060974 1.207060974 2.414121947 0.000000000
80 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000799076 1.000799076 2.001598152 0.000000000
sum over m 1.000799076 1.000799076 2.001598152 0.000000000
s 1 0.207385090 0.207385090 0.414770180 0.000000000
sum over m 0.207385090 0.207385090 0.414770180 0.000000000
s 2 0.014717895 0.014717895 0.029435790 0.000000000
sum over m 0.014717895 0.014717895 0.029435790 0.000000000
sum over m+mul 1.222902061 1.222902061 2.445804122 0.000000000
px 0 1.006391330 1.006391330 2.012782660 0.000000000
py 0 1.006390549 1.006390549 2.012781099 0.000000000
pz 0 1.006204320 1.006204320 2.012408639 0.000000000
sum over m 3.018986199 3.018986199 6.037972398 0.000000000
px 1 0.065451380 0.065451380 0.130902760 0.000000000
py 1 0.065449797 0.065449797 0.130899594 0.000000000
pz 1 0.040353482 0.040353482 0.080706963 0.000000000
sum over m 0.171254659 0.171254659 0.342509317 0.000000000
sum over m+mul 3.190240858 3.190240858 6.380481715 0.000000000
d3z^2-r^2 0 0.196317011 0.196317011 0.392634022 0.000000000
dx^2-y^2 0 0.201551363 0.201551363 0.403102726 0.000000000
dxy 0 0.250916975 0.250916975 0.501833951 0.000000000
dxz 0 0.268486420 0.268486420 0.536972840 0.000000000
dyz 0 0.268489531 0.268489531 0.536979062 0.000000000
sum over m 1.185761300 1.185761300 2.371522600 0.000000000
d3z^2-r^2 1 0.003469509 0.003469509 0.006939018 0.000000000
dx^2-y^2 1 -0.004486723 -0.004486723 -0.008973445 0.000000000
dxy 1 0.015348878 0.015348878 0.030697755 0.000000000
dxz 1 0.003488438 0.003488438 0.006976875 0.000000000
dyz 1 0.003488409 0.003488409 0.006976818 0.000000000
sum over m 0.021308511 0.021308511 0.042617021 0.000000000
sum over m+mul 1.207069811 1.207069811 2.414139621 0.000000000
81 O Up spin Down spin Sum Diff
multiple
s 0 0.893914047 0.893914047 1.787828094 0.000000000
sum over m 0.893914047 0.893914047 1.787828094 0.000000000
s 1 -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m+mul 0.890873559 0.890873559 1.781747118 0.000000000
px 0 0.787076034 0.787076034 1.574152068 0.000000000
py 0 0.786884071 0.786884071 1.573768143 0.000000000
pz 0 0.779774739 0.779774739 1.559549477 0.000000000
sum over m 2.353734844 2.353734844 4.707469688 0.000000000
px 1 -0.008745347 -0.008745347 -0.017490694 0.000000000
py 1 -0.008736786 -0.008736786 -0.017473571 0.000000000
pz 1 -0.006463925 -0.006463925 -0.012927850 0.000000000
sum over m -0.023946058 -0.023946058 -0.047892115 0.000000000
sum over m+mul 2.329788786 2.329788786 4.659577573 0.000000000
d3z^2-r^2 0 -0.006392667 -0.006392667 -0.012785333 0.000000000
dx^2-y^2 0 -0.005058377 -0.005058377 -0.010116753 0.000000000
dxy 0 -0.005435601 -0.005435601 -0.010871202 0.000000000
dxz 0 -0.006927428 -0.006927428 -0.013854856 0.000000000
dyz 0 -0.006930782 -0.006930782 -0.013861564 0.000000000
sum over m -0.030744854 -0.030744854 -0.061489708 0.000000000
sum over m+mul -0.030744854 -0.030744854 -0.061489708 0.000000000
82 O Up spin Down spin Sum Diff
multiple
s 0 0.893913386 0.893913386 1.787826773 0.000000000
sum over m 0.893913386 0.893913386 1.787826773 0.000000000
s 1 -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m+mul 0.890871876 0.890871876 1.781743752 0.000000000
px 0 0.786936799 0.786936799 1.573873598 0.000000000
py 0 0.787082983 0.787082983 1.574165965 0.000000000
pz 0 0.779721609 0.779721609 1.559443219 0.000000000
sum over m 2.353741391 2.353741391 4.707482782 0.000000000
px 1 -0.008738465 -0.008738465 -0.017476931 0.000000000
py 1 -0.008740597 -0.008740597 -0.017481195 0.000000000
pz 1 -0.006462880 -0.006462880 -0.012925760 0.000000000
sum over m -0.023941942 -0.023941942 -0.047883885 0.000000000
sum over m+mul 2.329799449 2.329799449 4.659598898 0.000000000
d3z^2-r^2 0 -0.006391999 -0.006391999 -0.012783997 0.000000000
dx^2-y^2 0 -0.005055370 -0.005055370 -0.010110741 0.000000000
dxy 0 -0.005435327 -0.005435327 -0.010870653 0.000000000
dxz 0 -0.006927532 -0.006927532 -0.013855065 0.000000000
dyz 0 -0.006925668 -0.006925668 -0.013851335 0.000000000
sum over m -0.030735896 -0.030735896 -0.061471791 0.000000000
sum over m+mul -0.030735896 -0.030735896 -0.061471791 0.000000000
83 O Up spin Down spin Sum Diff
multiple
s 0 0.893919403 0.893919403 1.787838806 0.000000000
sum over m 0.893919403 0.893919403 1.787838806 0.000000000
s 1 -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m+mul 0.890878531 0.890878531 1.781757063 0.000000000
px 0 0.786951810 0.786951810 1.573903620 0.000000000
py 0 0.787043897 0.787043897 1.574087794 0.000000000
pz 0 0.779741405 0.779741405 1.559482809 0.000000000
sum over m 2.353737112 2.353737112 4.707474223 0.000000000
px 1 -0.008739215 -0.008739215 -0.017478430 0.000000000
py 1 -0.008740843 -0.008740843 -0.017481686 0.000000000
pz 1 -0.006464071 -0.006464071 -0.012928141 0.000000000
sum over m -0.023944129 -0.023944129 -0.047888257 0.000000000
sum over m+mul 2.329792983 2.329792983 4.659585966 0.000000000
d3z^2-r^2 0 -0.006392789 -0.006392789 -0.012785577 0.000000000
dx^2-y^2 0 -0.005056673 -0.005056673 -0.010113346 0.000000000
dxy 0 -0.005435497 -0.005435497 -0.010870994 0.000000000
dxz 0 -0.006928318 -0.006928318 -0.013856635 0.000000000
dyz 0 -0.006926750 -0.006926750 -0.013853500 0.000000000
sum over m -0.030740026 -0.030740026 -0.061480053 0.000000000
sum over m+mul -0.030740026 -0.030740026 -0.061480053 0.000000000
84 O Up spin Down spin Sum Diff
multiple
s 0 0.893869394 0.893869394 1.787738788 0.000000000
sum over m 0.893869394 0.893869394 1.787738788 0.000000000
s 1 -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m+mul 0.890828733 0.890828733 1.781657466 0.000000000
px 0 0.786946663 0.786946663 1.573893326 0.000000000
py 0 0.786883502 0.786883502 1.573767003 0.000000000
pz 0 0.779866122 0.779866122 1.559732244 0.000000000
sum over m 2.353696287 2.353696287 4.707392573 0.000000000
px 1 -0.008736912 -0.008736912 -0.017473824 0.000000000
py 1 -0.008730798 -0.008730798 -0.017461596 0.000000000
pz 1 -0.006468956 -0.006468956 -0.012937912 0.000000000
sum over m -0.023936666 -0.023936666 -0.047873332 0.000000000
sum over m+mul 2.329759621 2.329759621 4.659519242 0.000000000
d3z^2-r^2 0 -0.006391283 -0.006391283 -0.012782565 0.000000000
dx^2-y^2 0 -0.005060925 -0.005060925 -0.010121850 0.000000000
dxy 0 -0.005434026 -0.005434026 -0.010868052 0.000000000
dxz 0 -0.006932730 -0.006932730 -0.013865459 0.000000000
dyz 0 -0.006933987 -0.006933987 -0.013867973 0.000000000
sum over m -0.030752950 -0.030752950 -0.061505900 0.000000000
sum over m+mul -0.030752950 -0.030752950 -0.061505900 0.000000000
85 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779759 1.000779759 2.001559517 0.000000000
sum over m 1.000779759 1.000779759 2.001559517 0.000000000
s 1 0.207398342 0.207398342 0.414796684 0.000000000
sum over m 0.207398342 0.207398342 0.414796684 0.000000000
s 2 0.014720594 0.014720594 0.029441188 0.000000000
sum over m 0.014720594 0.014720594 0.029441188 0.000000000
sum over m+mul 1.222898695 1.222898695 2.445797390 0.000000000
px 0 1.006400420 1.006400420 2.012800841 0.000000000
py 0 1.006387973 1.006387973 2.012775946 0.000000000
pz 0 1.006194818 1.006194818 2.012389636 0.000000000
sum over m 3.018983211 3.018983211 6.037966423 0.000000000
px 1 0.065430720 0.065430720 0.130861440 0.000000000
py 1 0.065427753 0.065427753 0.130855505 0.000000000
pz 1 0.040362129 0.040362129 0.080724259 0.000000000
sum over m 0.171220602 0.171220602 0.342441204 0.000000000
sum over m+mul 3.190203813 3.190203813 6.380407627 0.000000000
d3z^2-r^2 0 0.196297199 0.196297199 0.392594399 0.000000000
dx^2-y^2 0 0.201534012 0.201534012 0.403068025 0.000000000
dxy 0 0.250918262 0.250918262 0.501836525 0.000000000
dxz 0 0.268497934 0.268497934 0.536995869 0.000000000
dyz 0 0.268505878 0.268505878 0.537011756 0.000000000
sum over m 1.185753286 1.185753286 2.371506572 0.000000000
d3z^2-r^2 1 0.003469582 0.003469582 0.006939165 0.000000000
dx^2-y^2 1 -0.004482525 -0.004482525 -0.008965050 0.000000000
dxy 1 0.015342841 0.015342841 0.030685682 0.000000000
dxz 1 0.003484969 0.003484969 0.006969937 0.000000000
dyz 1 0.003485057 0.003485057 0.006970114 0.000000000
sum over m 0.021299924 0.021299924 0.042599849 0.000000000
sum over m+mul 1.207053211 1.207053211 2.414106421 0.000000000
86 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000786629 1.000786629 2.001573258 0.000000000
sum over m 1.000786629 1.000786629 2.001573258 0.000000000
s 1 0.207412251 0.207412251 0.414824502 0.000000000
sum over m 0.207412251 0.207412251 0.414824502 0.000000000
s 2 0.014723217 0.014723217 0.029446435 0.000000000
sum over m 0.014723217 0.014723217 0.029446435 0.000000000
sum over m+mul 1.222922097 1.222922097 2.445844194 0.000000000
px 0 1.006379604 1.006379604 2.012759208 0.000000000
py 0 1.006362926 1.006362926 2.012725851 0.000000000
pz 0 1.006207568 1.006207568 2.012415137 0.000000000
sum over m 3.018950098 3.018950098 6.037900196 0.000000000
px 1 0.065424391 0.065424391 0.130848782 0.000000000
py 1 0.065449661 0.065449661 0.130899321 0.000000000
pz 1 0.040363083 0.040363083 0.080726165 0.000000000
sum over m 0.171237134 0.171237134 0.342474269 0.000000000
sum over m+mul 3.190187232 3.190187232 6.380374465 0.000000000
d3z^2-r^2 0 0.196314102 0.196314102 0.392628205 0.000000000
dx^2-y^2 0 0.201515300 0.201515300 0.403030601 0.000000000
dxy 0 0.250946196 0.250946196 0.501892393 0.000000000
dxz 0 0.268479092 0.268479092 0.536958184 0.000000000
dyz 0 0.268502100 0.268502100 0.537004199 0.000000000
sum over m 1.185756791 1.185756791 2.371513581 0.000000000
d3z^2-r^2 1 0.003472794 0.003472794 0.006945587 0.000000000
dx^2-y^2 1 -0.004480490 -0.004480490 -0.008960980 0.000000000
dxy 1 0.015341851 0.015341851 0.030683703 0.000000000
dxz 1 0.003489723 0.003489723 0.006979446 0.000000000
dyz 1 0.003492223 0.003492223 0.006984446 0.000000000
sum over m 0.021316101 0.021316101 0.042632201 0.000000000
sum over m+mul 1.207072891 1.207072891 2.414145783 0.000000000
87 O Up spin Down spin Sum Diff
multiple
s 0 0.893895651 0.893895651 1.787791303 0.000000000
sum over m 0.893895651 0.893895651 1.787791303 0.000000000
s 1 -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m+mul 0.890854063 0.890854063 1.781708126 0.000000000
px 0 0.787109858 0.787109858 1.574219715 0.000000000
py 0 0.786850013 0.786850013 1.573700026 0.000000000
pz 0 0.779796894 0.779796894 1.559593789 0.000000000
sum over m 2.353756765 2.353756765 4.707513530 0.000000000
px 1 -0.008747356 -0.008747356 -0.017494712 0.000000000
py 1 -0.008731747 -0.008731747 -0.017463493 0.000000000
pz 1 -0.006464716 -0.006464716 -0.012929431 0.000000000
sum over m -0.023943818 -0.023943818 -0.047887637 0.000000000
sum over m+mul 2.329812946 2.329812946 4.659625893 0.000000000
d3z^2-r^2 0 -0.006391488 -0.006391488 -0.012782975 0.000000000
dx^2-y^2 0 -0.005058784 -0.005058784 -0.010117568 0.000000000
dxy 0 -0.005434639 -0.005434639 -0.010869278 0.000000000
dxz 0 -0.006927417 -0.006927417 -0.013854833 0.000000000
dyz 0 -0.006933227 -0.006933227 -0.013866455 0.000000000
sum over m -0.030745555 -0.030745555 -0.061491109 0.000000000
sum over m+mul -0.030745555 -0.030745555 -0.061491109 0.000000000
88 O Up spin Down spin Sum Diff
multiple
s 0 0.893891025 0.893891025 1.787782050 0.000000000
sum over m 0.893891025 0.893891025 1.787782050 0.000000000
s 1 -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m+mul 0.890848335 0.890848335 1.781696669 0.000000000
px 0 0.786953979 0.786953979 1.573907958 0.000000000
py 0 0.787044160 0.787044160 1.574088321 0.000000000
pz 0 0.779742007 0.779742007 1.559484014 0.000000000
sum over m 2.353740147 2.353740147 4.707480293 0.000000000
px 1 -0.008738783 -0.008738783 -0.017477566 0.000000000
py 1 -0.008733766 -0.008733766 -0.017467533 0.000000000
pz 1 -0.006460366 -0.006460366 -0.012920731 0.000000000
sum over m -0.023932915 -0.023932915 -0.047865830 0.000000000
sum over m+mul 2.329807231 2.329807231 4.659614463 0.000000000
d3z^2-r^2 0 -0.006389838 -0.006389838 -0.012779676 0.000000000
dx^2-y^2 0 -0.005056265 -0.005056265 -0.010112529 0.000000000
dxy 0 -0.005433964 -0.005433964 -0.010867928 0.000000000
dxz 0 -0.006927405 -0.006927405 -0.013854811 0.000000000
dyz 0 -0.006927781 -0.006927781 -0.013855563 0.000000000
sum over m -0.030735253 -0.030735253 -0.061470507 0.000000000
sum over m+mul -0.030735253 -0.030735253 -0.061470507 0.000000000
89 O Up spin Down spin Sum Diff
multiple
s 0 0.893902429 0.893902429 1.787804857 0.000000000
sum over m 0.893902429 0.893902429 1.787804857 0.000000000
s 1 -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m+mul 0.890860132 0.890860132 1.781720264 0.000000000
px 0 0.786938366 0.786938366 1.573876732 0.000000000
py 0 0.787083683 0.787083683 1.574167366 0.000000000
pz 0 0.779721516 0.779721516 1.559443032 0.000000000
sum over m 2.353743565 2.353743565 4.707487129 0.000000000
px 1 -0.008738389 -0.008738389 -0.017476778 0.000000000
py 1 -0.008739175 -0.008739175 -0.017478349 0.000000000
pz 1 -0.006462094 -0.006462094 -0.012924187 0.000000000
sum over m -0.023939657 -0.023939657 -0.047879315 0.000000000
sum over m+mul 2.329803907 2.329803907 4.659607815 0.000000000
d3z^2-r^2 0 -0.006390665 -0.006390665 -0.012781330 0.000000000
dx^2-y^2 0 -0.005055239 -0.005055239 -0.010110477 0.000000000
dxy 0 -0.005434586 -0.005434586 -0.010869173 0.000000000
dxz 0 -0.006927242 -0.006927242 -0.013854483 0.000000000
dyz 0 -0.006926101 -0.006926101 -0.013852202 0.000000000
sum over m -0.030733833 -0.030733833 -0.061467665 0.000000000
sum over m+mul -0.030733833 -0.030733833 -0.061467665 0.000000000
90 O Up spin Down spin Sum Diff
multiple
s 0 0.893859606 0.893859606 1.787719211 0.000000000
sum over m 0.893859606 0.893859606 1.787719211 0.000000000
s 1 -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m+mul 0.890817400 0.890817400 1.781634799 0.000000000
px 0 0.786920140 0.786920140 1.573840280 0.000000000
py 0 0.786920290 0.786920290 1.573840580 0.000000000
pz 0 0.779851139 0.779851139 1.559702279 0.000000000
sum over m 2.353691569 2.353691569 4.707383138 0.000000000
px 1 -0.008734849 -0.008734849 -0.017469697 0.000000000
py 1 -0.008726755 -0.008726755 -0.017453510 0.000000000
pz 1 -0.006464765 -0.006464765 -0.012929529 0.000000000
sum over m -0.023926368 -0.023926368 -0.047852736 0.000000000
sum over m+mul 2.329765201 2.329765201 4.659530402 0.000000000
d3z^2-r^2 0 -0.006389399 -0.006389399 -0.012778798 0.000000000
dx^2-y^2 0 -0.005060127 -0.005060127 -0.010120254 0.000000000
dxy 0 -0.005433050 -0.005433050 -0.010866099 0.000000000
dxz 0 -0.006931581 -0.006931581 -0.013863162 0.000000000
dyz 0 -0.006932951 -0.006932951 -0.013865902 0.000000000
sum over m -0.030747107 -0.030747107 -0.061494214 0.000000000
sum over m+mul -0.030747107 -0.030747107 -0.061494214 0.000000000
91 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779758 1.000779758 2.001559517 0.000000000
sum over m 1.000779758 1.000779758 2.001559517 0.000000000
s 1 0.207398342 0.207398342 0.414796684 0.000000000
sum over m 0.207398342 0.207398342 0.414796684 0.000000000
s 2 0.014720594 0.014720594 0.029441188 0.000000000
sum over m 0.014720594 0.014720594 0.029441188 0.000000000
sum over m+mul 1.222898695 1.222898695 2.445797389 0.000000000
px 0 1.006400420 1.006400420 2.012800841 0.000000000
py 0 1.006387973 1.006387973 2.012775946 0.000000000
pz 0 1.006194818 1.006194818 2.012389636 0.000000000
sum over m 3.018983212 3.018983212 6.037966423 0.000000000
px 1 0.065430720 0.065430720 0.130861440 0.000000000
py 1 0.065427752 0.065427752 0.130855505 0.000000000
pz 1 0.040362129 0.040362129 0.080724258 0.000000000
sum over m 0.171220601 0.171220601 0.342441203 0.000000000
sum over m+mul 3.190203813 3.190203813 6.380407626 0.000000000
d3z^2-r^2 0 0.196297199 0.196297199 0.392594399 0.000000000
dx^2-y^2 0 0.201534012 0.201534012 0.403068024 0.000000000
dxy 0 0.250918262 0.250918262 0.501836524 0.000000000
dxz 0 0.268497934 0.268497934 0.536995869 0.000000000
dyz 0 0.268505878 0.268505878 0.537011755 0.000000000
sum over m 1.185753286 1.185753286 2.371506571 0.000000000
d3z^2-r^2 1 0.003469582 0.003469582 0.006939165 0.000000000
dx^2-y^2 1 -0.004482525 -0.004482525 -0.008965050 0.000000000
dxy 1 0.015342841 0.015342841 0.030685682 0.000000000
dxz 1 0.003484969 0.003484969 0.006969937 0.000000000
dyz 1 0.003485057 0.003485057 0.006970114 0.000000000
sum over m 0.021299924 0.021299924 0.042599849 0.000000000
sum over m+mul 1.207053210 1.207053210 2.414106420 0.000000000
92 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000786629 1.000786629 2.001573258 0.000000000
sum over m 1.000786629 1.000786629 2.001573258 0.000000000
s 1 0.207412251 0.207412251 0.414824502 0.000000000
sum over m 0.207412251 0.207412251 0.414824502 0.000000000
s 2 0.014723217 0.014723217 0.029446435 0.000000000
sum over m 0.014723217 0.014723217 0.029446435 0.000000000
sum over m+mul 1.222922097 1.222922097 2.445844194 0.000000000
px 0 1.006379604 1.006379604 2.012759208 0.000000000
py 0 1.006362926 1.006362926 2.012725851 0.000000000
pz 0 1.006207568 1.006207568 2.012415137 0.000000000
sum over m 3.018950098 3.018950098 6.037900196 0.000000000
px 1 0.065424391 0.065424391 0.130848782 0.000000000
py 1 0.065449661 0.065449661 0.130899321 0.000000000
pz 1 0.040363083 0.040363083 0.080726166 0.000000000
sum over m 0.171237135 0.171237135 0.342474269 0.000000000
sum over m+mul 3.190187233 3.190187233 6.380374465 0.000000000
d3z^2-r^2 0 0.196314102 0.196314102 0.392628205 0.000000000
dx^2-y^2 0 0.201515300 0.201515300 0.403030601 0.000000000
dxy 0 0.250946196 0.250946196 0.501892392 0.000000000
dxz 0 0.268479092 0.268479092 0.536958184 0.000000000
dyz 0 0.268502099 0.268502099 0.537004199 0.000000000
sum over m 1.185756791 1.185756791 2.371513581 0.000000000
d3z^2-r^2 1 0.003472794 0.003472794 0.006945587 0.000000000
dx^2-y^2 1 -0.004480490 -0.004480490 -0.008960980 0.000000000
dxy 1 0.015341851 0.015341851 0.030683703 0.000000000
dxz 1 0.003489723 0.003489723 0.006979446 0.000000000
dyz 1 0.003492223 0.003492223 0.006984446 0.000000000
sum over m 0.021316101 0.021316101 0.042632201 0.000000000
sum over m+mul 1.207072891 1.207072891 2.414145783 0.000000000
93 O Up spin Down spin Sum Diff
multiple
s 0 0.893895651 0.893895651 1.787791303 0.000000000
sum over m 0.893895651 0.893895651 1.787791303 0.000000000
s 1 -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m+mul 0.890854063 0.890854063 1.781708126 0.000000000
px 0 0.787109858 0.787109858 1.574219716 0.000000000
py 0 0.786850013 0.786850013 1.573700026 0.000000000
pz 0 0.779796895 0.779796895 1.559593789 0.000000000
sum over m 2.353756765 2.353756765 4.707513531 0.000000000
px 1 -0.008747356 -0.008747356 -0.017494713 0.000000000
py 1 -0.008731747 -0.008731747 -0.017463493 0.000000000
pz 1 -0.006464716 -0.006464716 -0.012929431 0.000000000
sum over m -0.023943818 -0.023943818 -0.047887637 0.000000000
sum over m+mul 2.329812947 2.329812947 4.659625894 0.000000000
d3z^2-r^2 0 -0.006391488 -0.006391488 -0.012782975 0.000000000
dx^2-y^2 0 -0.005058784 -0.005058784 -0.010117568 0.000000000
dxy 0 -0.005434639 -0.005434639 -0.010869278 0.000000000
dxz 0 -0.006927417 -0.006927417 -0.013854833 0.000000000
dyz 0 -0.006933227 -0.006933227 -0.013866455 0.000000000
sum over m -0.030745555 -0.030745555 -0.061491109 0.000000000
sum over m+mul -0.030745555 -0.030745555 -0.061491109 0.000000000
94 O Up spin Down spin Sum Diff
multiple
s 0 0.893891025 0.893891025 1.787782050 0.000000000
sum over m 0.893891025 0.893891025 1.787782050 0.000000000
s 1 -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m+mul 0.890848335 0.890848335 1.781696669 0.000000000
px 0 0.786953979 0.786953979 1.573907958 0.000000000
py 0 0.787044160 0.787044160 1.574088320 0.000000000
pz 0 0.779742007 0.779742007 1.559484015 0.000000000
sum over m 2.353740147 2.353740147 4.707480293 0.000000000
px 1 -0.008738783 -0.008738783 -0.017477566 0.000000000
py 1 -0.008733767 -0.008733767 -0.017467533 0.000000000
pz 1 -0.006460366 -0.006460366 -0.012920731 0.000000000
sum over m -0.023932915 -0.023932915 -0.047865830 0.000000000
sum over m+mul 2.329807231 2.329807231 4.659614463 0.000000000
d3z^2-r^2 0 -0.006389838 -0.006389838 -0.012779676 0.000000000
dx^2-y^2 0 -0.005056265 -0.005056265 -0.010112529 0.000000000
dxy 0 -0.005433964 -0.005433964 -0.010867928 0.000000000
dxz 0 -0.006927405 -0.006927405 -0.013854811 0.000000000
dyz 0 -0.006927781 -0.006927781 -0.013855563 0.000000000
sum over m -0.030735253 -0.030735253 -0.061470507 0.000000000
sum over m+mul -0.030735253 -0.030735253 -0.061470507 0.000000000
95 O Up spin Down spin Sum Diff
multiple
s 0 0.893902429 0.893902429 1.787804858 0.000000000
sum over m 0.893902429 0.893902429 1.787804858 0.000000000
s 1 -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m+mul 0.890860132 0.890860132 1.781720264 0.000000000
px 0 0.786938366 0.786938366 1.573876732 0.000000000
py 0 0.787083683 0.787083683 1.574167366 0.000000000
pz 0 0.779721516 0.779721516 1.559443032 0.000000000
sum over m 2.353743565 2.353743565 4.707487130 0.000000000
px 1 -0.008738389 -0.008738389 -0.017476778 0.000000000
py 1 -0.008739175 -0.008739175 -0.017478349 0.000000000
pz 1 -0.006462093 -0.006462093 -0.012924187 0.000000000
sum over m -0.023939657 -0.023939657 -0.047879314 0.000000000
sum over m+mul 2.329803908 2.329803908 4.659607816 0.000000000
d3z^2-r^2 0 -0.006390665 -0.006390665 -0.012781330 0.000000000
dx^2-y^2 0 -0.005055239 -0.005055239 -0.010110477 0.000000000
dxy 0 -0.005434586 -0.005434586 -0.010869173 0.000000000
dxz 0 -0.006927242 -0.006927242 -0.013854483 0.000000000
dyz 0 -0.006926101 -0.006926101 -0.013852202 0.000000000
sum over m -0.030733833 -0.030733833 -0.061467665 0.000000000
sum over m+mul -0.030733833 -0.030733833 -0.061467665 0.000000000
96 O Up spin Down spin Sum Diff
multiple
s 0 0.893859606 0.893859606 1.787719211 0.000000000
sum over m 0.893859606 0.893859606 1.787719211 0.000000000
s 1 -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m+mul 0.890817400 0.890817400 1.781634799 0.000000000
px 0 0.786920140 0.786920140 1.573840280 0.000000000
py 0 0.786920290 0.786920290 1.573840580 0.000000000
pz 0 0.779851139 0.779851139 1.559702279 0.000000000
sum over m 2.353691569 2.353691569 4.707383139 0.000000000
px 1 -0.008734849 -0.008734849 -0.017469697 0.000000000
py 1 -0.008726755 -0.008726755 -0.017453510 0.000000000
pz 1 -0.006464765 -0.006464765 -0.012929529 0.000000000
sum over m -0.023926368 -0.023926368 -0.047852736 0.000000000
sum over m+mul 2.329765201 2.329765201 4.659530403 0.000000000
d3z^2-r^2 0 -0.006389399 -0.006389399 -0.012778798 0.000000000
dx^2-y^2 0 -0.005060127 -0.005060127 -0.010120254 0.000000000
dxy 0 -0.005433050 -0.005433050 -0.010866099 0.000000000
dxz 0 -0.006931581 -0.006931581 -0.013863162 0.000000000
dyz 0 -0.006932951 -0.006932951 -0.013865902 0.000000000
sum over m -0.030747107 -0.030747107 -0.061494214 0.000000000
sum over m+mul -0.030747107 -0.030747107 -0.061494214 0.000000000
97 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779758 1.000779758 2.001559517 0.000000000
sum over m 1.000779758 1.000779758 2.001559517 0.000000000
s 1 0.207398342 0.207398342 0.414796685 0.000000000
sum over m 0.207398342 0.207398342 0.414796685 0.000000000
s 2 0.014720594 0.014720594 0.029441188 0.000000000
sum over m 0.014720594 0.014720594 0.029441188 0.000000000
sum over m+mul 1.222898695 1.222898695 2.445797389 0.000000000
px 0 1.006400420 1.006400420 2.012800841 0.000000000
py 0 1.006387973 1.006387973 2.012775946 0.000000000
pz 0 1.006194818 1.006194818 2.012389636 0.000000000
sum over m 3.018983211 3.018983211 6.037966423 0.000000000
px 1 0.065430720 0.065430720 0.130861440 0.000000000
py 1 0.065427753 0.065427753 0.130855505 0.000000000
pz 1 0.040362129 0.040362129 0.080724259 0.000000000
sum over m 0.171220602 0.171220602 0.342441204 0.000000000
sum over m+mul 3.190203813 3.190203813 6.380407627 0.000000000
d3z^2-r^2 0 0.196297199 0.196297199 0.392594399 0.000000000
dx^2-y^2 0 0.201534013 0.201534013 0.403068025 0.000000000
dxy 0 0.250918262 0.250918262 0.501836525 0.000000000
dxz 0 0.268497934 0.268497934 0.536995869 0.000000000
dyz 0 0.268505878 0.268505878 0.537011756 0.000000000
sum over m 1.185753286 1.185753286 2.371506573 0.000000000
d3z^2-r^2 1 0.003469582 0.003469582 0.006939165 0.000000000
dx^2-y^2 1 -0.004482525 -0.004482525 -0.008965050 0.000000000
dxy 1 0.015342841 0.015342841 0.030685682 0.000000000
dxz 1 0.003484969 0.003484969 0.006969937 0.000000000
dyz 1 0.003485057 0.003485057 0.006970114 0.000000000
sum over m 0.021299924 0.021299924 0.042599849 0.000000000
sum over m+mul 1.207053211 1.207053211 2.414106422 0.000000000
98 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000786629 1.000786629 2.001573258 0.000000000
sum over m 1.000786629 1.000786629 2.001573258 0.000000000
s 1 0.207412251 0.207412251 0.414824502 0.000000000
sum over m 0.207412251 0.207412251 0.414824502 0.000000000
s 2 0.014723217 0.014723217 0.029446435 0.000000000
sum over m 0.014723217 0.014723217 0.029446435 0.000000000
sum over m+mul 1.222922097 1.222922097 2.445844195 0.000000000
px 0 1.006379604 1.006379604 2.012759208 0.000000000
py 0 1.006362926 1.006362926 2.012725851 0.000000000
pz 0 1.006207568 1.006207568 2.012415137 0.000000000
sum over m 3.018950098 3.018950098 6.037900196 0.000000000
px 1 0.065424391 0.065424391 0.130848782 0.000000000
py 1 0.065449661 0.065449661 0.130899321 0.000000000
pz 1 0.040363083 0.040363083 0.080726166 0.000000000
sum over m 0.171237134 0.171237134 0.342474269 0.000000000
sum over m+mul 3.190187232 3.190187232 6.380374465 0.000000000
d3z^2-r^2 0 0.196314103 0.196314103 0.392628205 0.000000000
dx^2-y^2 0 0.201515300 0.201515300 0.403030600 0.000000000
dxy 0 0.250946196 0.250946196 0.501892393 0.000000000
dxz 0 0.268479092 0.268479092 0.536958185 0.000000000
dyz 0 0.268502100 0.268502100 0.537004199 0.000000000
sum over m 1.185756791 1.185756791 2.371513582 0.000000000
d3z^2-r^2 1 0.003472794 0.003472794 0.006945587 0.000000000
dx^2-y^2 1 -0.004480490 -0.004480490 -0.008960980 0.000000000
dxy 1 0.015341851 0.015341851 0.030683703 0.000000000
dxz 1 0.003489723 0.003489723 0.006979446 0.000000000
dyz 1 0.003492223 0.003492223 0.006984446 0.000000000
sum over m 0.021316101 0.021316101 0.042632201 0.000000000
sum over m+mul 1.207072892 1.207072892 2.414145783 0.000000000
99 O Up spin Down spin Sum Diff
multiple
s 0 0.893895651 0.893895651 1.787791303 0.000000000
sum over m 0.893895651 0.893895651 1.787791303 0.000000000
s 1 -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m+mul 0.890854063 0.890854063 1.781708126 0.000000000
px 0 0.787109858 0.787109858 1.574219715 0.000000000
py 0 0.786850013 0.786850013 1.573700026 0.000000000
pz 0 0.779796894 0.779796894 1.559593789 0.000000000
sum over m 2.353756765 2.353756765 4.707513530 0.000000000
px 1 -0.008747356 -0.008747356 -0.017494713 0.000000000
py 1 -0.008731747 -0.008731747 -0.017463493 0.000000000
pz 1 -0.006464716 -0.006464716 -0.012929431 0.000000000
sum over m -0.023943818 -0.023943818 -0.047887637 0.000000000
sum over m+mul 2.329812947 2.329812947 4.659625894 0.000000000
d3z^2-r^2 0 -0.006391488 -0.006391488 -0.012782975 0.000000000
dx^2-y^2 0 -0.005058784 -0.005058784 -0.010117568 0.000000000
dxy 0 -0.005434639 -0.005434639 -0.010869278 0.000000000
dxz 0 -0.006927417 -0.006927417 -0.013854833 0.000000000
dyz 0 -0.006933227 -0.006933227 -0.013866455 0.000000000
sum over m -0.030745555 -0.030745555 -0.061491109 0.000000000
sum over m+mul -0.030745555 -0.030745555 -0.061491109 0.000000000
100 O Up spin Down spin Sum Diff
multiple
s 0 0.893891025 0.893891025 1.787782050 0.000000000
sum over m 0.893891025 0.893891025 1.787782050 0.000000000
s 1 -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m+mul 0.890848335 0.890848335 1.781696669 0.000000000
px 0 0.786953979 0.786953979 1.573907958 0.000000000
py 0 0.787044161 0.787044161 1.574088321 0.000000000
pz 0 0.779742007 0.779742007 1.559484015 0.000000000
sum over m 2.353740147 2.353740147 4.707480294 0.000000000
px 1 -0.008738783 -0.008738783 -0.017477566 0.000000000
py 1 -0.008733767 -0.008733767 -0.017467533 0.000000000
pz 1 -0.006460366 -0.006460366 -0.012920731 0.000000000
sum over m -0.023932915 -0.023932915 -0.047865830 0.000000000
sum over m+mul 2.329807232 2.329807232 4.659614463 0.000000000
d3z^2-r^2 0 -0.006389838 -0.006389838 -0.012779676 0.000000000
dx^2-y^2 0 -0.005056265 -0.005056265 -0.010112529 0.000000000
dxy 0 -0.005433964 -0.005433964 -0.010867928 0.000000000
dxz 0 -0.006927405 -0.006927405 -0.013854811 0.000000000
dyz 0 -0.006927781 -0.006927781 -0.013855563 0.000000000
sum over m -0.030735253 -0.030735253 -0.061470507 0.000000000
sum over m+mul -0.030735253 -0.030735253 -0.061470507 0.000000000
101 O Up spin Down spin Sum Diff
multiple
s 0 0.893902429 0.893902429 1.787804857 0.000000000
sum over m 0.893902429 0.893902429 1.787804857 0.000000000
s 1 -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m+mul 0.890860132 0.890860132 1.781720264 0.000000000
px 0 0.786938366 0.786938366 1.573876732 0.000000000
py 0 0.787083683 0.787083683 1.574167366 0.000000000
pz 0 0.779721516 0.779721516 1.559443033 0.000000000
sum over m 2.353743566 2.353743566 4.707487131 0.000000000
px 1 -0.008738389 -0.008738389 -0.017476778 0.000000000
py 1 -0.008739175 -0.008739175 -0.017478349 0.000000000
pz 1 -0.006462094 -0.006462094 -0.012924187 0.000000000
sum over m -0.023939657 -0.023939657 -0.047879314 0.000000000
sum over m+mul 2.329803908 2.329803908 4.659607817 0.000000000
d3z^2-r^2 0 -0.006390665 -0.006390665 -0.012781330 0.000000000
dx^2-y^2 0 -0.005055239 -0.005055239 -0.010110477 0.000000000
dxy 0 -0.005434586 -0.005434586 -0.010869173 0.000000000
dxz 0 -0.006927242 -0.006927242 -0.013854483 0.000000000
dyz 0 -0.006926101 -0.006926101 -0.013852202 0.000000000
sum over m -0.030733833 -0.030733833 -0.061467665 0.000000000
sum over m+mul -0.030733833 -0.030733833 -0.061467665 0.000000000
102 O Up spin Down spin Sum Diff
multiple
s 0 0.893859606 0.893859606 1.787719211 0.000000000
sum over m 0.893859606 0.893859606 1.787719211 0.000000000
s 1 -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m+mul 0.890817400 0.890817400 1.781634799 0.000000000
px 0 0.786920140 0.786920140 1.573840280 0.000000000
py 0 0.786920290 0.786920290 1.573840580 0.000000000
pz 0 0.779851139 0.779851139 1.559702279 0.000000000
sum over m 2.353691570 2.353691570 4.707383139 0.000000000
px 1 -0.008734849 -0.008734849 -0.017469697 0.000000000
py 1 -0.008726755 -0.008726755 -0.017453510 0.000000000
pz 1 -0.006464765 -0.006464765 -0.012929529 0.000000000
sum over m -0.023926368 -0.023926368 -0.047852736 0.000000000
sum over m+mul 2.329765201 2.329765201 4.659530403 0.000000000
d3z^2-r^2 0 -0.006389399 -0.006389399 -0.012778798 0.000000000
dx^2-y^2 0 -0.005060127 -0.005060127 -0.010120254 0.000000000
dxy 0 -0.005433050 -0.005433050 -0.010866099 0.000000000
dxz 0 -0.006931581 -0.006931581 -0.013863162 0.000000000
dyz 0 -0.006932951 -0.006932951 -0.013865902 0.000000000
sum over m -0.030747107 -0.030747107 -0.061494214 0.000000000
sum over m+mul -0.030747107 -0.030747107 -0.061494214 0.000000000
103 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779758 1.000779758 2.001559517 0.000000000
sum over m 1.000779758 1.000779758 2.001559517 0.000000000
s 1 0.207398342 0.207398342 0.414796684 0.000000000
sum over m 0.207398342 0.207398342 0.414796684 0.000000000
s 2 0.014720594 0.014720594 0.029441188 0.000000000
sum over m 0.014720594 0.014720594 0.029441188 0.000000000
sum over m+mul 1.222898695 1.222898695 2.445797389 0.000000000
px 0 1.006400421 1.006400421 2.012800841 0.000000000
py 0 1.006387973 1.006387973 2.012775946 0.000000000
pz 0 1.006194818 1.006194818 2.012389636 0.000000000
sum over m 3.018983211 3.018983211 6.037966423 0.000000000
px 1 0.065430720 0.065430720 0.130861440 0.000000000
py 1 0.065427753 0.065427753 0.130855505 0.000000000
pz 1 0.040362129 0.040362129 0.080724259 0.000000000
sum over m 0.171220602 0.171220602 0.342441204 0.000000000
sum over m+mul 3.190203813 3.190203813 6.380407627 0.000000000
d3z^2-r^2 0 0.196297199 0.196297199 0.392594399 0.000000000
dx^2-y^2 0 0.201534012 0.201534012 0.403068025 0.000000000
dxy 0 0.250918262 0.250918262 0.501836525 0.000000000
dxz 0 0.268497934 0.268497934 0.536995869 0.000000000
dyz 0 0.268505878 0.268505878 0.537011756 0.000000000
sum over m 1.185753286 1.185753286 2.371506573 0.000000000
d3z^2-r^2 1 0.003469582 0.003469582 0.006939165 0.000000000
dx^2-y^2 1 -0.004482525 -0.004482525 -0.008965050 0.000000000
dxy 1 0.015342841 0.015342841 0.030685682 0.000000000
dxz 1 0.003484969 0.003484969 0.006969937 0.000000000
dyz 1 0.003485057 0.003485057 0.006970114 0.000000000
sum over m 0.021299924 0.021299924 0.042599849 0.000000000
sum over m+mul 1.207053211 1.207053211 2.414106421 0.000000000
104 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000786629 1.000786629 2.001573258 0.000000000
sum over m 1.000786629 1.000786629 2.001573258 0.000000000
s 1 0.207412251 0.207412251 0.414824501 0.000000000
sum over m 0.207412251 0.207412251 0.414824501 0.000000000
s 2 0.014723217 0.014723217 0.029446434 0.000000000
sum over m 0.014723217 0.014723217 0.029446434 0.000000000
sum over m+mul 1.222922097 1.222922097 2.445844194 0.000000000
px 0 1.006379604 1.006379604 2.012759208 0.000000000
py 0 1.006362926 1.006362926 2.012725851 0.000000000
pz 0 1.006207568 1.006207568 2.012415137 0.000000000
sum over m 3.018950098 3.018950098 6.037900196 0.000000000
px 1 0.065424391 0.065424391 0.130848782 0.000000000
py 1 0.065449661 0.065449661 0.130899321 0.000000000
pz 1 0.040363083 0.040363083 0.080726166 0.000000000
sum over m 0.171237135 0.171237135 0.342474269 0.000000000
sum over m+mul 3.190187232 3.190187232 6.380374465 0.000000000
d3z^2-r^2 0 0.196314103 0.196314103 0.392628205 0.000000000
dx^2-y^2 0 0.201515300 0.201515300 0.403030601 0.000000000
dxy 0 0.250946196 0.250946196 0.501892393 0.000000000
dxz 0 0.268479092 0.268479092 0.536958185 0.000000000
dyz 0 0.268502099 0.268502099 0.537004199 0.000000000
sum over m 1.185756791 1.185756791 2.371513582 0.000000000
d3z^2-r^2 1 0.003472794 0.003472794 0.006945587 0.000000000
dx^2-y^2 1 -0.004480490 -0.004480490 -0.008960980 0.000000000
dxy 1 0.015341851 0.015341851 0.030683703 0.000000000
dxz 1 0.003489723 0.003489723 0.006979446 0.000000000
dyz 1 0.003492223 0.003492223 0.006984446 0.000000000
sum over m 0.021316101 0.021316101 0.042632202 0.000000000
sum over m+mul 1.207072892 1.207072892 2.414145784 0.000000000
105 O Up spin Down spin Sum Diff
multiple
s 0 0.893895651 0.893895651 1.787791303 0.000000000
sum over m 0.893895651 0.893895651 1.787791303 0.000000000
s 1 -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m+mul 0.890854063 0.890854063 1.781708126 0.000000000
px 0 0.787109858 0.787109858 1.574219715 0.000000000
py 0 0.786850013 0.786850013 1.573700026 0.000000000
pz 0 0.779796894 0.779796894 1.559593789 0.000000000
sum over m 2.353756765 2.353756765 4.707513530 0.000000000
px 1 -0.008747356 -0.008747356 -0.017494713 0.000000000
py 1 -0.008731747 -0.008731747 -0.017463493 0.000000000
pz 1 -0.006464716 -0.006464716 -0.012929431 0.000000000
sum over m -0.023943818 -0.023943818 -0.047887637 0.000000000
sum over m+mul 2.329812947 2.329812947 4.659625893 0.000000000
d3z^2-r^2 0 -0.006391488 -0.006391488 -0.012782975 0.000000000
dx^2-y^2 0 -0.005058784 -0.005058784 -0.010117568 0.000000000
dxy 0 -0.005434639 -0.005434639 -0.010869278 0.000000000
dxz 0 -0.006927417 -0.006927417 -0.013854833 0.000000000
dyz 0 -0.006933227 -0.006933227 -0.013866455 0.000000000
sum over m -0.030745555 -0.030745555 -0.061491109 0.000000000
sum over m+mul -0.030745555 -0.030745555 -0.061491109 0.000000000
106 O Up spin Down spin Sum Diff
multiple
s 0 0.893891025 0.893891025 1.787782050 0.000000000
sum over m 0.893891025 0.893891025 1.787782050 0.000000000
s 1 -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m+mul 0.890848335 0.890848335 1.781696669 0.000000000
px 0 0.786953979 0.786953979 1.573907958 0.000000000
py 0 0.787044160 0.787044160 1.574088321 0.000000000
pz 0 0.779742007 0.779742007 1.559484015 0.000000000
sum over m 2.353740147 2.353740147 4.707480294 0.000000000
px 1 -0.008738783 -0.008738783 -0.017477566 0.000000000
py 1 -0.008733767 -0.008733767 -0.017467533 0.000000000
pz 1 -0.006460366 -0.006460366 -0.012920731 0.000000000
sum over m -0.023932915 -0.023932915 -0.047865830 0.000000000
sum over m+mul 2.329807232 2.329807232 4.659614463 0.000000000
d3z^2-r^2 0 -0.006389838 -0.006389838 -0.012779676 0.000000000
dx^2-y^2 0 -0.005056265 -0.005056265 -0.010112529 0.000000000
dxy 0 -0.005433964 -0.005433964 -0.010867928 0.000000000
dxz 0 -0.006927405 -0.006927405 -0.013854811 0.000000000
dyz 0 -0.006927781 -0.006927781 -0.013855563 0.000000000
sum over m -0.030735253 -0.030735253 -0.061470507 0.000000000
sum over m+mul -0.030735253 -0.030735253 -0.061470507 0.000000000
107 O Up spin Down spin Sum Diff
multiple
s 0 0.893902429 0.893902429 1.787804857 0.000000000
sum over m 0.893902429 0.893902429 1.787804857 0.000000000
s 1 -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m+mul 0.890860132 0.890860132 1.781720264 0.000000000
px 0 0.786938366 0.786938366 1.573876731 0.000000000
py 0 0.787083683 0.787083683 1.574167366 0.000000000
pz 0 0.779721516 0.779721516 1.559443032 0.000000000
sum over m 2.353743565 2.353743565 4.707487130 0.000000000
px 1 -0.008738389 -0.008738389 -0.017476778 0.000000000
py 1 -0.008739175 -0.008739175 -0.017478349 0.000000000
pz 1 -0.006462094 -0.006462094 -0.012924187 0.000000000
sum over m -0.023939657 -0.023939657 -0.047879315 0.000000000
sum over m+mul 2.329803908 2.329803908 4.659607815 0.000000000
d3z^2-r^2 0 -0.006390665 -0.006390665 -0.012781330 0.000000000
dx^2-y^2 0 -0.005055239 -0.005055239 -0.010110477 0.000000000
dxy 0 -0.005434586 -0.005434586 -0.010869173 0.000000000
dxz 0 -0.006927242 -0.006927242 -0.013854483 0.000000000
dyz 0 -0.006926101 -0.006926101 -0.013852202 0.000000000
sum over m -0.030733833 -0.030733833 -0.061467665 0.000000000
sum over m+mul -0.030733833 -0.030733833 -0.061467665 0.000000000
108 O Up spin Down spin Sum Diff
multiple
s 0 0.893859606 0.893859606 1.787719211 0.000000000
sum over m 0.893859606 0.893859606 1.787719211 0.000000000
s 1 -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m+mul 0.890817400 0.890817400 1.781634799 0.000000000
px 0 0.786920140 0.786920140 1.573840280 0.000000000
py 0 0.786920290 0.786920290 1.573840580 0.000000000
pz 0 0.779851139 0.779851139 1.559702279 0.000000000
sum over m 2.353691569 2.353691569 4.707383139 0.000000000
px 1 -0.008734849 -0.008734849 -0.017469697 0.000000000
py 1 -0.008726755 -0.008726755 -0.017453510 0.000000000
pz 1 -0.006464765 -0.006464765 -0.012929529 0.000000000
sum over m -0.023926368 -0.023926368 -0.047852736 0.000000000
sum over m+mul 2.329765201 2.329765201 4.659530402 0.000000000
d3z^2-r^2 0 -0.006389399 -0.006389399 -0.012778798 0.000000000
dx^2-y^2 0 -0.005060127 -0.005060127 -0.010120254 0.000000000
dxy 0 -0.005433050 -0.005433050 -0.010866099 0.000000000
dxz 0 -0.006931581 -0.006931581 -0.013863162 0.000000000
dyz 0 -0.006932951 -0.006932951 -0.013865902 0.000000000
sum over m -0.030747107 -0.030747107 -0.061494214 0.000000000
sum over m+mul -0.030747107 -0.030747107 -0.061494214 0.000000000
109 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779759 1.000779759 2.001559517 0.000000000
sum over m 1.000779759 1.000779759 2.001559517 0.000000000
s 1 0.207398342 0.207398342 0.414796685 0.000000000
sum over m 0.207398342 0.207398342 0.414796685 0.000000000
s 2 0.014720594 0.014720594 0.029441188 0.000000000
sum over m 0.014720594 0.014720594 0.029441188 0.000000000
sum over m+mul 1.222898695 1.222898695 2.445797390 0.000000000
px 0 1.006400421 1.006400421 2.012800841 0.000000000
py 0 1.006387973 1.006387973 2.012775946 0.000000000
pz 0 1.006194818 1.006194818 2.012389636 0.000000000
sum over m 3.018983211 3.018983211 6.037966423 0.000000000
px 1 0.065430720 0.065430720 0.130861440 0.000000000
py 1 0.065427753 0.065427753 0.130855505 0.000000000
pz 1 0.040362129 0.040362129 0.080724259 0.000000000
sum over m 0.171220602 0.171220602 0.342441204 0.000000000
sum over m+mul 3.190203814 3.190203814 6.380407627 0.000000000
d3z^2-r^2 0 0.196297199 0.196297199 0.392594399 0.000000000
dx^2-y^2 0 0.201534012 0.201534012 0.403068025 0.000000000
dxy 0 0.250918262 0.250918262 0.501836525 0.000000000
dxz 0 0.268497935 0.268497935 0.536995869 0.000000000
dyz 0 0.268505878 0.268505878 0.537011756 0.000000000
sum over m 1.185753287 1.185753287 2.371506574 0.000000000
d3z^2-r^2 1 0.003469582 0.003469582 0.006939165 0.000000000
dx^2-y^2 1 -0.004482525 -0.004482525 -0.008965050 0.000000000
dxy 1 0.015342841 0.015342841 0.030685682 0.000000000
dxz 1 0.003484969 0.003484969 0.006969937 0.000000000
dyz 1 0.003485057 0.003485057 0.006970114 0.000000000
sum over m 0.021299924 0.021299924 0.042599849 0.000000000
sum over m+mul 1.207053211 1.207053211 2.414106422 0.000000000
110 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000786629 1.000786629 2.001573258 0.000000000
sum over m 1.000786629 1.000786629 2.001573258 0.000000000
s 1 0.207412251 0.207412251 0.414824502 0.000000000
sum over m 0.207412251 0.207412251 0.414824502 0.000000000
s 2 0.014723217 0.014723217 0.029446435 0.000000000
sum over m 0.014723217 0.014723217 0.029446435 0.000000000
sum over m+mul 1.222922097 1.222922097 2.445844194 0.000000000
px 0 1.006379604 1.006379604 2.012759208 0.000000000
py 0 1.006362926 1.006362926 2.012725851 0.000000000
pz 0 1.006207568 1.006207568 2.012415137 0.000000000
sum over m 3.018950098 3.018950098 6.037900196 0.000000000
px 1 0.065424391 0.065424391 0.130848782 0.000000000
py 1 0.065449661 0.065449661 0.130899321 0.000000000
pz 1 0.040363083 0.040363083 0.080726166 0.000000000
sum over m 0.171237135 0.171237135 0.342474270 0.000000000
sum over m+mul 3.190187233 3.190187233 6.380374465 0.000000000
d3z^2-r^2 0 0.196314102 0.196314102 0.392628205 0.000000000
dx^2-y^2 0 0.201515300 0.201515300 0.403030601 0.000000000
dxy 0 0.250946196 0.250946196 0.501892393 0.000000000
dxz 0 0.268479092 0.268479092 0.536958184 0.000000000
dyz 0 0.268502100 0.268502100 0.537004199 0.000000000
sum over m 1.185756791 1.185756791 2.371513581 0.000000000
d3z^2-r^2 1 0.003472794 0.003472794 0.006945587 0.000000000
dx^2-y^2 1 -0.004480490 -0.004480490 -0.008960980 0.000000000
dxy 1 0.015341851 0.015341851 0.030683703 0.000000000
dxz 1 0.003489723 0.003489723 0.006979446 0.000000000
dyz 1 0.003492223 0.003492223 0.006984446 0.000000000
sum over m 0.021316101 0.021316101 0.042632201 0.000000000
sum over m+mul 1.207072891 1.207072891 2.414145783 0.000000000
111 O Up spin Down spin Sum Diff
multiple
s 0 0.893895651 0.893895651 1.787791303 0.000000000
sum over m 0.893895651 0.893895651 1.787791303 0.000000000
s 1 -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m+mul 0.890854063 0.890854063 1.781708126 0.000000000
px 0 0.787109858 0.787109858 1.574219715 0.000000000
py 0 0.786850013 0.786850013 1.573700026 0.000000000
pz 0 0.779796894 0.779796894 1.559593789 0.000000000
sum over m 2.353756765 2.353756765 4.707513530 0.000000000
px 1 -0.008747356 -0.008747356 -0.017494712 0.000000000
py 1 -0.008731747 -0.008731747 -0.017463493 0.000000000
pz 1 -0.006464716 -0.006464716 -0.012929431 0.000000000
sum over m -0.023943818 -0.023943818 -0.047887637 0.000000000
sum over m+mul 2.329812947 2.329812947 4.659625893 0.000000000
d3z^2-r^2 0 -0.006391488 -0.006391488 -0.012782975 0.000000000
dx^2-y^2 0 -0.005058784 -0.005058784 -0.010117568 0.000000000
dxy 0 -0.005434639 -0.005434639 -0.010869278 0.000000000
dxz 0 -0.006927417 -0.006927417 -0.013854833 0.000000000
dyz 0 -0.006933227 -0.006933227 -0.013866455 0.000000000
sum over m -0.030745555 -0.030745555 -0.061491109 0.000000000
sum over m+mul -0.030745555 -0.030745555 -0.061491109 0.000000000
112 O Up spin Down spin Sum Diff
multiple
s 0 0.893891025 0.893891025 1.787782050 0.000000000
sum over m 0.893891025 0.893891025 1.787782050 0.000000000
s 1 -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m+mul 0.890848335 0.890848335 1.781696669 0.000000000
px 0 0.786953979 0.786953979 1.573907958 0.000000000
py 0 0.787044160 0.787044160 1.574088321 0.000000000
pz 0 0.779742007 0.779742007 1.559484015 0.000000000
sum over m 2.353740147 2.353740147 4.707480293 0.000000000
px 1 -0.008738783 -0.008738783 -0.017477566 0.000000000
py 1 -0.008733767 -0.008733767 -0.017467533 0.000000000
pz 1 -0.006460366 -0.006460366 -0.012920731 0.000000000
sum over m -0.023932915 -0.023932915 -0.047865830 0.000000000
sum over m+mul 2.329807232 2.329807232 4.659614463 0.000000000
d3z^2-r^2 0 -0.006389838 -0.006389838 -0.012779676 0.000000000
dx^2-y^2 0 -0.005056265 -0.005056265 -0.010112529 0.000000000
dxy 0 -0.005433964 -0.005433964 -0.010867928 0.000000000
dxz 0 -0.006927405 -0.006927405 -0.013854811 0.000000000
dyz 0 -0.006927781 -0.006927781 -0.013855563 0.000000000
sum over m -0.030735253 -0.030735253 -0.061470507 0.000000000
sum over m+mul -0.030735253 -0.030735253 -0.061470507 0.000000000
113 O Up spin Down spin Sum Diff
multiple
s 0 0.893902429 0.893902429 1.787804857 0.000000000
sum over m 0.893902429 0.893902429 1.787804857 0.000000000
s 1 -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m+mul 0.890860132 0.890860132 1.781720263 0.000000000
px 0 0.786938366 0.786938366 1.573876732 0.000000000
py 0 0.787083683 0.787083683 1.574167366 0.000000000
pz 0 0.779721516 0.779721516 1.559443032 0.000000000
sum over m 2.353743565 2.353743565 4.707487130 0.000000000
px 1 -0.008738389 -0.008738389 -0.017476778 0.000000000
py 1 -0.008739175 -0.008739175 -0.017478349 0.000000000
pz 1 -0.006462094 -0.006462094 -0.012924187 0.000000000
sum over m -0.023939657 -0.023939657 -0.047879315 0.000000000
sum over m+mul 2.329803908 2.329803908 4.659607815 0.000000000
d3z^2-r^2 0 -0.006390665 -0.006390665 -0.012781330 0.000000000
dx^2-y^2 0 -0.005055239 -0.005055239 -0.010110477 0.000000000
dxy 0 -0.005434586 -0.005434586 -0.010869173 0.000000000
dxz 0 -0.006927242 -0.006927242 -0.013854483 0.000000000
dyz 0 -0.006926101 -0.006926101 -0.013852202 0.000000000
sum over m -0.030733833 -0.030733833 -0.061467665 0.000000000
sum over m+mul -0.030733833 -0.030733833 -0.061467665 0.000000000
114 O Up spin Down spin Sum Diff
multiple
s 0 0.893859606 0.893859606 1.787719211 0.000000000
sum over m 0.893859606 0.893859606 1.787719211 0.000000000
s 1 -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m+mul 0.890817400 0.890817400 1.781634799 0.000000000
px 0 0.786920140 0.786920140 1.573840280 0.000000000
py 0 0.786920290 0.786920290 1.573840580 0.000000000
pz 0 0.779851139 0.779851139 1.559702279 0.000000000
sum over m 2.353691569 2.353691569 4.707383139 0.000000000
px 1 -0.008734849 -0.008734849 -0.017469697 0.000000000
py 1 -0.008726755 -0.008726755 -0.017453510 0.000000000
pz 1 -0.006464765 -0.006464765 -0.012929529 0.000000000
sum over m -0.023926368 -0.023926368 -0.047852736 0.000000000
sum over m+mul 2.329765201 2.329765201 4.659530402 0.000000000
d3z^2-r^2 0 -0.006389399 -0.006389399 -0.012778798 0.000000000
dx^2-y^2 0 -0.005060127 -0.005060127 -0.010120254 0.000000000
dxy 0 -0.005433050 -0.005433050 -0.010866099 0.000000000
dxz 0 -0.006931581 -0.006931581 -0.013863162 0.000000000
dyz 0 -0.006932951 -0.006932951 -0.013865902 0.000000000
sum over m -0.030747107 -0.030747107 -0.061494214 0.000000000
sum over m+mul -0.030747107 -0.030747107 -0.061494214 0.000000000
115 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779759 1.000779759 2.001559517 0.000000000
sum over m 1.000779759 1.000779759 2.001559517 0.000000000
s 1 0.207398342 0.207398342 0.414796684 0.000000000
sum over m 0.207398342 0.207398342 0.414796684 0.000000000
s 2 0.014720594 0.014720594 0.029441188 0.000000000
sum over m 0.014720594 0.014720594 0.029441188 0.000000000
sum over m+mul 1.222898695 1.222898695 2.445797389 0.000000000
px 0 1.006400421 1.006400421 2.012800841 0.000000000
py 0 1.006387973 1.006387973 2.012775946 0.000000000
pz 0 1.006194818 1.006194818 2.012389636 0.000000000
sum over m 3.018983211 3.018983211 6.037966423 0.000000000
px 1 0.065430720 0.065430720 0.130861440 0.000000000
py 1 0.065427752 0.065427752 0.130855505 0.000000000
pz 1 0.040362130 0.040362130 0.080724259 0.000000000
sum over m 0.171220602 0.171220602 0.342441204 0.000000000
sum over m+mul 3.190203813 3.190203813 6.380407627 0.000000000
d3z^2-r^2 0 0.196297199 0.196297199 0.392594399 0.000000000
dx^2-y^2 0 0.201534013 0.201534013 0.403068025 0.000000000
dxy 0 0.250918262 0.250918262 0.501836525 0.000000000
dxz 0 0.268497934 0.268497934 0.536995869 0.000000000
dyz 0 0.268505878 0.268505878 0.537011755 0.000000000
sum over m 1.185753286 1.185753286 2.371506573 0.000000000
d3z^2-r^2 1 0.003469582 0.003469582 0.006939165 0.000000000
dx^2-y^2 1 -0.004482525 -0.004482525 -0.008965050 0.000000000
dxy 1 0.015342841 0.015342841 0.030685682 0.000000000
dxz 1 0.003484969 0.003484969 0.006969937 0.000000000
dyz 1 0.003485057 0.003485057 0.006970114 0.000000000
sum over m 0.021299924 0.021299924 0.042599849 0.000000000
sum over m+mul 1.207053211 1.207053211 2.414106422 0.000000000
116 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000786629 1.000786629 2.001573258 0.000000000
sum over m 1.000786629 1.000786629 2.001573258 0.000000000
s 1 0.207412251 0.207412251 0.414824501 0.000000000
sum over m 0.207412251 0.207412251 0.414824501 0.000000000
s 2 0.014723217 0.014723217 0.029446435 0.000000000
sum over m 0.014723217 0.014723217 0.029446435 0.000000000
sum over m+mul 1.222922097 1.222922097 2.445844194 0.000000000
px 0 1.006379604 1.006379604 2.012759208 0.000000000
py 0 1.006362926 1.006362926 2.012725851 0.000000000
pz 0 1.006207568 1.006207568 2.012415137 0.000000000
sum over m 3.018950098 3.018950098 6.037900196 0.000000000
px 1 0.065424391 0.065424391 0.130848782 0.000000000
py 1 0.065449661 0.065449661 0.130899321 0.000000000
pz 1 0.040363083 0.040363083 0.080726166 0.000000000
sum over m 0.171237135 0.171237135 0.342474269 0.000000000
sum over m+mul 3.190187233 3.190187233 6.380374465 0.000000000
d3z^2-r^2 0 0.196314103 0.196314103 0.392628205 0.000000000
dx^2-y^2 0 0.201515301 0.201515301 0.403030601 0.000000000
dxy 0 0.250946197 0.250946197 0.501892393 0.000000000
dxz 0 0.268479092 0.268479092 0.536958184 0.000000000
dyz 0 0.268502100 0.268502100 0.537004199 0.000000000
sum over m 1.185756791 1.185756791 2.371513583 0.000000000
d3z^2-r^2 1 0.003472794 0.003472794 0.006945587 0.000000000
dx^2-y^2 1 -0.004480490 -0.004480490 -0.008960980 0.000000000
dxy 1 0.015341851 0.015341851 0.030683703 0.000000000
dxz 1 0.003489723 0.003489723 0.006979446 0.000000000
dyz 1 0.003492223 0.003492223 0.006984446 0.000000000
sum over m 0.021316101 0.021316101 0.042632201 0.000000000
sum over m+mul 1.207072892 1.207072892 2.414145784 0.000000000
117 O Up spin Down spin Sum Diff
multiple
s 0 0.893895651 0.893895651 1.787791303 0.000000000
sum over m 0.893895651 0.893895651 1.787791303 0.000000000
s 1 -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m+mul 0.890854063 0.890854063 1.781708126 0.000000000
px 0 0.787109857 0.787109857 1.574219715 0.000000000
py 0 0.786850013 0.786850013 1.573700026 0.000000000
pz 0 0.779796894 0.779796894 1.559593789 0.000000000
sum over m 2.353756765 2.353756765 4.707513530 0.000000000
px 1 -0.008747356 -0.008747356 -0.017494712 0.000000000
py 1 -0.008731747 -0.008731747 -0.017463493 0.000000000
pz 1 -0.006464716 -0.006464716 -0.012929431 0.000000000
sum over m -0.023943818 -0.023943818 -0.047887637 0.000000000
sum over m+mul 2.329812946 2.329812946 4.659625893 0.000000000
d3z^2-r^2 0 -0.006391488 -0.006391488 -0.012782975 0.000000000
dx^2-y^2 0 -0.005058784 -0.005058784 -0.010117568 0.000000000
dxy 0 -0.005434639 -0.005434639 -0.010869278 0.000000000
dxz 0 -0.006927417 -0.006927417 -0.013854833 0.000000000
dyz 0 -0.006933227 -0.006933227 -0.013866455 0.000000000
sum over m -0.030745555 -0.030745555 -0.061491109 0.000000000
sum over m+mul -0.030745555 -0.030745555 -0.061491109 0.000000000
118 O Up spin Down spin Sum Diff
multiple
s 0 0.893891025 0.893891025 1.787782050 0.000000000
sum over m 0.893891025 0.893891025 1.787782050 0.000000000
s 1 -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m+mul 0.890848335 0.890848335 1.781696669 0.000000000
px 0 0.786953979 0.786953979 1.573907958 0.000000000
py 0 0.787044161 0.787044161 1.574088321 0.000000000
pz 0 0.779742007 0.779742007 1.559484015 0.000000000
sum over m 2.353740147 2.353740147 4.707480294 0.000000000
px 1 -0.008738783 -0.008738783 -0.017477566 0.000000000
py 1 -0.008733767 -0.008733767 -0.017467533 0.000000000
pz 1 -0.006460366 -0.006460366 -0.012920731 0.000000000
sum over m -0.023932915 -0.023932915 -0.047865830 0.000000000
sum over m+mul 2.329807232 2.329807232 4.659614464 0.000000000
d3z^2-r^2 0 -0.006389838 -0.006389838 -0.012779676 0.000000000
dx^2-y^2 0 -0.005056265 -0.005056265 -0.010112529 0.000000000
dxy 0 -0.005433964 -0.005433964 -0.010867928 0.000000000
dxz 0 -0.006927405 -0.006927405 -0.013854811 0.000000000
dyz 0 -0.006927781 -0.006927781 -0.013855563 0.000000000
sum over m -0.030735254 -0.030735254 -0.061470507 0.000000000
sum over m+mul -0.030735254 -0.030735254 -0.061470507 0.000000000
119 O Up spin Down spin Sum Diff
multiple
s 0 0.893902429 0.893902429 1.787804857 0.000000000
sum over m 0.893902429 0.893902429 1.787804857 0.000000000
s 1 -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m+mul 0.890860132 0.890860132 1.781720264 0.000000000
px 0 0.786938366 0.786938366 1.573876731 0.000000000
py 0 0.787083683 0.787083683 1.574167366 0.000000000
pz 0 0.779721516 0.779721516 1.559443032 0.000000000
sum over m 2.353743565 2.353743565 4.707487130 0.000000000
px 1 -0.008738389 -0.008738389 -0.017476778 0.000000000
py 1 -0.008739175 -0.008739175 -0.017478349 0.000000000
pz 1 -0.006462094 -0.006462094 -0.012924187 0.000000000
sum over m -0.023939657 -0.023939657 -0.047879314 0.000000000
sum over m+mul 2.329803908 2.329803908 4.659607815 0.000000000
d3z^2-r^2 0 -0.006390665 -0.006390665 -0.012781330 0.000000000
dx^2-y^2 0 -0.005055239 -0.005055239 -0.010110477 0.000000000
dxy 0 -0.005434586 -0.005434586 -0.010869173 0.000000000
dxz 0 -0.006927242 -0.006927242 -0.013854483 0.000000000
dyz 0 -0.006926101 -0.006926101 -0.013852202 0.000000000
sum over m -0.030733833 -0.030733833 -0.061467665 0.000000000
sum over m+mul -0.030733833 -0.030733833 -0.061467665 0.000000000
120 O Up spin Down spin Sum Diff
multiple
s 0 0.893859606 0.893859606 1.787719211 0.000000000
sum over m 0.893859606 0.893859606 1.787719211 0.000000000
s 1 -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m+mul 0.890817400 0.890817400 1.781634799 0.000000000
px 0 0.786920140 0.786920140 1.573840280 0.000000000
py 0 0.786920290 0.786920290 1.573840579 0.000000000
pz 0 0.779851139 0.779851139 1.559702279 0.000000000
sum over m 2.353691569 2.353691569 4.707383138 0.000000000
px 1 -0.008734849 -0.008734849 -0.017469697 0.000000000
py 1 -0.008726755 -0.008726755 -0.017453510 0.000000000
pz 1 -0.006464765 -0.006464765 -0.012929529 0.000000000
sum over m -0.023926368 -0.023926368 -0.047852736 0.000000000
sum over m+mul 2.329765201 2.329765201 4.659530402 0.000000000
d3z^2-r^2 0 -0.006389399 -0.006389399 -0.012778798 0.000000000
dx^2-y^2 0 -0.005060127 -0.005060127 -0.010120254 0.000000000
dxy 0 -0.005433050 -0.005433050 -0.010866099 0.000000000
dxz 0 -0.006931581 -0.006931581 -0.013863162 0.000000000
dyz 0 -0.006932951 -0.006932951 -0.013865902 0.000000000
sum over m -0.030747107 -0.030747107 -0.061494214 0.000000000
sum over m+mul -0.030747107 -0.030747107 -0.061494214 0.000000000
121 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779758 1.000779758 2.001559517 0.000000000
sum over m 1.000779758 1.000779758 2.001559517 0.000000000
s 1 0.207398342 0.207398342 0.414796684 0.000000000
sum over m 0.207398342 0.207398342 0.414796684 0.000000000
s 2 0.014720594 0.014720594 0.029441188 0.000000000
sum over m 0.014720594 0.014720594 0.029441188 0.000000000
sum over m+mul 1.222898695 1.222898695 2.445797389 0.000000000
px 0 1.006400420 1.006400420 2.012800841 0.000000000
py 0 1.006387973 1.006387973 2.012775946 0.000000000
pz 0 1.006194818 1.006194818 2.012389636 0.000000000
sum over m 3.018983211 3.018983211 6.037966423 0.000000000
px 1 0.065430720 0.065430720 0.130861440 0.000000000
py 1 0.065427753 0.065427753 0.130855505 0.000000000
pz 1 0.040362129 0.040362129 0.080724259 0.000000000
sum over m 0.171220602 0.171220602 0.342441204 0.000000000
sum over m+mul 3.190203813 3.190203813 6.380407627 0.000000000
d3z^2-r^2 0 0.196297199 0.196297199 0.392594399 0.000000000
dx^2-y^2 0 0.201534012 0.201534012 0.403068025 0.000000000
dxy 0 0.250918262 0.250918262 0.501836525 0.000000000
dxz 0 0.268497934 0.268497934 0.536995869 0.000000000
dyz 0 0.268505878 0.268505878 0.537011756 0.000000000
sum over m 1.185753287 1.185753287 2.371506573 0.000000000
d3z^2-r^2 1 0.003469582 0.003469582 0.006939165 0.000000000
dx^2-y^2 1 -0.004482525 -0.004482525 -0.008965050 0.000000000
dxy 1 0.015342841 0.015342841 0.030685682 0.000000000
dxz 1 0.003484969 0.003484969 0.006969937 0.000000000
dyz 1 0.003485057 0.003485057 0.006970114 0.000000000
sum over m 0.021299924 0.021299924 0.042599849 0.000000000
sum over m+mul 1.207053211 1.207053211 2.414106422 0.000000000
122 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000786629 1.000786629 2.001573258 0.000000000
sum over m 1.000786629 1.000786629 2.001573258 0.000000000
s 1 0.207412251 0.207412251 0.414824502 0.000000000
sum over m 0.207412251 0.207412251 0.414824502 0.000000000
s 2 0.014723217 0.014723217 0.029446435 0.000000000
sum over m 0.014723217 0.014723217 0.029446435 0.000000000
sum over m+mul 1.222922097 1.222922097 2.445844194 0.000000000
px 0 1.006379604 1.006379604 2.012759208 0.000000000
py 0 1.006362926 1.006362926 2.012725851 0.000000000
pz 0 1.006207568 1.006207568 2.012415137 0.000000000
sum over m 3.018950098 3.018950098 6.037900196 0.000000000
px 1 0.065424391 0.065424391 0.130848782 0.000000000
py 1 0.065449661 0.065449661 0.130899321 0.000000000
pz 1 0.040363083 0.040363083 0.080726166 0.000000000
sum over m 0.171237135 0.171237135 0.342474270 0.000000000
sum over m+mul 3.190187233 3.190187233 6.380374465 0.000000000
d3z^2-r^2 0 0.196314103 0.196314103 0.392628205 0.000000000
dx^2-y^2 0 0.201515300 0.201515300 0.403030601 0.000000000
dxy 0 0.250946196 0.250946196 0.501892393 0.000000000
dxz 0 0.268479092 0.268479092 0.536958185 0.000000000
dyz 0 0.268502100 0.268502100 0.537004199 0.000000000
sum over m 1.185756791 1.185756791 2.371513583 0.000000000
d3z^2-r^2 1 0.003472794 0.003472794 0.006945587 0.000000000
dx^2-y^2 1 -0.004480490 -0.004480490 -0.008960980 0.000000000
dxy 1 0.015341851 0.015341851 0.030683703 0.000000000
dxz 1 0.003489723 0.003489723 0.006979446 0.000000000
dyz 1 0.003492223 0.003492223 0.006984446 0.000000000
sum over m 0.021316101 0.021316101 0.042632202 0.000000000
sum over m+mul 1.207072892 1.207072892 2.414145784 0.000000000
123 O Up spin Down spin Sum Diff
multiple
s 0 0.893895651 0.893895651 1.787791303 0.000000000
sum over m 0.893895651 0.893895651 1.787791303 0.000000000
s 1 -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m+mul 0.890854063 0.890854063 1.781708126 0.000000000
px 0 0.787109858 0.787109858 1.574219715 0.000000000
py 0 0.786850013 0.786850013 1.573700026 0.000000000
pz 0 0.779796894 0.779796894 1.559593789 0.000000000
sum over m 2.353756765 2.353756765 4.707513530 0.000000000
px 1 -0.008747356 -0.008747356 -0.017494713 0.000000000
py 1 -0.008731747 -0.008731747 -0.017463493 0.000000000
pz 1 -0.006464716 -0.006464716 -0.012929431 0.000000000
sum over m -0.023943818 -0.023943818 -0.047887637 0.000000000
sum over m+mul 2.329812946 2.329812946 4.659625893 0.000000000
d3z^2-r^2 0 -0.006391488 -0.006391488 -0.012782975 0.000000000
dx^2-y^2 0 -0.005058784 -0.005058784 -0.010117568 0.000000000
dxy 0 -0.005434639 -0.005434639 -0.010869278 0.000000000
dxz 0 -0.006927417 -0.006927417 -0.013854833 0.000000000
dyz 0 -0.006933227 -0.006933227 -0.013866455 0.000000000
sum over m -0.030745555 -0.030745555 -0.061491109 0.000000000
sum over m+mul -0.030745555 -0.030745555 -0.061491109 0.000000000
124 O Up spin Down spin Sum Diff
multiple
s 0 0.893891025 0.893891025 1.787782050 0.000000000
sum over m 0.893891025 0.893891025 1.787782050 0.000000000
s 1 -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m+mul 0.890848335 0.890848335 1.781696669 0.000000000
px 0 0.786953979 0.786953979 1.573907958 0.000000000
py 0 0.787044160 0.787044160 1.574088321 0.000000000
pz 0 0.779742007 0.779742007 1.559484015 0.000000000
sum over m 2.353740147 2.353740147 4.707480293 0.000000000
px 1 -0.008738783 -0.008738783 -0.017477566 0.000000000
py 1 -0.008733767 -0.008733767 -0.017467533 0.000000000
pz 1 -0.006460366 -0.006460366 -0.012920731 0.000000000
sum over m -0.023932915 -0.023932915 -0.047865830 0.000000000
sum over m+mul 2.329807231 2.329807231 4.659614463 0.000000000
d3z^2-r^2 0 -0.006389838 -0.006389838 -0.012779676 0.000000000
dx^2-y^2 0 -0.005056265 -0.005056265 -0.010112529 0.000000000
dxy 0 -0.005433964 -0.005433964 -0.010867928 0.000000000
dxz 0 -0.006927405 -0.006927405 -0.013854811 0.000000000
dyz 0 -0.006927781 -0.006927781 -0.013855563 0.000000000
sum over m -0.030735253 -0.030735253 -0.061470507 0.000000000
sum over m+mul -0.030735253 -0.030735253 -0.061470507 0.000000000
125 O Up spin Down spin Sum Diff
multiple
s 0 0.893902429 0.893902429 1.787804858 0.000000000
sum over m 0.893902429 0.893902429 1.787804858 0.000000000
s 1 -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m+mul 0.890860132 0.890860132 1.781720264 0.000000000
px 0 0.786938366 0.786938366 1.573876732 0.000000000
py 0 0.787083683 0.787083683 1.574167366 0.000000000
pz 0 0.779721516 0.779721516 1.559443032 0.000000000
sum over m 2.353743565 2.353743565 4.707487130 0.000000000
px 1 -0.008738389 -0.008738389 -0.017476778 0.000000000
py 1 -0.008739175 -0.008739175 -0.017478349 0.000000000
pz 1 -0.006462093 -0.006462093 -0.012924187 0.000000000
sum over m -0.023939657 -0.023939657 -0.047879314 0.000000000
sum over m+mul 2.329803908 2.329803908 4.659607815 0.000000000
d3z^2-r^2 0 -0.006390665 -0.006390665 -0.012781330 0.000000000
dx^2-y^2 0 -0.005055239 -0.005055239 -0.010110477 0.000000000
dxy 0 -0.005434586 -0.005434586 -0.010869173 0.000000000
dxz 0 -0.006927242 -0.006927242 -0.013854483 0.000000000
dyz 0 -0.006926101 -0.006926101 -0.013852202 0.000000000
sum over m -0.030733833 -0.030733833 -0.061467665 0.000000000
sum over m+mul -0.030733833 -0.030733833 -0.061467665 0.000000000
126 O Up spin Down spin Sum Diff
multiple
s 0 0.893859606 0.893859606 1.787719211 0.000000000
sum over m 0.893859606 0.893859606 1.787719211 0.000000000
s 1 -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m+mul 0.890817400 0.890817400 1.781634799 0.000000000
px 0 0.786920140 0.786920140 1.573840280 0.000000000
py 0 0.786920290 0.786920290 1.573840580 0.000000000
pz 0 0.779851139 0.779851139 1.559702279 0.000000000
sum over m 2.353691569 2.353691569 4.707383138 0.000000000
px 1 -0.008734849 -0.008734849 -0.017469697 0.000000000
py 1 -0.008726755 -0.008726755 -0.017453510 0.000000000
pz 1 -0.006464765 -0.006464765 -0.012929529 0.000000000
sum over m -0.023926368 -0.023926368 -0.047852736 0.000000000
sum over m+mul 2.329765201 2.329765201 4.659530402 0.000000000
d3z^2-r^2 0 -0.006389399 -0.006389399 -0.012778798 0.000000000
dx^2-y^2 0 -0.005060127 -0.005060127 -0.010120254 0.000000000
dxy 0 -0.005433050 -0.005433050 -0.010866099 0.000000000
dxz 0 -0.006931581 -0.006931581 -0.013863162 0.000000000
dyz 0 -0.006932951 -0.006932951 -0.013865902 0.000000000
sum over m -0.030747107 -0.030747107 -0.061494214 0.000000000
sum over m+mul -0.030747107 -0.030747107 -0.061494214 0.000000000
127 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000770732 1.000770732 2.001541464 0.000000000
sum over m 1.000770732 1.000770732 2.001541464 0.000000000
s 1 0.207415354 0.207415354 0.414830707 0.000000000
sum over m 0.207415354 0.207415354 0.414830707 0.000000000
s 2 0.014725018 0.014725018 0.029450037 0.000000000
sum over m 0.014725018 0.014725018 0.029450037 0.000000000
sum over m+mul 1.222911104 1.222911104 2.445822208 0.000000000
px 0 1.006377070 1.006377070 2.012754140 0.000000000
py 0 1.006363497 1.006363497 2.012726994 0.000000000
pz 0 1.006197348 1.006197348 2.012394695 0.000000000
sum over m 3.018937914 3.018937914 6.037875829 0.000000000
px 1 0.065435974 0.065435974 0.130871948 0.000000000
py 1 0.065430544 0.065430544 0.130861089 0.000000000
pz 1 0.040378093 0.040378093 0.080756187 0.000000000
sum over m 0.171244612 0.171244612 0.342489223 0.000000000
sum over m+mul 3.190182526 3.190182526 6.380365052 0.000000000
d3z^2-r^2 0 0.196300924 0.196300924 0.392601848 0.000000000
dx^2-y^2 0 0.201509474 0.201509474 0.403018949 0.000000000
dxy 0 0.250938065 0.250938065 0.501876129 0.000000000
dxz 0 0.268491138 0.268491138 0.536982277 0.000000000
dyz 0 0.268515407 0.268515407 0.537030813 0.000000000
sum over m 1.185755008 1.185755008 2.371510015 0.000000000
d3z^2-r^2 1 0.003475239 0.003475239 0.006950478 0.000000000
dx^2-y^2 1 -0.004476268 -0.004476268 -0.008952536 0.000000000
dxy 1 0.015340008 0.015340008 0.030680016 0.000000000
dxz 1 0.003489582 0.003489582 0.006979164 0.000000000
dyz 1 0.003489873 0.003489873 0.006979746 0.000000000
sum over m 0.021318434 0.021318434 0.042636868 0.000000000
sum over m+mul 1.207073442 1.207073442 2.414146883 0.000000000
128 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778689 1.000778689 2.001557378 0.000000000
sum over m 1.000778689 1.000778689 2.001557378 0.000000000
s 1 0.207427937 0.207427937 0.414855875 0.000000000
sum over m 0.207427937 0.207427937 0.414855875 0.000000000
s 2 0.014724840 0.014724840 0.029449681 0.000000000
sum over m 0.014724840 0.014724840 0.029449681 0.000000000
sum over m+mul 1.222931466 1.222931466 2.445862933 0.000000000
px 0 1.006378244 1.006378244 2.012756488 0.000000000
py 0 1.006362938 1.006362938 2.012725875 0.000000000
pz 0 1.006192809 1.006192809 2.012385617 0.000000000
sum over m 3.018933990 3.018933990 6.037867981 0.000000000
px 1 0.065430970 0.065430970 0.130861940 0.000000000
py 1 0.065445106 0.065445106 0.130890212 0.000000000
pz 1 0.040376746 0.040376746 0.080753493 0.000000000
sum over m 0.171252823 0.171252823 0.342505645 0.000000000
sum over m+mul 3.190186813 3.190186813 6.380373626 0.000000000
d3z^2-r^2 0 0.196306657 0.196306657 0.392613314 0.000000000
dx^2-y^2 0 0.201501412 0.201501412 0.403002824 0.000000000
dxy 0 0.250950786 0.250950786 0.501901572 0.000000000
dxz 0 0.268477950 0.268477950 0.536955900 0.000000000
dyz 0 0.268511716 0.268511716 0.537023433 0.000000000
sum over m 1.185748521 1.185748521 2.371497042 0.000000000
d3z^2-r^2 1 0.003474151 0.003474151 0.006948302 0.000000000
dx^2-y^2 1 -0.004476884 -0.004476884 -0.008953767 0.000000000
dxy 1 0.015339214 0.015339214 0.030678429 0.000000000
dxz 1 0.003488727 0.003488727 0.006977455 0.000000000
dyz 1 0.003491773 0.003491773 0.006983546 0.000000000
sum over m 0.021316982 0.021316982 0.042633964 0.000000000
sum over m+mul 1.207065503 1.207065503 2.414131007 0.000000000
129 O Up spin Down spin Sum Diff
multiple
s 0 0.893895019 0.893895019 1.787790038 0.000000000
sum over m 0.893895019 0.893895019 1.787790038 0.000000000
s 1 -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m+mul 0.890852483 0.890852483 1.781704966 0.000000000
px 0 0.787056712 0.787056712 1.574113423 0.000000000
py 0 0.786966454 0.786966454 1.573932907 0.000000000
pz 0 0.779743447 0.779743447 1.559486894 0.000000000
sum over m 2.353766613 2.353766613 4.707533225 0.000000000
px 1 -0.008739472 -0.008739472 -0.017478944 0.000000000
py 1 -0.008730480 -0.008730480 -0.017460960 0.000000000
pz 1 -0.006458433 -0.006458433 -0.012916866 0.000000000
sum over m -0.023928385 -0.023928385 -0.047856770 0.000000000
sum over m+mul 2.329838227 2.329838227 4.659676455 0.000000000
d3z^2-r^2 0 -0.006389905 -0.006389905 -0.012779810 0.000000000
dx^2-y^2 0 -0.005056718 -0.005056718 -0.010113437 0.000000000
dxy 0 -0.005434763 -0.005434763 -0.010869526 0.000000000
dxz 0 -0.006925027 -0.006925027 -0.013850053 0.000000000
dyz 0 -0.006929867 -0.006929867 -0.013859734 0.000000000
sum over m -0.030736281 -0.030736281 -0.061472561 0.000000000
sum over m+mul -0.030736281 -0.030736281 -0.061472561 0.000000000
130 O Up spin Down spin Sum Diff
multiple
s 0 0.893874732 0.893874732 1.787749464 0.000000000
sum over m 0.893874732 0.893874732 1.787749464 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m+mul 0.890832556 0.890832556 1.781665113 0.000000000
px 0 0.787008076 0.787008076 1.574016153 0.000000000
py 0 0.786910520 0.786910520 1.573821040 0.000000000
pz 0 0.779811493 0.779811493 1.559622987 0.000000000
sum over m 2.353730090 2.353730090 4.707460180 0.000000000
px 1 -0.008738822 -0.008738822 -0.017477644 0.000000000
py 1 -0.008727624 -0.008727624 -0.017455248 0.000000000
pz 1 -0.006463367 -0.006463367 -0.012926734 0.000000000
sum over m -0.023929813 -0.023929813 -0.047859626 0.000000000
sum over m+mul 2.329800277 2.329800277 4.659600554 0.000000000
d3z^2-r^2 0 -0.006389922 -0.006389922 -0.012779845 0.000000000
dx^2-y^2 0 -0.005059210 -0.005059210 -0.010118420 0.000000000
dxy 0 -0.005433824 -0.005433824 -0.010867647 0.000000000
dxz 0 -0.006928883 -0.006928883 -0.013857765 0.000000000
dyz 0 -0.006932427 -0.006932427 -0.013864854 0.000000000
sum over m -0.030744266 -0.030744266 -0.061488531 0.000000000
sum over m+mul -0.030744266 -0.030744266 -0.061488531 0.000000000
131 O Up spin Down spin Sum Diff
multiple
s 0 0.893881298 0.893881298 1.787762596 0.000000000
sum over m 0.893881298 0.893881298 1.787762596 0.000000000
s 1 -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m+mul 0.890838813 0.890838813 1.781677626 0.000000000
px 0 0.786978394 0.786978394 1.573956787 0.000000000
py 0 0.786977266 0.786977266 1.573954532 0.000000000
pz 0 0.779778276 0.779778276 1.559556552 0.000000000
sum over m 2.353733936 2.353733936 4.707467871 0.000000000
px 1 -0.008737772 -0.008737772 -0.017475544 0.000000000
py 1 -0.008729574 -0.008729574 -0.017459148 0.000000000
pz 1 -0.006460567 -0.006460567 -0.012921134 0.000000000
sum over m -0.023927913 -0.023927913 -0.047855826 0.000000000
sum over m+mul 2.329806022 2.329806022 4.659612045 0.000000000
d3z^2-r^2 0 -0.006389700 -0.006389700 -0.012779401 0.000000000
dx^2-y^2 0 -0.005057871 -0.005057871 -0.010115741 0.000000000
dxy 0 -0.005433956 -0.005433956 -0.010867912 0.000000000
dxz 0 -0.006927692 -0.006927692 -0.013855384 0.000000000
dyz 0 -0.006930158 -0.006930158 -0.013860316 0.000000000
sum over m -0.030739377 -0.030739377 -0.061478754 0.000000000
sum over m+mul -0.030739377 -0.030739377 -0.061478754 0.000000000
132 O Up spin Down spin Sum Diff
multiple
s 0 0.893886339 0.893886339 1.787772678 0.000000000
sum over m 0.893886339 0.893886339 1.787772678 0.000000000
s 1 -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m+mul 0.890843777 0.890843777 1.781687554 0.000000000
px 0 0.786877517 0.786877517 1.573755034 0.000000000
py 0 0.787069304 0.787069304 1.574138608 0.000000000
pz 0 0.779775813 0.779775813 1.559551626 0.000000000
sum over m 2.353722635 2.353722635 4.707445269 0.000000000
px 1 -0.008739259 -0.008739259 -0.017478518 0.000000000
py 1 -0.008737633 -0.008737633 -0.017475265 0.000000000
pz 1 -0.006463380 -0.006463380 -0.012926759 0.000000000
sum over m -0.023940271 -0.023940271 -0.047880542 0.000000000
sum over m+mul 2.329782364 2.329782364 4.659564727 0.000000000
d3z^2-r^2 0 -0.006389979 -0.006389979 -0.012779958 0.000000000
dx^2-y^2 0 -0.005057691 -0.005057691 -0.010115383 0.000000000
dxy 0 -0.005433292 -0.005433292 -0.010866584 0.000000000
dxz 0 -0.006930501 -0.006930501 -0.013861002 0.000000000
dyz 0 -0.006928514 -0.006928514 -0.013857028 0.000000000
sum over m -0.030739977 -0.030739977 -0.061479954 0.000000000
sum over m+mul -0.030739977 -0.030739977 -0.061479954 0.000000000
133 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000770732 1.000770732 2.001541464 0.000000000
sum over m 1.000770732 1.000770732 2.001541464 0.000000000
s 1 0.207415353 0.207415353 0.414830707 0.000000000
sum over m 0.207415353 0.207415353 0.414830707 0.000000000
s 2 0.014725018 0.014725018 0.029450037 0.000000000
sum over m 0.014725018 0.014725018 0.029450037 0.000000000
sum over m+mul 1.222911104 1.222911104 2.445822208 0.000000000
px 0 1.006377070 1.006377070 2.012754140 0.000000000
py 0 1.006363497 1.006363497 2.012726994 0.000000000
pz 0 1.006197348 1.006197348 2.012394695 0.000000000
sum over m 3.018937914 3.018937914 6.037875828 0.000000000
px 1 0.065435974 0.065435974 0.130871948 0.000000000
py 1 0.065430544 0.065430544 0.130861089 0.000000000
pz 1 0.040378094 0.040378094 0.080756187 0.000000000
sum over m 0.171244612 0.171244612 0.342489224 0.000000000
sum over m+mul 3.190182526 3.190182526 6.380365052 0.000000000
d3z^2-r^2 0 0.196300924 0.196300924 0.392601848 0.000000000
dx^2-y^2 0 0.201509474 0.201509474 0.403018948 0.000000000
dxy 0 0.250938064 0.250938064 0.501876129 0.000000000
dxz 0 0.268491138 0.268491138 0.536982276 0.000000000
dyz 0 0.268515406 0.268515406 0.537030813 0.000000000
sum over m 1.185755007 1.185755007 2.371510014 0.000000000
d3z^2-r^2 1 0.003475239 0.003475239 0.006950478 0.000000000
dx^2-y^2 1 -0.004476268 -0.004476268 -0.008952536 0.000000000
dxy 1 0.015340008 0.015340008 0.030680016 0.000000000
dxz 1 0.003489582 0.003489582 0.006979164 0.000000000
dyz 1 0.003489873 0.003489873 0.006979746 0.000000000
sum over m 0.021318434 0.021318434 0.042636868 0.000000000
sum over m+mul 1.207073441 1.207073441 2.414146882 0.000000000
134 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778689 1.000778689 2.001557378 0.000000000
sum over m 1.000778689 1.000778689 2.001557378 0.000000000
s 1 0.207427937 0.207427937 0.414855874 0.000000000
sum over m 0.207427937 0.207427937 0.414855874 0.000000000
s 2 0.014724840 0.014724840 0.029449681 0.000000000
sum over m 0.014724840 0.014724840 0.029449681 0.000000000
sum over m+mul 1.222931466 1.222931466 2.445862933 0.000000000
px 0 1.006378244 1.006378244 2.012756488 0.000000000
py 0 1.006362938 1.006362938 2.012725875 0.000000000
pz 0 1.006192809 1.006192809 2.012385617 0.000000000
sum over m 3.018933990 3.018933990 6.037867981 0.000000000
px 1 0.065430970 0.065430970 0.130861940 0.000000000
py 1 0.065445106 0.065445106 0.130890212 0.000000000
pz 1 0.040376746 0.040376746 0.080753493 0.000000000
sum over m 0.171252822 0.171252822 0.342505645 0.000000000
sum over m+mul 3.190186813 3.190186813 6.380373626 0.000000000
d3z^2-r^2 0 0.196306657 0.196306657 0.392613314 0.000000000
dx^2-y^2 0 0.201501412 0.201501412 0.403002824 0.000000000
dxy 0 0.250950786 0.250950786 0.501901571 0.000000000
dxz 0 0.268477950 0.268477950 0.536955900 0.000000000
dyz 0 0.268511716 0.268511716 0.537023432 0.000000000
sum over m 1.185748521 1.185748521 2.371497042 0.000000000
d3z^2-r^2 1 0.003474151 0.003474151 0.006948302 0.000000000
dx^2-y^2 1 -0.004476884 -0.004476884 -0.008953767 0.000000000
dxy 1 0.015339214 0.015339214 0.030678429 0.000000000
dxz 1 0.003488727 0.003488727 0.006977455 0.000000000
dyz 1 0.003491773 0.003491773 0.006983546 0.000000000
sum over m 0.021316982 0.021316982 0.042633964 0.000000000
sum over m+mul 1.207065503 1.207065503 2.414131006 0.000000000
135 O Up spin Down spin Sum Diff
multiple
s 0 0.893895019 0.893895019 1.787790038 0.000000000
sum over m 0.893895019 0.893895019 1.787790038 0.000000000
s 1 -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m+mul 0.890852483 0.890852483 1.781704966 0.000000000
px 0 0.787056711 0.787056711 1.574113423 0.000000000
py 0 0.786966454 0.786966454 1.573932908 0.000000000
pz 0 0.779743447 0.779743447 1.559486894 0.000000000
sum over m 2.353766612 2.353766612 4.707533225 0.000000000
px 1 -0.008739472 -0.008739472 -0.017478944 0.000000000
py 1 -0.008730480 -0.008730480 -0.017460960 0.000000000
pz 1 -0.006458433 -0.006458433 -0.012916866 0.000000000
sum over m -0.023928385 -0.023928385 -0.047856770 0.000000000
sum over m+mul 2.329838227 2.329838227 4.659676455 0.000000000
d3z^2-r^2 0 -0.006389905 -0.006389905 -0.012779810 0.000000000
dx^2-y^2 0 -0.005056718 -0.005056718 -0.010113437 0.000000000
dxy 0 -0.005434763 -0.005434763 -0.010869526 0.000000000
dxz 0 -0.006925027 -0.006925027 -0.013850053 0.000000000
dyz 0 -0.006929867 -0.006929867 -0.013859734 0.000000000
sum over m -0.030736281 -0.030736281 -0.061472561 0.000000000
sum over m+mul -0.030736281 -0.030736281 -0.061472561 0.000000000
136 O Up spin Down spin Sum Diff
multiple
s 0 0.893874732 0.893874732 1.787749464 0.000000000
sum over m 0.893874732 0.893874732 1.787749464 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m+mul 0.890832556 0.890832556 1.781665113 0.000000000
px 0 0.787008077 0.787008077 1.574016153 0.000000000
py 0 0.786910520 0.786910520 1.573821040 0.000000000
pz 0 0.779811493 0.779811493 1.559622987 0.000000000
sum over m 2.353730090 2.353730090 4.707460180 0.000000000
px 1 -0.008738822 -0.008738822 -0.017477644 0.000000000
py 1 -0.008727624 -0.008727624 -0.017455248 0.000000000
pz 1 -0.006463367 -0.006463367 -0.012926734 0.000000000
sum over m -0.023929813 -0.023929813 -0.047859626 0.000000000
sum over m+mul 2.329800277 2.329800277 4.659600554 0.000000000
d3z^2-r^2 0 -0.006389922 -0.006389922 -0.012779845 0.000000000
dx^2-y^2 0 -0.005059210 -0.005059210 -0.010118420 0.000000000
dxy 0 -0.005433824 -0.005433824 -0.010867647 0.000000000
dxz 0 -0.006928883 -0.006928883 -0.013857765 0.000000000
dyz 0 -0.006932427 -0.006932427 -0.013864854 0.000000000
sum over m -0.030744266 -0.030744266 -0.061488531 0.000000000
sum over m+mul -0.030744266 -0.030744266 -0.061488531 0.000000000
137 O Up spin Down spin Sum Diff
multiple
s 0 0.893881298 0.893881298 1.787762596 0.000000000
sum over m 0.893881298 0.893881298 1.787762596 0.000000000
s 1 -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m+mul 0.890838813 0.890838813 1.781677626 0.000000000
px 0 0.786978393 0.786978393 1.573956787 0.000000000
py 0 0.786977266 0.786977266 1.573954532 0.000000000
pz 0 0.779778276 0.779778276 1.559556553 0.000000000
sum over m 2.353733936 2.353733936 4.707467872 0.000000000
px 1 -0.008737772 -0.008737772 -0.017475544 0.000000000
py 1 -0.008729574 -0.008729574 -0.017459148 0.000000000
pz 1 -0.006460567 -0.006460567 -0.012921134 0.000000000
sum over m -0.023927913 -0.023927913 -0.047855826 0.000000000
sum over m+mul 2.329806023 2.329806023 4.659612046 0.000000000
d3z^2-r^2 0 -0.006389700 -0.006389700 -0.012779401 0.000000000
dx^2-y^2 0 -0.005057871 -0.005057871 -0.010115741 0.000000000
dxy 0 -0.005433956 -0.005433956 -0.010867912 0.000000000
dxz 0 -0.006927692 -0.006927692 -0.013855384 0.000000000
dyz 0 -0.006930158 -0.006930158 -0.013860316 0.000000000
sum over m -0.030739377 -0.030739377 -0.061478754 0.000000000
sum over m+mul -0.030739377 -0.030739377 -0.061478754 0.000000000
138 O Up spin Down spin Sum Diff
multiple
s 0 0.893886339 0.893886339 1.787772678 0.000000000
sum over m 0.893886339 0.893886339 1.787772678 0.000000000
s 1 -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m+mul 0.890843777 0.890843777 1.781687554 0.000000000
px 0 0.786877517 0.786877517 1.573755034 0.000000000
py 0 0.787069304 0.787069304 1.574138608 0.000000000
pz 0 0.779775813 0.779775813 1.559551626 0.000000000
sum over m 2.353722634 2.353722634 4.707445268 0.000000000
px 1 -0.008739259 -0.008739259 -0.017478518 0.000000000
py 1 -0.008737633 -0.008737633 -0.017475265 0.000000000
pz 1 -0.006463380 -0.006463380 -0.012926759 0.000000000
sum over m -0.023940271 -0.023940271 -0.047880542 0.000000000
sum over m+mul 2.329782363 2.329782363 4.659564726 0.000000000
d3z^2-r^2 0 -0.006389979 -0.006389979 -0.012779958 0.000000000
dx^2-y^2 0 -0.005057691 -0.005057691 -0.010115383 0.000000000
dxy 0 -0.005433292 -0.005433292 -0.010866584 0.000000000
dxz 0 -0.006930501 -0.006930501 -0.013861002 0.000000000
dyz 0 -0.006928514 -0.006928514 -0.013857028 0.000000000
sum over m -0.030739977 -0.030739977 -0.061479954 0.000000000
sum over m+mul -0.030739977 -0.030739977 -0.061479954 0.000000000
139 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000770732 1.000770732 2.001541464 0.000000000
sum over m 1.000770732 1.000770732 2.001541464 0.000000000
s 1 0.207415354 0.207415354 0.414830707 0.000000000
sum over m 0.207415354 0.207415354 0.414830707 0.000000000
s 2 0.014725018 0.014725018 0.029450037 0.000000000
sum over m 0.014725018 0.014725018 0.029450037 0.000000000
sum over m+mul 1.222911104 1.222911104 2.445822208 0.000000000
px 0 1.006377070 1.006377070 2.012754140 0.000000000
py 0 1.006363497 1.006363497 2.012726993 0.000000000
pz 0 1.006197347 1.006197347 2.012394695 0.000000000
sum over m 3.018937914 3.018937914 6.037875828 0.000000000
px 1 0.065435974 0.065435974 0.130871948 0.000000000
py 1 0.065430544 0.065430544 0.130861088 0.000000000
pz 1 0.040378093 0.040378093 0.080756187 0.000000000
sum over m 0.171244612 0.171244612 0.342489224 0.000000000
sum over m+mul 3.190182526 3.190182526 6.380365052 0.000000000
d3z^2-r^2 0 0.196300924 0.196300924 0.392601848 0.000000000
dx^2-y^2 0 0.201509474 0.201509474 0.403018949 0.000000000
dxy 0 0.250938064 0.250938064 0.501876129 0.000000000
dxz 0 0.268491138 0.268491138 0.536982276 0.000000000
dyz 0 0.268515406 0.268515406 0.537030813 0.000000000
sum over m 1.185755007 1.185755007 2.371510014 0.000000000
d3z^2-r^2 1 0.003475239 0.003475239 0.006950478 0.000000000
dx^2-y^2 1 -0.004476268 -0.004476268 -0.008952536 0.000000000
dxy 1 0.015340008 0.015340008 0.030680016 0.000000000
dxz 1 0.003489582 0.003489582 0.006979164 0.000000000
dyz 1 0.003489873 0.003489873 0.006979746 0.000000000
sum over m 0.021318434 0.021318434 0.042636868 0.000000000
sum over m+mul 1.207073441 1.207073441 2.414146882 0.000000000
140 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778689 1.000778689 2.001557378 0.000000000
sum over m 1.000778689 1.000778689 2.001557378 0.000000000
s 1 0.207427937 0.207427937 0.414855874 0.000000000
sum over m 0.207427937 0.207427937 0.414855874 0.000000000
s 2 0.014724840 0.014724840 0.029449681 0.000000000
sum over m 0.014724840 0.014724840 0.029449681 0.000000000
sum over m+mul 1.222931466 1.222931466 2.445862933 0.000000000
px 0 1.006378244 1.006378244 2.012756488 0.000000000
py 0 1.006362938 1.006362938 2.012725875 0.000000000
pz 0 1.006192809 1.006192809 2.012385618 0.000000000
sum over m 3.018933990 3.018933990 6.037867981 0.000000000
px 1 0.065430970 0.065430970 0.130861940 0.000000000
py 1 0.065445106 0.065445106 0.130890212 0.000000000
pz 1 0.040376747 0.040376747 0.080753493 0.000000000
sum over m 0.171252822 0.171252822 0.342505644 0.000000000
sum over m+mul 3.190186813 3.190186813 6.380373625 0.000000000
d3z^2-r^2 0 0.196306657 0.196306657 0.392613314 0.000000000
dx^2-y^2 0 0.201501412 0.201501412 0.403002823 0.000000000
dxy 0 0.250950786 0.250950786 0.501901572 0.000000000
dxz 0 0.268477950 0.268477950 0.536955900 0.000000000
dyz 0 0.268511716 0.268511716 0.537023433 0.000000000
sum over m 1.185748521 1.185748521 2.371497042 0.000000000
d3z^2-r^2 1 0.003474151 0.003474151 0.006948302 0.000000000
dx^2-y^2 1 -0.004476884 -0.004476884 -0.008953767 0.000000000
dxy 1 0.015339214 0.015339214 0.030678429 0.000000000
dxz 1 0.003488727 0.003488727 0.006977455 0.000000000
dyz 1 0.003491773 0.003491773 0.006983546 0.000000000
sum over m 0.021316982 0.021316982 0.042633964 0.000000000
sum over m+mul 1.207065503 1.207065503 2.414131006 0.000000000
141 O Up spin Down spin Sum Diff
multiple
s 0 0.893895019 0.893895019 1.787790038 0.000000000
sum over m 0.893895019 0.893895019 1.787790038 0.000000000
s 1 -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m+mul 0.890852483 0.890852483 1.781704966 0.000000000
px 0 0.787056712 0.787056712 1.574113423 0.000000000
py 0 0.786966454 0.786966454 1.573932908 0.000000000
pz 0 0.779743447 0.779743447 1.559486895 0.000000000
sum over m 2.353766613 2.353766613 4.707533225 0.000000000
px 1 -0.008739472 -0.008739472 -0.017478944 0.000000000
py 1 -0.008730480 -0.008730480 -0.017460960 0.000000000
pz 1 -0.006458433 -0.006458433 -0.012916866 0.000000000
sum over m -0.023928385 -0.023928385 -0.047856770 0.000000000
sum over m+mul 2.329838228 2.329838228 4.659676455 0.000000000
d3z^2-r^2 0 -0.006389905 -0.006389905 -0.012779810 0.000000000
dx^2-y^2 0 -0.005056718 -0.005056718 -0.010113437 0.000000000
dxy 0 -0.005434763 -0.005434763 -0.010869526 0.000000000
dxz 0 -0.006925027 -0.006925027 -0.013850053 0.000000000
dyz 0 -0.006929867 -0.006929867 -0.013859734 0.000000000
sum over m -0.030736281 -0.030736281 -0.061472561 0.000000000
sum over m+mul -0.030736281 -0.030736281 -0.061472561 0.000000000
142 O Up spin Down spin Sum Diff
multiple
s 0 0.893874732 0.893874732 1.787749464 0.000000000
sum over m 0.893874732 0.893874732 1.787749464 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m+mul 0.890832556 0.890832556 1.781665113 0.000000000
px 0 0.787008076 0.787008076 1.574016153 0.000000000
py 0 0.786910520 0.786910520 1.573821040 0.000000000
pz 0 0.779811493 0.779811493 1.559622987 0.000000000
sum over m 2.353730090 2.353730090 4.707460179 0.000000000
px 1 -0.008738822 -0.008738822 -0.017477644 0.000000000
py 1 -0.008727624 -0.008727624 -0.017455248 0.000000000
pz 1 -0.006463367 -0.006463367 -0.012926734 0.000000000
sum over m -0.023929813 -0.023929813 -0.047859626 0.000000000
sum over m+mul 2.329800277 2.329800277 4.659600554 0.000000000
d3z^2-r^2 0 -0.006389922 -0.006389922 -0.012779845 0.000000000
dx^2-y^2 0 -0.005059210 -0.005059210 -0.010118420 0.000000000
dxy 0 -0.005433824 -0.005433824 -0.010867647 0.000000000
dxz 0 -0.006928883 -0.006928883 -0.013857765 0.000000000
dyz 0 -0.006932427 -0.006932427 -0.013864854 0.000000000
sum over m -0.030744266 -0.030744266 -0.061488531 0.000000000
sum over m+mul -0.030744266 -0.030744266 -0.061488531 0.000000000
143 O Up spin Down spin Sum Diff
multiple
s 0 0.893881298 0.893881298 1.787762596 0.000000000
sum over m 0.893881298 0.893881298 1.787762596 0.000000000
s 1 -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m+mul 0.890838813 0.890838813 1.781677626 0.000000000
px 0 0.786978393 0.786978393 1.573956787 0.000000000
py 0 0.786977266 0.786977266 1.573954532 0.000000000
pz 0 0.779778276 0.779778276 1.559556553 0.000000000
sum over m 2.353733936 2.353733936 4.707467872 0.000000000
px 1 -0.008737772 -0.008737772 -0.017475544 0.000000000
py 1 -0.008729574 -0.008729574 -0.017459148 0.000000000
pz 1 -0.006460567 -0.006460567 -0.012921134 0.000000000
sum over m -0.023927913 -0.023927913 -0.047855826 0.000000000
sum over m+mul 2.329806023 2.329806023 4.659612046 0.000000000
d3z^2-r^2 0 -0.006389700 -0.006389700 -0.012779401 0.000000000
dx^2-y^2 0 -0.005057871 -0.005057871 -0.010115741 0.000000000
dxy 0 -0.005433956 -0.005433956 -0.010867912 0.000000000
dxz 0 -0.006927692 -0.006927692 -0.013855384 0.000000000
dyz 0 -0.006930158 -0.006930158 -0.013860316 0.000000000
sum over m -0.030739377 -0.030739377 -0.061478754 0.000000000
sum over m+mul -0.030739377 -0.030739377 -0.061478754 0.000000000
144 O Up spin Down spin Sum Diff
multiple
s 0 0.893886339 0.893886339 1.787772678 0.000000000
sum over m 0.893886339 0.893886339 1.787772678 0.000000000
s 1 -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m+mul 0.890843777 0.890843777 1.781687554 0.000000000
px 0 0.786877518 0.786877518 1.573755035 0.000000000
py 0 0.787069304 0.787069304 1.574138608 0.000000000
pz 0 0.779775813 0.779775813 1.559551626 0.000000000
sum over m 2.353722634 2.353722634 4.707445269 0.000000000
px 1 -0.008739259 -0.008739259 -0.017478518 0.000000000
py 1 -0.008737633 -0.008737633 -0.017475265 0.000000000
pz 1 -0.006463380 -0.006463380 -0.012926759 0.000000000
sum over m -0.023940271 -0.023940271 -0.047880542 0.000000000
sum over m+mul 2.329782363 2.329782363 4.659564727 0.000000000
d3z^2-r^2 0 -0.006389979 -0.006389979 -0.012779958 0.000000000
dx^2-y^2 0 -0.005057691 -0.005057691 -0.010115383 0.000000000
dxy 0 -0.005433292 -0.005433292 -0.010866584 0.000000000
dxz 0 -0.006930501 -0.006930501 -0.013861002 0.000000000
dyz 0 -0.006928514 -0.006928514 -0.013857028 0.000000000
sum over m -0.030739977 -0.030739977 -0.061479954 0.000000000
sum over m+mul -0.030739977 -0.030739977 -0.061479954 0.000000000
145 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000770732 1.000770732 2.001541464 0.000000000
sum over m 1.000770732 1.000770732 2.001541464 0.000000000
s 1 0.207415354 0.207415354 0.414830707 0.000000000
sum over m 0.207415354 0.207415354 0.414830707 0.000000000
s 2 0.014725018 0.014725018 0.029450037 0.000000000
sum over m 0.014725018 0.014725018 0.029450037 0.000000000
sum over m+mul 1.222911104 1.222911104 2.445822208 0.000000000
px 0 1.006377070 1.006377070 2.012754140 0.000000000
py 0 1.006363497 1.006363497 2.012726994 0.000000000
pz 0 1.006197348 1.006197348 2.012394695 0.000000000
sum over m 3.018937914 3.018937914 6.037875828 0.000000000
px 1 0.065435974 0.065435974 0.130871948 0.000000000
py 1 0.065430544 0.065430544 0.130861089 0.000000000
pz 1 0.040378093 0.040378093 0.080756187 0.000000000
sum over m 0.171244612 0.171244612 0.342489224 0.000000000
sum over m+mul 3.190182526 3.190182526 6.380365052 0.000000000
d3z^2-r^2 0 0.196300924 0.196300924 0.392601848 0.000000000
dx^2-y^2 0 0.201509474 0.201509474 0.403018948 0.000000000
dxy 0 0.250938064 0.250938064 0.501876129 0.000000000
dxz 0 0.268491138 0.268491138 0.536982276 0.000000000
dyz 0 0.268515406 0.268515406 0.537030813 0.000000000
sum over m 1.185755007 1.185755007 2.371510014 0.000000000
d3z^2-r^2 1 0.003475239 0.003475239 0.006950478 0.000000000
dx^2-y^2 1 -0.004476268 -0.004476268 -0.008952536 0.000000000
dxy 1 0.015340008 0.015340008 0.030680016 0.000000000
dxz 1 0.003489582 0.003489582 0.006979164 0.000000000
dyz 1 0.003489873 0.003489873 0.006979746 0.000000000
sum over m 0.021318434 0.021318434 0.042636868 0.000000000
sum over m+mul 1.207073441 1.207073441 2.414146882 0.000000000
146 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778689 1.000778689 2.001557378 0.000000000
sum over m 1.000778689 1.000778689 2.001557378 0.000000000
s 1 0.207427937 0.207427937 0.414855875 0.000000000
sum over m 0.207427937 0.207427937 0.414855875 0.000000000
s 2 0.014724840 0.014724840 0.029449681 0.000000000
sum over m 0.014724840 0.014724840 0.029449681 0.000000000
sum over m+mul 1.222931467 1.222931467 2.445862933 0.000000000
px 0 1.006378244 1.006378244 2.012756488 0.000000000
py 0 1.006362938 1.006362938 2.012725875 0.000000000
pz 0 1.006192809 1.006192809 2.012385617 0.000000000
sum over m 3.018933990 3.018933990 6.037867981 0.000000000
px 1 0.065430970 0.065430970 0.130861940 0.000000000
py 1 0.065445106 0.065445106 0.130890212 0.000000000
pz 1 0.040376747 0.040376747 0.080753493 0.000000000
sum over m 0.171252823 0.171252823 0.342505646 0.000000000
sum over m+mul 3.190186813 3.190186813 6.380373626 0.000000000
d3z^2-r^2 0 0.196306657 0.196306657 0.392613314 0.000000000
dx^2-y^2 0 0.201501412 0.201501412 0.403002824 0.000000000
dxy 0 0.250950786 0.250950786 0.501901572 0.000000000
dxz 0 0.268477950 0.268477950 0.536955900 0.000000000
dyz 0 0.268511716 0.268511716 0.537023433 0.000000000
sum over m 1.185748521 1.185748521 2.371497042 0.000000000
d3z^2-r^2 1 0.003474151 0.003474151 0.006948302 0.000000000
dx^2-y^2 1 -0.004476884 -0.004476884 -0.008953767 0.000000000
dxy 1 0.015339214 0.015339214 0.030678429 0.000000000
dxz 1 0.003488727 0.003488727 0.006977455 0.000000000
dyz 1 0.003491773 0.003491773 0.006983546 0.000000000
sum over m 0.021316982 0.021316982 0.042633964 0.000000000
sum over m+mul 1.207065503 1.207065503 2.414131007 0.000000000
147 O Up spin Down spin Sum Diff
multiple
s 0 0.893895019 0.893895019 1.787790038 0.000000000
sum over m 0.893895019 0.893895019 1.787790038 0.000000000
s 1 -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m+mul 0.890852483 0.890852483 1.781704966 0.000000000
px 0 0.787056711 0.787056711 1.574113423 0.000000000
py 0 0.786966454 0.786966454 1.573932907 0.000000000
pz 0 0.779743447 0.779743447 1.559486895 0.000000000
sum over m 2.353766613 2.353766613 4.707533225 0.000000000
px 1 -0.008739472 -0.008739472 -0.017478944 0.000000000
py 1 -0.008730480 -0.008730480 -0.017460960 0.000000000
pz 1 -0.006458433 -0.006458433 -0.012916866 0.000000000
sum over m -0.023928385 -0.023928385 -0.047856770 0.000000000
sum over m+mul 2.329838227 2.329838227 4.659676455 0.000000000
d3z^2-r^2 0 -0.006389905 -0.006389905 -0.012779810 0.000000000
dx^2-y^2 0 -0.005056718 -0.005056718 -0.010113437 0.000000000
dxy 0 -0.005434763 -0.005434763 -0.010869526 0.000000000
dxz 0 -0.006925027 -0.006925027 -0.013850053 0.000000000
dyz 0 -0.006929867 -0.006929867 -0.013859734 0.000000000
sum over m -0.030736281 -0.030736281 -0.061472561 0.000000000
sum over m+mul -0.030736281 -0.030736281 -0.061472561 0.000000000
148 O Up spin Down spin Sum Diff
multiple
s 0 0.893874732 0.893874732 1.787749464 0.000000000
sum over m 0.893874732 0.893874732 1.787749464 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m+mul 0.890832556 0.890832556 1.781665113 0.000000000
px 0 0.787008076 0.787008076 1.574016153 0.000000000
py 0 0.786910520 0.786910520 1.573821040 0.000000000
pz 0 0.779811494 0.779811494 1.559622987 0.000000000
sum over m 2.353730090 2.353730090 4.707460180 0.000000000
px 1 -0.008738822 -0.008738822 -0.017477644 0.000000000
py 1 -0.008727624 -0.008727624 -0.017455248 0.000000000
pz 1 -0.006463367 -0.006463367 -0.012926734 0.000000000
sum over m -0.023929813 -0.023929813 -0.047859626 0.000000000
sum over m+mul 2.329800277 2.329800277 4.659600554 0.000000000
d3z^2-r^2 0 -0.006389922 -0.006389922 -0.012779845 0.000000000
dx^2-y^2 0 -0.005059210 -0.005059210 -0.010118420 0.000000000
dxy 0 -0.005433824 -0.005433824 -0.010867647 0.000000000
dxz 0 -0.006928883 -0.006928883 -0.013857765 0.000000000
dyz 0 -0.006932427 -0.006932427 -0.013864854 0.000000000
sum over m -0.030744266 -0.030744266 -0.061488531 0.000000000
sum over m+mul -0.030744266 -0.030744266 -0.061488531 0.000000000
149 O Up spin Down spin Sum Diff
multiple
s 0 0.893881298 0.893881298 1.787762596 0.000000000
sum over m 0.893881298 0.893881298 1.787762596 0.000000000
s 1 -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m+mul 0.890838813 0.890838813 1.781677626 0.000000000
px 0 0.786978393 0.786978393 1.573956786 0.000000000
py 0 0.786977266 0.786977266 1.573954532 0.000000000
pz 0 0.779778276 0.779778276 1.559556552 0.000000000
sum over m 2.353733935 2.353733935 4.707467871 0.000000000
px 1 -0.008737772 -0.008737772 -0.017475544 0.000000000
py 1 -0.008729574 -0.008729574 -0.017459148 0.000000000
pz 1 -0.006460567 -0.006460567 -0.012921134 0.000000000
sum over m -0.023927913 -0.023927913 -0.047855826 0.000000000
sum over m+mul 2.329806022 2.329806022 4.659612045 0.000000000
d3z^2-r^2 0 -0.006389700 -0.006389700 -0.012779401 0.000000000
dx^2-y^2 0 -0.005057871 -0.005057871 -0.010115741 0.000000000
dxy 0 -0.005433956 -0.005433956 -0.010867912 0.000000000
dxz 0 -0.006927692 -0.006927692 -0.013855384 0.000000000
dyz 0 -0.006930158 -0.006930158 -0.013860316 0.000000000
sum over m -0.030739377 -0.030739377 -0.061478754 0.000000000
sum over m+mul -0.030739377 -0.030739377 -0.061478754 0.000000000
150 O Up spin Down spin Sum Diff
multiple
s 0 0.893886339 0.893886339 1.787772678 0.000000000
sum over m 0.893886339 0.893886339 1.787772678 0.000000000
s 1 -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m+mul 0.890843777 0.890843777 1.781687554 0.000000000
px 0 0.786877517 0.786877517 1.573755034 0.000000000
py 0 0.787069304 0.787069304 1.574138608 0.000000000
pz 0 0.779775813 0.779775813 1.559551627 0.000000000
sum over m 2.353722634 2.353722634 4.707445269 0.000000000
px 1 -0.008739259 -0.008739259 -0.017478518 0.000000000
py 1 -0.008737633 -0.008737633 -0.017475265 0.000000000
pz 1 -0.006463380 -0.006463380 -0.012926759 0.000000000
sum over m -0.023940271 -0.023940271 -0.047880542 0.000000000
sum over m+mul 2.329782363 2.329782363 4.659564727 0.000000000
d3z^2-r^2 0 -0.006389979 -0.006389979 -0.012779958 0.000000000
dx^2-y^2 0 -0.005057691 -0.005057691 -0.010115383 0.000000000
dxy 0 -0.005433292 -0.005433292 -0.010866584 0.000000000
dxz 0 -0.006930501 -0.006930501 -0.013861002 0.000000000
dyz 0 -0.006928514 -0.006928514 -0.013857028 0.000000000
sum over m -0.030739977 -0.030739977 -0.061479954 0.000000000
sum over m+mul -0.030739977 -0.030739977 -0.061479954 0.000000000
151 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000770732 1.000770732 2.001541464 0.000000000
sum over m 1.000770732 1.000770732 2.001541464 0.000000000
s 1 0.207415354 0.207415354 0.414830707 0.000000000
sum over m 0.207415354 0.207415354 0.414830707 0.000000000
s 2 0.014725018 0.014725018 0.029450037 0.000000000
sum over m 0.014725018 0.014725018 0.029450037 0.000000000
sum over m+mul 1.222911104 1.222911104 2.445822208 0.000000000
px 0 1.006377070 1.006377070 2.012754140 0.000000000
py 0 1.006363497 1.006363497 2.012726994 0.000000000
pz 0 1.006197347 1.006197347 2.012394695 0.000000000
sum over m 3.018937914 3.018937914 6.037875828 0.000000000
px 1 0.065435974 0.065435974 0.130871948 0.000000000
py 1 0.065430544 0.065430544 0.130861088 0.000000000
pz 1 0.040378093 0.040378093 0.080756186 0.000000000
sum over m 0.171244611 0.171244611 0.342489223 0.000000000
sum over m+mul 3.190182525 3.190182525 6.380365051 0.000000000
d3z^2-r^2 0 0.196300924 0.196300924 0.392601848 0.000000000
dx^2-y^2 0 0.201509474 0.201509474 0.403018948 0.000000000
dxy 0 0.250938064 0.250938064 0.501876129 0.000000000
dxz 0 0.268491138 0.268491138 0.536982277 0.000000000
dyz 0 0.268515406 0.268515406 0.537030813 0.000000000
sum over m 1.185755007 1.185755007 2.371510014 0.000000000
d3z^2-r^2 1 0.003475239 0.003475239 0.006950478 0.000000000
dx^2-y^2 1 -0.004476268 -0.004476268 -0.008952536 0.000000000
dxy 1 0.015340008 0.015340008 0.030680016 0.000000000
dxz 1 0.003489582 0.003489582 0.006979164 0.000000000
dyz 1 0.003489873 0.003489873 0.006979746 0.000000000
sum over m 0.021318434 0.021318434 0.042636868 0.000000000
sum over m+mul 1.207073441 1.207073441 2.414146882 0.000000000
152 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778689 1.000778689 2.001557378 0.000000000
sum over m 1.000778689 1.000778689 2.001557378 0.000000000
s 1 0.207427937 0.207427937 0.414855875 0.000000000
sum over m 0.207427937 0.207427937 0.414855875 0.000000000
s 2 0.014724840 0.014724840 0.029449681 0.000000000
sum over m 0.014724840 0.014724840 0.029449681 0.000000000
sum over m+mul 1.222931467 1.222931467 2.445862933 0.000000000
px 0 1.006378244 1.006378244 2.012756488 0.000000000
py 0 1.006362938 1.006362938 2.012725875 0.000000000
pz 0 1.006192809 1.006192809 2.012385617 0.000000000
sum over m 3.018933990 3.018933990 6.037867981 0.000000000
px 1 0.065430970 0.065430970 0.130861940 0.000000000
py 1 0.065445106 0.065445106 0.130890212 0.000000000
pz 1 0.040376746 0.040376746 0.080753493 0.000000000
sum over m 0.171252823 0.171252823 0.342505645 0.000000000
sum over m+mul 3.190186813 3.190186813 6.380373626 0.000000000
d3z^2-r^2 0 0.196306657 0.196306657 0.392613314 0.000000000
dx^2-y^2 0 0.201501412 0.201501412 0.403002824 0.000000000
dxy 0 0.250950786 0.250950786 0.501901572 0.000000000
dxz 0 0.268477950 0.268477950 0.536955900 0.000000000
dyz 0 0.268511717 0.268511717 0.537023433 0.000000000
sum over m 1.185748522 1.185748522 2.371497043 0.000000000
d3z^2-r^2 1 0.003474151 0.003474151 0.006948302 0.000000000
dx^2-y^2 1 -0.004476884 -0.004476884 -0.008953767 0.000000000
dxy 1 0.015339214 0.015339214 0.030678429 0.000000000
dxz 1 0.003488727 0.003488727 0.006977455 0.000000000
dyz 1 0.003491773 0.003491773 0.006983546 0.000000000
sum over m 0.021316982 0.021316982 0.042633964 0.000000000
sum over m+mul 1.207065504 1.207065504 2.414131007 0.000000000
153 O Up spin Down spin Sum Diff
multiple
s 0 0.893895019 0.893895019 1.787790038 0.000000000
sum over m 0.893895019 0.893895019 1.787790038 0.000000000
s 1 -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m+mul 0.890852483 0.890852483 1.781704966 0.000000000
px 0 0.787056712 0.787056712 1.574113423 0.000000000
py 0 0.786966454 0.786966454 1.573932908 0.000000000
pz 0 0.779743447 0.779743447 1.559486894 0.000000000
sum over m 2.353766613 2.353766613 4.707533225 0.000000000
px 1 -0.008739472 -0.008739472 -0.017478944 0.000000000
py 1 -0.008730480 -0.008730480 -0.017460960 0.000000000
pz 1 -0.006458433 -0.006458433 -0.012916866 0.000000000
sum over m -0.023928385 -0.023928385 -0.047856770 0.000000000
sum over m+mul 2.329838227 2.329838227 4.659676455 0.000000000
d3z^2-r^2 0 -0.006389905 -0.006389905 -0.012779810 0.000000000
dx^2-y^2 0 -0.005056718 -0.005056718 -0.010113437 0.000000000
dxy 0 -0.005434763 -0.005434763 -0.010869526 0.000000000
dxz 0 -0.006925027 -0.006925027 -0.013850053 0.000000000
dyz 0 -0.006929867 -0.006929867 -0.013859734 0.000000000
sum over m -0.030736281 -0.030736281 -0.061472561 0.000000000
sum over m+mul -0.030736281 -0.030736281 -0.061472561 0.000000000
154 O Up spin Down spin Sum Diff
multiple
s 0 0.893874732 0.893874732 1.787749464 0.000000000
sum over m 0.893874732 0.893874732 1.787749464 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m+mul 0.890832556 0.890832556 1.781665113 0.000000000
px 0 0.787008077 0.787008077 1.574016153 0.000000000
py 0 0.786910520 0.786910520 1.573821040 0.000000000
pz 0 0.779811493 0.779811493 1.559622986 0.000000000
sum over m 2.353730090 2.353730090 4.707460179 0.000000000
px 1 -0.008738822 -0.008738822 -0.017477644 0.000000000
py 1 -0.008727624 -0.008727624 -0.017455248 0.000000000
pz 1 -0.006463367 -0.006463367 -0.012926734 0.000000000
sum over m -0.023929813 -0.023929813 -0.047859626 0.000000000
sum over m+mul 2.329800277 2.329800277 4.659600553 0.000000000
d3z^2-r^2 0 -0.006389922 -0.006389922 -0.012779845 0.000000000
dx^2-y^2 0 -0.005059210 -0.005059210 -0.010118420 0.000000000
dxy 0 -0.005433824 -0.005433824 -0.010867647 0.000000000
dxz 0 -0.006928883 -0.006928883 -0.013857765 0.000000000
dyz 0 -0.006932427 -0.006932427 -0.013864854 0.000000000
sum over m -0.030744266 -0.030744266 -0.061488531 0.000000000
sum over m+mul -0.030744266 -0.030744266 -0.061488531 0.000000000
155 O Up spin Down spin Sum Diff
multiple
s 0 0.893881298 0.893881298 1.787762596 0.000000000
sum over m 0.893881298 0.893881298 1.787762596 0.000000000
s 1 -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m+mul 0.890838813 0.890838813 1.781677626 0.000000000
px 0 0.786978393 0.786978393 1.573956786 0.000000000
py 0 0.786977266 0.786977266 1.573954532 0.000000000
pz 0 0.779778276 0.779778276 1.559556552 0.000000000
sum over m 2.353733935 2.353733935 4.707467870 0.000000000
px 1 -0.008737772 -0.008737772 -0.017475544 0.000000000
py 1 -0.008729574 -0.008729574 -0.017459148 0.000000000
pz 1 -0.006460567 -0.006460567 -0.012921134 0.000000000
sum over m -0.023927913 -0.023927913 -0.047855826 0.000000000
sum over m+mul 2.329806022 2.329806022 4.659612044 0.000000000
d3z^2-r^2 0 -0.006389700 -0.006389700 -0.012779401 0.000000000
dx^2-y^2 0 -0.005057871 -0.005057871 -0.010115741 0.000000000
dxy 0 -0.005433956 -0.005433956 -0.010867912 0.000000000
dxz 0 -0.006927692 -0.006927692 -0.013855384 0.000000000
dyz 0 -0.006930158 -0.006930158 -0.013860316 0.000000000
sum over m -0.030739377 -0.030739377 -0.061478754 0.000000000
sum over m+mul -0.030739377 -0.030739377 -0.061478754 0.000000000
156 O Up spin Down spin Sum Diff
multiple
s 0 0.893886339 0.893886339 1.787772678 0.000000000
sum over m 0.893886339 0.893886339 1.787772678 0.000000000
s 1 -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m+mul 0.890843777 0.890843777 1.781687554 0.000000000
px 0 0.786877517 0.786877517 1.573755034 0.000000000
py 0 0.787069304 0.787069304 1.574138608 0.000000000
pz 0 0.779775813 0.779775813 1.559551626 0.000000000
sum over m 2.353722634 2.353722634 4.707445269 0.000000000
px 1 -0.008739259 -0.008739259 -0.017478518 0.000000000
py 1 -0.008737633 -0.008737633 -0.017475265 0.000000000
pz 1 -0.006463380 -0.006463380 -0.012926759 0.000000000
sum over m -0.023940271 -0.023940271 -0.047880542 0.000000000
sum over m+mul 2.329782363 2.329782363 4.659564727 0.000000000
d3z^2-r^2 0 -0.006389979 -0.006389979 -0.012779958 0.000000000
dx^2-y^2 0 -0.005057691 -0.005057691 -0.010115383 0.000000000
dxy 0 -0.005433292 -0.005433292 -0.010866584 0.000000000
dxz 0 -0.006930501 -0.006930501 -0.013861002 0.000000000
dyz 0 -0.006928514 -0.006928514 -0.013857028 0.000000000
sum over m -0.030739977 -0.030739977 -0.061479954 0.000000000
sum over m+mul -0.030739977 -0.030739977 -0.061479954 0.000000000
157 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000770732 1.000770732 2.001541464 0.000000000
sum over m 1.000770732 1.000770732 2.001541464 0.000000000
s 1 0.207415354 0.207415354 0.414830707 0.000000000
sum over m 0.207415354 0.207415354 0.414830707 0.000000000
s 2 0.014725018 0.014725018 0.029450037 0.000000000
sum over m 0.014725018 0.014725018 0.029450037 0.000000000
sum over m+mul 1.222911104 1.222911104 2.445822208 0.000000000
px 0 1.006377070 1.006377070 2.012754140 0.000000000
py 0 1.006363497 1.006363497 2.012726994 0.000000000
pz 0 1.006197348 1.006197348 2.012394695 0.000000000
sum over m 3.018937914 3.018937914 6.037875828 0.000000000
px 1 0.065435974 0.065435974 0.130871948 0.000000000
py 1 0.065430544 0.065430544 0.130861088 0.000000000
pz 1 0.040378093 0.040378093 0.080756187 0.000000000
sum over m 0.171244611 0.171244611 0.342489223 0.000000000
sum over m+mul 3.190182526 3.190182526 6.380365051 0.000000000
d3z^2-r^2 0 0.196300924 0.196300924 0.392601847 0.000000000
dx^2-y^2 0 0.201509474 0.201509474 0.403018949 0.000000000
dxy 0 0.250938064 0.250938064 0.501876129 0.000000000
dxz 0 0.268491138 0.268491138 0.536982277 0.000000000
dyz 0 0.268515407 0.268515407 0.537030813 0.000000000
sum over m 1.185755007 1.185755007 2.371510014 0.000000000
d3z^2-r^2 1 0.003475239 0.003475239 0.006950478 0.000000000
dx^2-y^2 1 -0.004476268 -0.004476268 -0.008952536 0.000000000
dxy 1 0.015340008 0.015340008 0.030680016 0.000000000
dxz 1 0.003489582 0.003489582 0.006979164 0.000000000
dyz 1 0.003489873 0.003489873 0.006979746 0.000000000
sum over m 0.021318434 0.021318434 0.042636868 0.000000000
sum over m+mul 1.207073441 1.207073441 2.414146882 0.000000000
158 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778689 1.000778689 2.001557378 0.000000000
sum over m 1.000778689 1.000778689 2.001557378 0.000000000
s 1 0.207427937 0.207427937 0.414855875 0.000000000
sum over m 0.207427937 0.207427937 0.414855875 0.000000000
s 2 0.014724840 0.014724840 0.029449681 0.000000000
sum over m 0.014724840 0.014724840 0.029449681 0.000000000
sum over m+mul 1.222931467 1.222931467 2.445862933 0.000000000
px 0 1.006378244 1.006378244 2.012756488 0.000000000
py 0 1.006362938 1.006362938 2.012725875 0.000000000
pz 0 1.006192809 1.006192809 2.012385618 0.000000000
sum over m 3.018933990 3.018933990 6.037867981 0.000000000
px 1 0.065430970 0.065430970 0.130861940 0.000000000
py 1 0.065445106 0.065445106 0.130890212 0.000000000
pz 1 0.040376746 0.040376746 0.080753493 0.000000000
sum over m 0.171252822 0.171252822 0.342505645 0.000000000
sum over m+mul 3.190186813 3.190186813 6.380373626 0.000000000
d3z^2-r^2 0 0.196306657 0.196306657 0.392613314 0.000000000
dx^2-y^2 0 0.201501412 0.201501412 0.403002824 0.000000000
dxy 0 0.250950786 0.250950786 0.501901571 0.000000000
dxz 0 0.268477950 0.268477950 0.536955900 0.000000000
dyz 0 0.268511716 0.268511716 0.537023433 0.000000000
sum over m 1.185748521 1.185748521 2.371497042 0.000000000
d3z^2-r^2 1 0.003474151 0.003474151 0.006948302 0.000000000
dx^2-y^2 1 -0.004476884 -0.004476884 -0.008953767 0.000000000
dxy 1 0.015339214 0.015339214 0.030678429 0.000000000
dxz 1 0.003488727 0.003488727 0.006977455 0.000000000
dyz 1 0.003491773 0.003491773 0.006983546 0.000000000
sum over m 0.021316982 0.021316982 0.042633964 0.000000000
sum over m+mul 1.207065503 1.207065503 2.414131006 0.000000000
159 O Up spin Down spin Sum Diff
multiple
s 0 0.893895019 0.893895019 1.787790038 0.000000000
sum over m 0.893895019 0.893895019 1.787790038 0.000000000
s 1 -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m+mul 0.890852483 0.890852483 1.781704965 0.000000000
px 0 0.787056712 0.787056712 1.574113423 0.000000000
py 0 0.786966454 0.786966454 1.573932907 0.000000000
pz 0 0.779743447 0.779743447 1.559486894 0.000000000
sum over m 2.353766612 2.353766612 4.707533225 0.000000000
px 1 -0.008739472 -0.008739472 -0.017478944 0.000000000
py 1 -0.008730480 -0.008730480 -0.017460960 0.000000000
pz 1 -0.006458433 -0.006458433 -0.012916866 0.000000000
sum over m -0.023928385 -0.023928385 -0.047856770 0.000000000
sum over m+mul 2.329838227 2.329838227 4.659676455 0.000000000
d3z^2-r^2 0 -0.006389905 -0.006389905 -0.012779810 0.000000000
dx^2-y^2 0 -0.005056718 -0.005056718 -0.010113437 0.000000000
dxy 0 -0.005434763 -0.005434763 -0.010869526 0.000000000
dxz 0 -0.006925027 -0.006925027 -0.013850053 0.000000000
dyz 0 -0.006929867 -0.006929867 -0.013859734 0.000000000
sum over m -0.030736281 -0.030736281 -0.061472561 0.000000000
sum over m+mul -0.030736281 -0.030736281 -0.061472561 0.000000000
160 O Up spin Down spin Sum Diff
multiple
s 0 0.893874732 0.893874732 1.787749464 0.000000000
sum over m 0.893874732 0.893874732 1.787749464 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m+mul 0.890832556 0.890832556 1.781665113 0.000000000
px 0 0.787008076 0.787008076 1.574016153 0.000000000
py 0 0.786910520 0.786910520 1.573821040 0.000000000
pz 0 0.779811493 0.779811493 1.559622987 0.000000000
sum over m 2.353730090 2.353730090 4.707460179 0.000000000
px 1 -0.008738822 -0.008738822 -0.017477644 0.000000000
py 1 -0.008727624 -0.008727624 -0.017455248 0.000000000
pz 1 -0.006463367 -0.006463367 -0.012926734 0.000000000
sum over m -0.023929813 -0.023929813 -0.047859626 0.000000000
sum over m+mul 2.329800277 2.329800277 4.659600554 0.000000000
d3z^2-r^2 0 -0.006389922 -0.006389922 -0.012779845 0.000000000
dx^2-y^2 0 -0.005059210 -0.005059210 -0.010118420 0.000000000
dxy 0 -0.005433824 -0.005433824 -0.010867647 0.000000000
dxz 0 -0.006928883 -0.006928883 -0.013857765 0.000000000
dyz 0 -0.006932427 -0.006932427 -0.013864854 0.000000000
sum over m -0.030744266 -0.030744266 -0.061488531 0.000000000
sum over m+mul -0.030744266 -0.030744266 -0.061488531 0.000000000
161 O Up spin Down spin Sum Diff
multiple
s 0 0.893881298 0.893881298 1.787762596 0.000000000
sum over m 0.893881298 0.893881298 1.787762596 0.000000000
s 1 -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m+mul 0.890838813 0.890838813 1.781677626 0.000000000
px 0 0.786978393 0.786978393 1.573956786 0.000000000
py 0 0.786977266 0.786977266 1.573954532 0.000000000
pz 0 0.779778276 0.779778276 1.559556552 0.000000000
sum over m 2.353733935 2.353733935 4.707467871 0.000000000
px 1 -0.008737772 -0.008737772 -0.017475544 0.000000000
py 1 -0.008729574 -0.008729574 -0.017459148 0.000000000
pz 1 -0.006460567 -0.006460567 -0.012921134 0.000000000
sum over m -0.023927913 -0.023927913 -0.047855826 0.000000000
sum over m+mul 2.329806022 2.329806022 4.659612045 0.000000000
d3z^2-r^2 0 -0.006389700 -0.006389700 -0.012779401 0.000000000
dx^2-y^2 0 -0.005057871 -0.005057871 -0.010115741 0.000000000
dxy 0 -0.005433956 -0.005433956 -0.010867912 0.000000000
dxz 0 -0.006927692 -0.006927692 -0.013855384 0.000000000
dyz 0 -0.006930158 -0.006930158 -0.013860316 0.000000000
sum over m -0.030739377 -0.030739377 -0.061478754 0.000000000
sum over m+mul -0.030739377 -0.030739377 -0.061478754 0.000000000
162 O Up spin Down spin Sum Diff
multiple
s 0 0.893886339 0.893886339 1.787772678 0.000000000
sum over m 0.893886339 0.893886339 1.787772678 0.000000000
s 1 -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m+mul 0.890843777 0.890843777 1.781687554 0.000000000
px 0 0.786877517 0.786877517 1.573755035 0.000000000
py 0 0.787069304 0.787069304 1.574138608 0.000000000
pz 0 0.779775813 0.779775813 1.559551626 0.000000000
sum over m 2.353722634 2.353722634 4.707445269 0.000000000
px 1 -0.008739259 -0.008739259 -0.017478518 0.000000000
py 1 -0.008737633 -0.008737633 -0.017475265 0.000000000
pz 1 -0.006463380 -0.006463380 -0.012926759 0.000000000
sum over m -0.023940271 -0.023940271 -0.047880542 0.000000000
sum over m+mul 2.329782363 2.329782363 4.659564727 0.000000000
d3z^2-r^2 0 -0.006389979 -0.006389979 -0.012779958 0.000000000
dx^2-y^2 0 -0.005057691 -0.005057691 -0.010115383 0.000000000
dxy 0 -0.005433292 -0.005433292 -0.010866584 0.000000000
dxz 0 -0.006930501 -0.006930501 -0.013861002 0.000000000
dyz 0 -0.006928514 -0.006928514 -0.013857028 0.000000000
sum over m -0.030739977 -0.030739977 -0.061479954 0.000000000
sum over m+mul -0.030739977 -0.030739977 -0.061479954 0.000000000
163 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000770732 1.000770732 2.001541464 0.000000000
sum over m 1.000770732 1.000770732 2.001541464 0.000000000
s 1 0.207415354 0.207415354 0.414830707 0.000000000
sum over m 0.207415354 0.207415354 0.414830707 0.000000000
s 2 0.014725018 0.014725018 0.029450037 0.000000000
sum over m 0.014725018 0.014725018 0.029450037 0.000000000
sum over m+mul 1.222911104 1.222911104 2.445822208 0.000000000
px 0 1.006377070 1.006377070 2.012754140 0.000000000
py 0 1.006363497 1.006363497 2.012726994 0.000000000
pz 0 1.006197348 1.006197348 2.012394695 0.000000000
sum over m 3.018937914 3.018937914 6.037875829 0.000000000
px 1 0.065435974 0.065435974 0.130871948 0.000000000
py 1 0.065430544 0.065430544 0.130861088 0.000000000
pz 1 0.040378094 0.040378094 0.080756187 0.000000000
sum over m 0.171244611 0.171244611 0.342489223 0.000000000
sum over m+mul 3.190182526 3.190182526 6.380365052 0.000000000
d3z^2-r^2 0 0.196300924 0.196300924 0.392601848 0.000000000
dx^2-y^2 0 0.201509474 0.201509474 0.403018948 0.000000000
dxy 0 0.250938064 0.250938064 0.501876129 0.000000000
dxz 0 0.268491138 0.268491138 0.536982277 0.000000000
dyz 0 0.268515406 0.268515406 0.537030813 0.000000000
sum over m 1.185755007 1.185755007 2.371510014 0.000000000
d3z^2-r^2 1 0.003475239 0.003475239 0.006950478 0.000000000
dx^2-y^2 1 -0.004476268 -0.004476268 -0.008952536 0.000000000
dxy 1 0.015340008 0.015340008 0.030680016 0.000000000
dxz 1 0.003489582 0.003489582 0.006979164 0.000000000
dyz 1 0.003489873 0.003489873 0.006979746 0.000000000
sum over m 0.021318434 0.021318434 0.042636868 0.000000000
sum over m+mul 1.207073441 1.207073441 2.414146882 0.000000000
164 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778689 1.000778689 2.001557378 0.000000000
sum over m 1.000778689 1.000778689 2.001557378 0.000000000
s 1 0.207427937 0.207427937 0.414855874 0.000000000
sum over m 0.207427937 0.207427937 0.414855874 0.000000000
s 2 0.014724840 0.014724840 0.029449681 0.000000000
sum over m 0.014724840 0.014724840 0.029449681 0.000000000
sum over m+mul 1.222931466 1.222931466 2.445862933 0.000000000
px 0 1.006378244 1.006378244 2.012756488 0.000000000
py 0 1.006362938 1.006362938 2.012725875 0.000000000
pz 0 1.006192809 1.006192809 2.012385618 0.000000000
sum over m 3.018933990 3.018933990 6.037867981 0.000000000
px 1 0.065430970 0.065430970 0.130861940 0.000000000
py 1 0.065445106 0.065445106 0.130890212 0.000000000
pz 1 0.040376746 0.040376746 0.080753493 0.000000000
sum over m 0.171252822 0.171252822 0.342505645 0.000000000
sum over m+mul 3.190186813 3.190186813 6.380373625 0.000000000
d3z^2-r^2 0 0.196306657 0.196306657 0.392613314 0.000000000
dx^2-y^2 0 0.201501412 0.201501412 0.403002824 0.000000000
dxy 0 0.250950786 0.250950786 0.501901571 0.000000000
dxz 0 0.268477950 0.268477950 0.536955900 0.000000000
dyz 0 0.268511716 0.268511716 0.537023433 0.000000000
sum over m 1.185748521 1.185748521 2.371497042 0.000000000
d3z^2-r^2 1 0.003474151 0.003474151 0.006948302 0.000000000
dx^2-y^2 1 -0.004476884 -0.004476884 -0.008953767 0.000000000
dxy 1 0.015339214 0.015339214 0.030678429 0.000000000
dxz 1 0.003488727 0.003488727 0.006977455 0.000000000
dyz 1 0.003491773 0.003491773 0.006983546 0.000000000
sum over m 0.021316982 0.021316982 0.042633964 0.000000000
sum over m+mul 1.207065503 1.207065503 2.414131007 0.000000000
165 O Up spin Down spin Sum Diff
multiple
s 0 0.893895019 0.893895019 1.787790038 0.000000000
sum over m 0.893895019 0.893895019 1.787790038 0.000000000
s 1 -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m+mul 0.890852483 0.890852483 1.781704966 0.000000000
px 0 0.787056712 0.787056712 1.574113424 0.000000000
py 0 0.786966454 0.786966454 1.573932907 0.000000000
pz 0 0.779743447 0.779743447 1.559486894 0.000000000
sum over m 2.353766613 2.353766613 4.707533225 0.000000000
px 1 -0.008739472 -0.008739472 -0.017478944 0.000000000
py 1 -0.008730480 -0.008730480 -0.017460960 0.000000000
pz 1 -0.006458433 -0.006458433 -0.012916866 0.000000000
sum over m -0.023928385 -0.023928385 -0.047856770 0.000000000
sum over m+mul 2.329838228 2.329838228 4.659676455 0.000000000
d3z^2-r^2 0 -0.006389905 -0.006389905 -0.012779810 0.000000000
dx^2-y^2 0 -0.005056718 -0.005056718 -0.010113437 0.000000000
dxy 0 -0.005434763 -0.005434763 -0.010869526 0.000000000
dxz 0 -0.006925027 -0.006925027 -0.013850053 0.000000000
dyz 0 -0.006929867 -0.006929867 -0.013859734 0.000000000
sum over m -0.030736281 -0.030736281 -0.061472561 0.000000000
sum over m+mul -0.030736281 -0.030736281 -0.061472561 0.000000000
166 O Up spin Down spin Sum Diff
multiple
s 0 0.893874732 0.893874732 1.787749464 0.000000000
sum over m 0.893874732 0.893874732 1.787749464 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m+mul 0.890832556 0.890832556 1.781665113 0.000000000
px 0 0.787008076 0.787008076 1.574016153 0.000000000
py 0 0.786910520 0.786910520 1.573821039 0.000000000
pz 0 0.779811493 0.779811493 1.559622987 0.000000000
sum over m 2.353730089 2.353730089 4.707460179 0.000000000
px 1 -0.008738822 -0.008738822 -0.017477644 0.000000000
py 1 -0.008727624 -0.008727624 -0.017455248 0.000000000
pz 1 -0.006463367 -0.006463367 -0.012926734 0.000000000
sum over m -0.023929813 -0.023929813 -0.047859626 0.000000000
sum over m+mul 2.329800277 2.329800277 4.659600553 0.000000000
d3z^2-r^2 0 -0.006389922 -0.006389922 -0.012779845 0.000000000
dx^2-y^2 0 -0.005059210 -0.005059210 -0.010118420 0.000000000
dxy 0 -0.005433824 -0.005433824 -0.010867647 0.000000000
dxz 0 -0.006928883 -0.006928883 -0.013857765 0.000000000
dyz 0 -0.006932427 -0.006932427 -0.013864854 0.000000000
sum over m -0.030744266 -0.030744266 -0.061488531 0.000000000
sum over m+mul -0.030744266 -0.030744266 -0.061488531 0.000000000
167 O Up spin Down spin Sum Diff
multiple
s 0 0.893881298 0.893881298 1.787762596 0.000000000
sum over m 0.893881298 0.893881298 1.787762596 0.000000000
s 1 -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m+mul 0.890838813 0.890838813 1.781677626 0.000000000
px 0 0.786978393 0.786978393 1.573956786 0.000000000
py 0 0.786977266 0.786977266 1.573954532 0.000000000
pz 0 0.779778276 0.779778276 1.559556552 0.000000000
sum over m 2.353733935 2.353733935 4.707467870 0.000000000
px 1 -0.008737772 -0.008737772 -0.017475544 0.000000000
py 1 -0.008729574 -0.008729574 -0.017459148 0.000000000
pz 1 -0.006460567 -0.006460567 -0.012921134 0.000000000
sum over m -0.023927913 -0.023927913 -0.047855826 0.000000000
sum over m+mul 2.329806022 2.329806022 4.659612044 0.000000000
d3z^2-r^2 0 -0.006389700 -0.006389700 -0.012779401 0.000000000
dx^2-y^2 0 -0.005057871 -0.005057871 -0.010115741 0.000000000
dxy 0 -0.005433956 -0.005433956 -0.010867912 0.000000000
dxz 0 -0.006927692 -0.006927692 -0.013855384 0.000000000
dyz 0 -0.006930158 -0.006930158 -0.013860316 0.000000000
sum over m -0.030739377 -0.030739377 -0.061478754 0.000000000
sum over m+mul -0.030739377 -0.030739377 -0.061478754 0.000000000
168 O Up spin Down spin Sum Diff
multiple
s 0 0.893886339 0.893886339 1.787772678 0.000000000
sum over m 0.893886339 0.893886339 1.787772678 0.000000000
s 1 -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m+mul 0.890843777 0.890843777 1.781687554 0.000000000
px 0 0.786877517 0.786877517 1.573755035 0.000000000
py 0 0.787069304 0.787069304 1.574138608 0.000000000
pz 0 0.779775813 0.779775813 1.559551626 0.000000000
sum over m 2.353722635 2.353722635 4.707445269 0.000000000
px 1 -0.008739259 -0.008739259 -0.017478518 0.000000000
py 1 -0.008737633 -0.008737633 -0.017475265 0.000000000
pz 1 -0.006463380 -0.006463380 -0.012926759 0.000000000
sum over m -0.023940271 -0.023940271 -0.047880542 0.000000000
sum over m+mul 2.329782364 2.329782364 4.659564727 0.000000000
d3z^2-r^2 0 -0.006389979 -0.006389979 -0.012779958 0.000000000
dx^2-y^2 0 -0.005057691 -0.005057691 -0.010115383 0.000000000
dxy 0 -0.005433292 -0.005433292 -0.010866584 0.000000000
dxz 0 -0.006930501 -0.006930501 -0.013861002 0.000000000
dyz 0 -0.006928514 -0.006928514 -0.013857028 0.000000000
sum over m -0.030739977 -0.030739977 -0.061479954 0.000000000
sum over m+mul -0.030739977 -0.030739977 -0.061479954 0.000000000
169 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778916 1.000778916 2.001557832 0.000000000
sum over m 1.000778916 1.000778916 2.001557832 0.000000000
s 1 0.207409563 0.207409563 0.414819127 0.000000000
sum over m 0.207409563 0.207409563 0.414819127 0.000000000
s 2 0.014724051 0.014724051 0.029448102 0.000000000
sum over m 0.014724051 0.014724051 0.029448102 0.000000000
sum over m+mul 1.222912530 1.222912530 2.445825060 0.000000000
px 0 1.006374183 1.006374183 2.012748366 0.000000000
py 0 1.006362420 1.006362420 2.012724841 0.000000000
pz 0 1.006209865 1.006209865 2.012419730 0.000000000
sum over m 3.018946468 3.018946468 6.037892936 0.000000000
px 1 0.065429433 0.065429433 0.130858865 0.000000000
py 1 0.065443904 0.065443904 0.130887808 0.000000000
pz 1 0.040370974 0.040370974 0.080741948 0.000000000
sum over m 0.171244311 0.171244311 0.342488622 0.000000000
sum over m+mul 3.190190779 3.190190779 6.380381559 0.000000000
d3z^2-r^2 0 0.196318571 0.196318571 0.392637143 0.000000000
dx^2-y^2 0 0.201518580 0.201518580 0.403037160 0.000000000
dxy 0 0.250943859 0.250943859 0.501887717 0.000000000
dxz 0 0.268483071 0.268483071 0.536966142 0.000000000
dyz 0 0.268501702 0.268501702 0.537003404 0.000000000
sum over m 1.185765783 1.185765783 2.371531566 0.000000000
d3z^2-r^2 1 0.003475678 0.003475678 0.006951357 0.000000000
dx^2-y^2 1 -0.004478521 -0.004478521 -0.008957041 0.000000000
dxy 1 0.015343153 0.015343153 0.030686307 0.000000000
dxz 1 0.003492711 0.003492711 0.006985422 0.000000000
dyz 1 0.003494748 0.003494748 0.006989496 0.000000000
sum over m 0.021327770 0.021327770 0.042655541 0.000000000
sum over m+mul 1.207093553 1.207093553 2.414187106 0.000000000
170 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000792991 1.000792991 2.001585981 0.000000000
sum over m 1.000792991 1.000792991 2.001585981 0.000000000
s 1 0.207390820 0.207390820 0.414781640 0.000000000
sum over m 0.207390820 0.207390820 0.414781640 0.000000000
s 2 0.014720510 0.014720510 0.029441020 0.000000000
sum over m 0.014720510 0.014720510 0.029441020 0.000000000
sum over m+mul 1.222904321 1.222904321 2.445808642 0.000000000
px 0 1.006384887 1.006384887 2.012769774 0.000000000
py 0 1.006377573 1.006377573 2.012755145 0.000000000
pz 0 1.006212343 1.006212343 2.012424686 0.000000000
sum over m 3.018974803 3.018974803 6.037949606 0.000000000
px 1 0.065437539 0.065437539 0.130875078 0.000000000
py 1 0.065446611 0.065446611 0.130893223 0.000000000
pz 1 0.040352263 0.040352263 0.080704525 0.000000000
sum over m 0.171236413 0.171236413 0.342472826 0.000000000
sum over m+mul 3.190211216 3.190211216 6.380422432 0.000000000
d3z^2-r^2 0 0.196306883 0.196306883 0.392613766 0.000000000
dx^2-y^2 0 0.201535544 0.201535544 0.403071088 0.000000000
dxy 0 0.250924809 0.250924809 0.501849619 0.000000000
dxz 0 0.268487708 0.268487708 0.536975415 0.000000000
dyz 0 0.268500321 0.268500321 0.537000642 0.000000000
sum over m 1.185755265 1.185755265 2.371510529 0.000000000
d3z^2-r^2 1 0.003469984 0.003469984 0.006939968 0.000000000
dx^2-y^2 1 -0.004484206 -0.004484206 -0.008968412 0.000000000
dxy 1 0.015344325 0.015344325 0.030688651 0.000000000
dxz 1 0.003485635 0.003485635 0.006971270 0.000000000
dyz 1 0.003487590 0.003487590 0.006975180 0.000000000
sum over m 0.021303329 0.021303329 0.042606657 0.000000000
sum over m+mul 1.207058593 1.207058593 2.414117187 0.000000000
171 O Up spin Down spin Sum Diff
multiple
s 0 0.893905185 0.893905185 1.787810370 0.000000000
sum over m 0.893905185 0.893905185 1.787810370 0.000000000
s 1 -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m+mul 0.890862675 0.890862675 1.781725349 0.000000000
px 0 0.787002996 0.787002996 1.574005991 0.000000000
py 0 0.787059160 0.787059160 1.574118320 0.000000000
pz 0 0.779696595 0.779696595 1.559393190 0.000000000
sum over m 2.353758751 2.353758751 4.707517502 0.000000000
px 1 -0.008735018 -0.008735018 -0.017470036 0.000000000
py 1 -0.008733168 -0.008733168 -0.017466336 0.000000000
pz 1 -0.006457441 -0.006457441 -0.012914882 0.000000000
sum over m -0.023925627 -0.023925627 -0.047851254 0.000000000
sum over m+mul 2.329833124 2.329833124 4.659666247 0.000000000
d3z^2-r^2 0 -0.006390179 -0.006390179 -0.012780358 0.000000000
dx^2-y^2 0 -0.005053263 -0.005053263 -0.010106526 0.000000000
dxy 0 -0.005435079 -0.005435079 -0.010870159 0.000000000
dxz 0 -0.006924637 -0.006924637 -0.013849274 0.000000000
dyz 0 -0.006925305 -0.006925305 -0.013850609 0.000000000
sum over m -0.030728463 -0.030728463 -0.061456926 0.000000000
sum over m+mul -0.030728463 -0.030728463 -0.061456926 0.000000000
172 O Up spin Down spin Sum Diff
multiple
s 0 0.893888928 0.893888928 1.787777856 0.000000000
sum over m 0.893888928 0.893888928 1.787777856 0.000000000
s 1 -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m+mul 0.890848292 0.890848292 1.781696584 0.000000000
px 0 0.787028939 0.787028939 1.574057877 0.000000000
py 0 0.786865217 0.786865217 1.573730434 0.000000000
pz 0 0.779830101 0.779830101 1.559660202 0.000000000
sum over m 2.353724257 2.353724257 4.707448513 0.000000000
px 1 -0.008744757 -0.008744757 -0.017489514 0.000000000
py 1 -0.008732656 -0.008732656 -0.017465311 0.000000000
pz 1 -0.006466405 -0.006466405 -0.012932810 0.000000000
sum over m -0.023943817 -0.023943817 -0.047887635 0.000000000
sum over m+mul 2.329780439 2.329780439 4.659560878 0.000000000
d3z^2-r^2 0 -0.006391873 -0.006391873 -0.012783746 0.000000000
dx^2-y^2 0 -0.005060058 -0.005060058 -0.010120116 0.000000000
dxy 0 -0.005434637 -0.005434637 -0.010869275 0.000000000
dxz 0 -0.006930267 -0.006930267 -0.013860534 0.000000000
dyz 0 -0.006933241 -0.006933241 -0.013866483 0.000000000
sum over m -0.030750077 -0.030750077 -0.061500154 0.000000000
sum over m+mul -0.030750077 -0.030750077 -0.061500154 0.000000000
173 O Up spin Down spin Sum Diff
multiple
s 0 0.893877889 0.893877889 1.787755777 0.000000000
sum over m 0.893877889 0.893877889 1.787755777 0.000000000
s 1 -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m+mul 0.890836748 0.890836748 1.781673495 0.000000000
px 0 0.787030508 0.787030508 1.574061016 0.000000000
py 0 0.786864481 0.786864481 1.573728963 0.000000000
pz 0 0.779832476 0.779832476 1.559664951 0.000000000
sum over m 2.353727465 2.353727465 4.707454930 0.000000000
px 1 -0.008742331 -0.008742331 -0.017484663 0.000000000
py 1 -0.008727804 -0.008727804 -0.017455608 0.000000000
pz 1 -0.006466676 -0.006466676 -0.012933352 0.000000000
sum over m -0.023936811 -0.023936811 -0.047873622 0.000000000
sum over m+mul 2.329790654 2.329790654 4.659581308 0.000000000
d3z^2-r^2 0 -0.006390882 -0.006390882 -0.012781764 0.000000000
dx^2-y^2 0 -0.005059703 -0.005059703 -0.010119406 0.000000000
dxy 0 -0.005434362 -0.005434362 -0.010868723 0.000000000
dxz 0 -0.006929750 -0.006929750 -0.013859500 0.000000000
dyz 0 -0.006933518 -0.006933518 -0.013867035 0.000000000
sum over m -0.030748214 -0.030748214 -0.061496428 0.000000000
sum over m+mul -0.030748214 -0.030748214 -0.061496428 0.000000000
174 O Up spin Down spin Sum Diff
multiple
s 0 0.893912791 0.893912791 1.787825582 0.000000000
sum over m 0.893912791 0.893912791 1.787825582 0.000000000
s 1 -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m+mul 0.890871448 0.890871448 1.781742896 0.000000000
px 0 0.786870148 0.786870148 1.573740296 0.000000000
py 0 0.787115831 0.787115831 1.574231662 0.000000000
pz 0 0.779754650 0.779754650 1.559509300 0.000000000
sum over m 2.353740629 2.353740629 4.707481258 0.000000000
px 1 -0.008737390 -0.008737390 -0.017474781 0.000000000
py 1 -0.008744205 -0.008744205 -0.017488409 0.000000000
pz 1 -0.006463247 -0.006463247 -0.012926494 0.000000000
sum over m -0.023944842 -0.023944842 -0.047889684 0.000000000
sum over m+mul 2.329795787 2.329795787 4.659591574 0.000000000
d3z^2-r^2 0 -0.006392167 -0.006392167 -0.012784335 0.000000000
dx^2-y^2 0 -0.005057196 -0.005057196 -0.010114392 0.000000000
dxy 0 -0.005435295 -0.005435295 -0.010870589 0.000000000
dxz 0 -0.006930221 -0.006930221 -0.013860442 0.000000000
dyz 0 -0.006926335 -0.006926335 -0.013852670 0.000000000
sum over m -0.030741214 -0.030741214 -0.061482428 0.000000000
sum over m+mul -0.030741214 -0.030741214 -0.061482428 0.000000000
175 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778916 1.000778916 2.001557831 0.000000000
sum over m 1.000778916 1.000778916 2.001557831 0.000000000
s 1 0.207409563 0.207409563 0.414819127 0.000000000
sum over m 0.207409563 0.207409563 0.414819127 0.000000000
s 2 0.014724051 0.014724051 0.029448102 0.000000000
sum over m 0.014724051 0.014724051 0.029448102 0.000000000
sum over m+mul 1.222912530 1.222912530 2.445825060 0.000000000
px 0 1.006374183 1.006374183 2.012748366 0.000000000
py 0 1.006362420 1.006362420 2.012724841 0.000000000
pz 0 1.006209865 1.006209865 2.012419730 0.000000000
sum over m 3.018946468 3.018946468 6.037892937 0.000000000
px 1 0.065429433 0.065429433 0.130858865 0.000000000
py 1 0.065443904 0.065443904 0.130887808 0.000000000
pz 1 0.040370974 0.040370974 0.080741948 0.000000000
sum over m 0.171244311 0.171244311 0.342488622 0.000000000
sum over m+mul 3.190190779 3.190190779 6.380381558 0.000000000
d3z^2-r^2 0 0.196318571 0.196318571 0.392637143 0.000000000
dx^2-y^2 0 0.201518580 0.201518580 0.403037160 0.000000000
dxy 0 0.250943858 0.250943858 0.501887717 0.000000000
dxz 0 0.268483071 0.268483071 0.536966142 0.000000000
dyz 0 0.268501702 0.268501702 0.537003404 0.000000000
sum over m 1.185765783 1.185765783 2.371531565 0.000000000
d3z^2-r^2 1 0.003475678 0.003475678 0.006951357 0.000000000
dx^2-y^2 1 -0.004478521 -0.004478521 -0.008957041 0.000000000
dxy 1 0.015343154 0.015343154 0.030686307 0.000000000
dxz 1 0.003492711 0.003492711 0.006985422 0.000000000
dyz 1 0.003494748 0.003494748 0.006989496 0.000000000
sum over m 0.021327770 0.021327770 0.042655541 0.000000000
sum over m+mul 1.207093553 1.207093553 2.414187106 0.000000000
176 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000792990 1.000792990 2.001585981 0.000000000
sum over m 1.000792990 1.000792990 2.001585981 0.000000000
s 1 0.207390820 0.207390820 0.414781640 0.000000000
sum over m 0.207390820 0.207390820 0.414781640 0.000000000
s 2 0.014720510 0.014720510 0.029441020 0.000000000
sum over m 0.014720510 0.014720510 0.029441020 0.000000000
sum over m+mul 1.222904321 1.222904321 2.445808641 0.000000000
px 0 1.006384887 1.006384887 2.012769774 0.000000000
py 0 1.006377573 1.006377573 2.012755145 0.000000000
pz 0 1.006212343 1.006212343 2.012424686 0.000000000
sum over m 3.018974803 3.018974803 6.037949606 0.000000000
px 1 0.065437539 0.065437539 0.130875079 0.000000000
py 1 0.065446611 0.065446611 0.130893222 0.000000000
pz 1 0.040352263 0.040352263 0.080704526 0.000000000
sum over m 0.171236413 0.171236413 0.342472826 0.000000000
sum over m+mul 3.190211216 3.190211216 6.380422432 0.000000000
d3z^2-r^2 0 0.196306883 0.196306883 0.392613765 0.000000000
dx^2-y^2 0 0.201535544 0.201535544 0.403071089 0.000000000
dxy 0 0.250924809 0.250924809 0.501849618 0.000000000
dxz 0 0.268487707 0.268487707 0.536975415 0.000000000
dyz 0 0.268500321 0.268500321 0.537000642 0.000000000
sum over m 1.185755265 1.185755265 2.371510529 0.000000000
d3z^2-r^2 1 0.003469984 0.003469984 0.006939968 0.000000000
dx^2-y^2 1 -0.004484206 -0.004484206 -0.008968412 0.000000000
dxy 1 0.015344325 0.015344325 0.030688651 0.000000000
dxz 1 0.003485635 0.003485635 0.006971270 0.000000000
dyz 1 0.003487590 0.003487590 0.006975180 0.000000000
sum over m 0.021303329 0.021303329 0.042606657 0.000000000
sum over m+mul 1.207058593 1.207058593 2.414117186 0.000000000
177 O Up spin Down spin Sum Diff
multiple
s 0 0.893905185 0.893905185 1.787810370 0.000000000
sum over m 0.893905185 0.893905185 1.787810370 0.000000000
s 1 -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m+mul 0.890862675 0.890862675 1.781725349 0.000000000
px 0 0.787002996 0.787002996 1.574005991 0.000000000
py 0 0.787059160 0.787059160 1.574118321 0.000000000
pz 0 0.779696595 0.779696595 1.559393190 0.000000000
sum over m 2.353758751 2.353758751 4.707517502 0.000000000
px 1 -0.008735018 -0.008735018 -0.017470036 0.000000000
py 1 -0.008733168 -0.008733168 -0.017466336 0.000000000
pz 1 -0.006457441 -0.006457441 -0.012914882 0.000000000
sum over m -0.023925627 -0.023925627 -0.047851254 0.000000000
sum over m+mul 2.329833124 2.329833124 4.659666248 0.000000000
d3z^2-r^2 0 -0.006390179 -0.006390179 -0.012780358 0.000000000
dx^2-y^2 0 -0.005053263 -0.005053263 -0.010106526 0.000000000
dxy 0 -0.005435079 -0.005435079 -0.010870159 0.000000000
dxz 0 -0.006924637 -0.006924637 -0.013849274 0.000000000
dyz 0 -0.006925305 -0.006925305 -0.013850609 0.000000000
sum over m -0.030728463 -0.030728463 -0.061456926 0.000000000
sum over m+mul -0.030728463 -0.030728463 -0.061456926 0.000000000
178 O Up spin Down spin Sum Diff
multiple
s 0 0.893888928 0.893888928 1.787777856 0.000000000
sum over m 0.893888928 0.893888928 1.787777856 0.000000000
s 1 -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m+mul 0.890848292 0.890848292 1.781696584 0.000000000
px 0 0.787028939 0.787028939 1.574057877 0.000000000
py 0 0.786865217 0.786865217 1.573730434 0.000000000
pz 0 0.779830101 0.779830101 1.559660202 0.000000000
sum over m 2.353724257 2.353724257 4.707448514 0.000000000
px 1 -0.008744757 -0.008744757 -0.017489514 0.000000000
py 1 -0.008732655 -0.008732655 -0.017465311 0.000000000
pz 1 -0.006466405 -0.006466405 -0.012932810 0.000000000
sum over m -0.023943817 -0.023943817 -0.047887635 0.000000000
sum over m+mul 2.329780439 2.329780439 4.659560879 0.000000000
d3z^2-r^2 0 -0.006391873 -0.006391873 -0.012783746 0.000000000
dx^2-y^2 0 -0.005060058 -0.005060058 -0.010120116 0.000000000
dxy 0 -0.005434637 -0.005434637 -0.010869275 0.000000000
dxz 0 -0.006930267 -0.006930267 -0.013860534 0.000000000
dyz 0 -0.006933241 -0.006933241 -0.013866483 0.000000000
sum over m -0.030750077 -0.030750077 -0.061500154 0.000000000
sum over m+mul -0.030750077 -0.030750077 -0.061500154 0.000000000
179 O Up spin Down spin Sum Diff
multiple
s 0 0.893877889 0.893877889 1.787755777 0.000000000
sum over m 0.893877889 0.893877889 1.787755777 0.000000000
s 1 -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m+mul 0.890836748 0.890836748 1.781673495 0.000000000
px 0 0.787030508 0.787030508 1.574061017 0.000000000
py 0 0.786864481 0.786864481 1.573728963 0.000000000
pz 0 0.779832476 0.779832476 1.559664951 0.000000000
sum over m 2.353727465 2.353727465 4.707454931 0.000000000
px 1 -0.008742331 -0.008742331 -0.017484663 0.000000000
py 1 -0.008727804 -0.008727804 -0.017455608 0.000000000
pz 1 -0.006466676 -0.006466676 -0.012933352 0.000000000
sum over m -0.023936811 -0.023936811 -0.047873622 0.000000000
sum over m+mul 2.329790654 2.329790654 4.659581308 0.000000000
d3z^2-r^2 0 -0.006390882 -0.006390882 -0.012781764 0.000000000
dx^2-y^2 0 -0.005059703 -0.005059703 -0.010119406 0.000000000
dxy 0 -0.005434362 -0.005434362 -0.010868723 0.000000000
dxz 0 -0.006929750 -0.006929750 -0.013859500 0.000000000
dyz 0 -0.006933518 -0.006933518 -0.013867035 0.000000000
sum over m -0.030748214 -0.030748214 -0.061496428 0.000000000
sum over m+mul -0.030748214 -0.030748214 -0.061496428 0.000000000
180 O Up spin Down spin Sum Diff
multiple
s 0 0.893912791 0.893912791 1.787825582 0.000000000
sum over m 0.893912791 0.893912791 1.787825582 0.000000000
s 1 -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m+mul 0.890871448 0.890871448 1.781742896 0.000000000
px 0 0.786870148 0.786870148 1.573740297 0.000000000
py 0 0.787115831 0.787115831 1.574231661 0.000000000
pz 0 0.779754650 0.779754650 1.559509300 0.000000000
sum over m 2.353740629 2.353740629 4.707481258 0.000000000
px 1 -0.008737390 -0.008737390 -0.017474781 0.000000000
py 1 -0.008744205 -0.008744205 -0.017488409 0.000000000
pz 1 -0.006463247 -0.006463247 -0.012926494 0.000000000
sum over m -0.023944842 -0.023944842 -0.047889684 0.000000000
sum over m+mul 2.329795787 2.329795787 4.659591574 0.000000000
d3z^2-r^2 0 -0.006392167 -0.006392167 -0.012784335 0.000000000
dx^2-y^2 0 -0.005057196 -0.005057196 -0.010114392 0.000000000
dxy 0 -0.005435295 -0.005435295 -0.010870589 0.000000000
dxz 0 -0.006930221 -0.006930221 -0.013860442 0.000000000
dyz 0 -0.006926335 -0.006926335 -0.013852670 0.000000000
sum over m -0.030741214 -0.030741214 -0.061482428 0.000000000
sum over m+mul -0.030741214 -0.030741214 -0.061482428 0.000000000
181 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778916 1.000778916 2.001557832 0.000000000
sum over m 1.000778916 1.000778916 2.001557832 0.000000000
s 1 0.207409563 0.207409563 0.414819127 0.000000000
sum over m 0.207409563 0.207409563 0.414819127 0.000000000
s 2 0.014724051 0.014724051 0.029448102 0.000000000
sum over m 0.014724051 0.014724051 0.029448102 0.000000000
sum over m+mul 1.222912530 1.222912530 2.445825061 0.000000000
px 0 1.006374183 1.006374183 2.012748366 0.000000000
py 0 1.006362420 1.006362420 2.012724841 0.000000000
pz 0 1.006209865 1.006209865 2.012419730 0.000000000
sum over m 3.018946468 3.018946468 6.037892937 0.000000000
px 1 0.065429433 0.065429433 0.130858866 0.000000000
py 1 0.065443904 0.065443904 0.130887809 0.000000000
pz 1 0.040370974 0.040370974 0.080741949 0.000000000
sum over m 0.171244311 0.171244311 0.342488623 0.000000000
sum over m+mul 3.190190780 3.190190780 6.380381560 0.000000000
d3z^2-r^2 0 0.196318571 0.196318571 0.392637143 0.000000000
dx^2-y^2 0 0.201518580 0.201518580 0.403037161 0.000000000
dxy 0 0.250943859 0.250943859 0.501887717 0.000000000
dxz 0 0.268483071 0.268483071 0.536966142 0.000000000
dyz 0 0.268501702 0.268501702 0.537003404 0.000000000
sum over m 1.185765783 1.185765783 2.371531566 0.000000000
d3z^2-r^2 1 0.003475678 0.003475678 0.006951357 0.000000000
dx^2-y^2 1 -0.004478521 -0.004478521 -0.008957041 0.000000000
dxy 1 0.015343153 0.015343153 0.030686307 0.000000000
dxz 1 0.003492711 0.003492711 0.006985422 0.000000000
dyz 1 0.003494748 0.003494748 0.006989496 0.000000000
sum over m 0.021327770 0.021327770 0.042655541 0.000000000
sum over m+mul 1.207093554 1.207093554 2.414187107 0.000000000
182 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000792991 1.000792991 2.001585981 0.000000000
sum over m 1.000792991 1.000792991 2.001585981 0.000000000
s 1 0.207390820 0.207390820 0.414781640 0.000000000
sum over m 0.207390820 0.207390820 0.414781640 0.000000000
s 2 0.014720510 0.014720510 0.029441020 0.000000000
sum over m 0.014720510 0.014720510 0.029441020 0.000000000
sum over m+mul 1.222904321 1.222904321 2.445808642 0.000000000
px 0 1.006384887 1.006384887 2.012769774 0.000000000
py 0 1.006377573 1.006377573 2.012755145 0.000000000
pz 0 1.006212343 1.006212343 2.012424686 0.000000000
sum over m 3.018974803 3.018974803 6.037949606 0.000000000
px 1 0.065437539 0.065437539 0.130875078 0.000000000
py 1 0.065446611 0.065446611 0.130893222 0.000000000
pz 1 0.040352263 0.040352263 0.080704526 0.000000000
sum over m 0.171236413 0.171236413 0.342472826 0.000000000
sum over m+mul 3.190211216 3.190211216 6.380422432 0.000000000
d3z^2-r^2 0 0.196306883 0.196306883 0.392613766 0.000000000
dx^2-y^2 0 0.201535544 0.201535544 0.403071088 0.000000000
dxy 0 0.250924809 0.250924809 0.501849618 0.000000000
dxz 0 0.268487707 0.268487707 0.536975415 0.000000000
dyz 0 0.268500321 0.268500321 0.537000642 0.000000000
sum over m 1.185755264 1.185755264 2.371510529 0.000000000
d3z^2-r^2 1 0.003469984 0.003469984 0.006939968 0.000000000
dx^2-y^2 1 -0.004484206 -0.004484206 -0.008968412 0.000000000
dxy 1 0.015344325 0.015344325 0.030688651 0.000000000
dxz 1 0.003485635 0.003485635 0.006971270 0.000000000
dyz 1 0.003487590 0.003487590 0.006975180 0.000000000
sum over m 0.021303329 0.021303329 0.042606657 0.000000000
sum over m+mul 1.207058593 1.207058593 2.414117186 0.000000000
183 O Up spin Down spin Sum Diff
multiple
s 0 0.893905185 0.893905185 1.787810370 0.000000000
sum over m 0.893905185 0.893905185 1.787810370 0.000000000
s 1 -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m+mul 0.890862675 0.890862675 1.781725349 0.000000000
px 0 0.787002996 0.787002996 1.574005991 0.000000000
py 0 0.787059161 0.787059161 1.574118321 0.000000000
pz 0 0.779696595 0.779696595 1.559393190 0.000000000
sum over m 2.353758752 2.353758752 4.707517503 0.000000000
px 1 -0.008735018 -0.008735018 -0.017470036 0.000000000
py 1 -0.008733168 -0.008733168 -0.017466336 0.000000000
pz 1 -0.006457441 -0.006457441 -0.012914882 0.000000000
sum over m -0.023925627 -0.023925627 -0.047851254 0.000000000
sum over m+mul 2.329833125 2.329833125 4.659666249 0.000000000
d3z^2-r^2 0 -0.006390179 -0.006390179 -0.012780358 0.000000000
dx^2-y^2 0 -0.005053263 -0.005053263 -0.010106526 0.000000000
dxy 0 -0.005435079 -0.005435079 -0.010870159 0.000000000
dxz 0 -0.006924637 -0.006924637 -0.013849274 0.000000000
dyz 0 -0.006925305 -0.006925305 -0.013850609 0.000000000
sum over m -0.030728463 -0.030728463 -0.061456926 0.000000000
sum over m+mul -0.030728463 -0.030728463 -0.061456926 0.000000000
184 O Up spin Down spin Sum Diff
multiple
s 0 0.893888928 0.893888928 1.787777856 0.000000000
sum over m 0.893888928 0.893888928 1.787777856 0.000000000
s 1 -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m+mul 0.890848292 0.890848292 1.781696584 0.000000000
px 0 0.787028939 0.787028939 1.574057877 0.000000000
py 0 0.786865217 0.786865217 1.573730434 0.000000000
pz 0 0.779830101 0.779830101 1.559660202 0.000000000
sum over m 2.353724257 2.353724257 4.707448514 0.000000000
px 1 -0.008744757 -0.008744757 -0.017489514 0.000000000
py 1 -0.008732656 -0.008732656 -0.017465311 0.000000000
pz 1 -0.006466405 -0.006466405 -0.012932810 0.000000000
sum over m -0.023943817 -0.023943817 -0.047887635 0.000000000
sum over m+mul 2.329780439 2.329780439 4.659560879 0.000000000
d3z^2-r^2 0 -0.006391873 -0.006391873 -0.012783746 0.000000000
dx^2-y^2 0 -0.005060058 -0.005060058 -0.010120116 0.000000000
dxy 0 -0.005434637 -0.005434637 -0.010869275 0.000000000
dxz 0 -0.006930267 -0.006930267 -0.013860534 0.000000000
dyz 0 -0.006933241 -0.006933241 -0.013866483 0.000000000
sum over m -0.030750077 -0.030750077 -0.061500154 0.000000000
sum over m+mul -0.030750077 -0.030750077 -0.061500154 0.000000000
185 O Up spin Down spin Sum Diff
multiple
s 0 0.893877889 0.893877889 1.787755777 0.000000000
sum over m 0.893877889 0.893877889 1.787755777 0.000000000
s 1 -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m+mul 0.890836748 0.890836748 1.781673495 0.000000000
px 0 0.787030508 0.787030508 1.574061017 0.000000000
py 0 0.786864481 0.786864481 1.573728963 0.000000000
pz 0 0.779832476 0.779832476 1.559664951 0.000000000
sum over m 2.353727465 2.353727465 4.707454931 0.000000000
px 1 -0.008742331 -0.008742331 -0.017484663 0.000000000
py 1 -0.008727804 -0.008727804 -0.017455608 0.000000000
pz 1 -0.006466676 -0.006466676 -0.012933352 0.000000000
sum over m -0.023936811 -0.023936811 -0.047873622 0.000000000
sum over m+mul 2.329790654 2.329790654 4.659581309 0.000000000
d3z^2-r^2 0 -0.006390882 -0.006390882 -0.012781764 0.000000000
dx^2-y^2 0 -0.005059703 -0.005059703 -0.010119406 0.000000000
dxy 0 -0.005434362 -0.005434362 -0.010868723 0.000000000
dxz 0 -0.006929750 -0.006929750 -0.013859500 0.000000000
dyz 0 -0.006933518 -0.006933518 -0.013867035 0.000000000
sum over m -0.030748214 -0.030748214 -0.061496428 0.000000000
sum over m+mul -0.030748214 -0.030748214 -0.061496428 0.000000000
186 O Up spin Down spin Sum Diff
multiple
s 0 0.893912791 0.893912791 1.787825582 0.000000000
sum over m 0.893912791 0.893912791 1.787825582 0.000000000
s 1 -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m+mul 0.890871448 0.890871448 1.781742896 0.000000000
px 0 0.786870148 0.786870148 1.573740296 0.000000000
py 0 0.787115831 0.787115831 1.574231661 0.000000000
pz 0 0.779754650 0.779754650 1.559509299 0.000000000
sum over m 2.353740629 2.353740629 4.707481257 0.000000000
px 1 -0.008737390 -0.008737390 -0.017474781 0.000000000
py 1 -0.008744205 -0.008744205 -0.017488409 0.000000000
pz 1 -0.006463247 -0.006463247 -0.012926494 0.000000000
sum over m -0.023944842 -0.023944842 -0.047889684 0.000000000
sum over m+mul 2.329795787 2.329795787 4.659591574 0.000000000
d3z^2-r^2 0 -0.006392167 -0.006392167 -0.012784335 0.000000000
dx^2-y^2 0 -0.005057196 -0.005057196 -0.010114392 0.000000000
dxy 0 -0.005435295 -0.005435295 -0.010870589 0.000000000
dxz 0 -0.006930221 -0.006930221 -0.013860442 0.000000000
dyz 0 -0.006926335 -0.006926335 -0.013852670 0.000000000
sum over m -0.030741214 -0.030741214 -0.061482428 0.000000000
sum over m+mul -0.030741214 -0.030741214 -0.061482428 0.000000000
187 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778916 1.000778916 2.001557831 0.000000000
sum over m 1.000778916 1.000778916 2.001557831 0.000000000
s 1 0.207409563 0.207409563 0.414819127 0.000000000
sum over m 0.207409563 0.207409563 0.414819127 0.000000000
s 2 0.014724051 0.014724051 0.029448102 0.000000000
sum over m 0.014724051 0.014724051 0.029448102 0.000000000
sum over m+mul 1.222912530 1.222912530 2.445825060 0.000000000
px 0 1.006374183 1.006374183 2.012748366 0.000000000
py 0 1.006362420 1.006362420 2.012724841 0.000000000
pz 0 1.006209865 1.006209865 2.012419730 0.000000000
sum over m 3.018946468 3.018946468 6.037892936 0.000000000
px 1 0.065429433 0.065429433 0.130858866 0.000000000
py 1 0.065443904 0.065443904 0.130887809 0.000000000
pz 1 0.040370974 0.040370974 0.080741948 0.000000000
sum over m 0.171244311 0.171244311 0.342488622 0.000000000
sum over m+mul 3.190190779 3.190190779 6.380381559 0.000000000
d3z^2-r^2 0 0.196318572 0.196318572 0.392637143 0.000000000
dx^2-y^2 0 0.201518580 0.201518580 0.403037160 0.000000000
dxy 0 0.250943859 0.250943859 0.501887717 0.000000000
dxz 0 0.268483071 0.268483071 0.536966142 0.000000000
dyz 0 0.268501702 0.268501702 0.537003404 0.000000000
sum over m 1.185765783 1.185765783 2.371531566 0.000000000
d3z^2-r^2 1 0.003475678 0.003475678 0.006951357 0.000000000
dx^2-y^2 1 -0.004478521 -0.004478521 -0.008957041 0.000000000
dxy 1 0.015343153 0.015343153 0.030686307 0.000000000
dxz 1 0.003492711 0.003492711 0.006985422 0.000000000
dyz 1 0.003494748 0.003494748 0.006989496 0.000000000
sum over m 0.021327770 0.021327770 0.042655541 0.000000000
sum over m+mul 1.207093553 1.207093553 2.414187107 0.000000000
188 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000792991 1.000792991 2.001585981 0.000000000
sum over m 1.000792991 1.000792991 2.001585981 0.000000000
s 1 0.207390820 0.207390820 0.414781640 0.000000000
sum over m 0.207390820 0.207390820 0.414781640 0.000000000
s 2 0.014720510 0.014720510 0.029441020 0.000000000
sum over m 0.014720510 0.014720510 0.029441020 0.000000000
sum over m+mul 1.222904321 1.222904321 2.445808642 0.000000000
px 0 1.006384887 1.006384887 2.012769774 0.000000000
py 0 1.006377573 1.006377573 2.012755145 0.000000000
pz 0 1.006212343 1.006212343 2.012424686 0.000000000
sum over m 3.018974803 3.018974803 6.037949606 0.000000000
px 1 0.065437539 0.065437539 0.130875078 0.000000000
py 1 0.065446611 0.065446611 0.130893222 0.000000000
pz 1 0.040352263 0.040352263 0.080704525 0.000000000
sum over m 0.171236413 0.171236413 0.342472826 0.000000000
sum over m+mul 3.190211216 3.190211216 6.380422432 0.000000000
d3z^2-r^2 0 0.196306883 0.196306883 0.392613766 0.000000000
dx^2-y^2 0 0.201535544 0.201535544 0.403071088 0.000000000
dxy 0 0.250924809 0.250924809 0.501849618 0.000000000
dxz 0 0.268487707 0.268487707 0.536975415 0.000000000
dyz 0 0.268500321 0.268500321 0.537000642 0.000000000
sum over m 1.185755264 1.185755264 2.371510529 0.000000000
d3z^2-r^2 1 0.003469984 0.003469984 0.006939968 0.000000000
dx^2-y^2 1 -0.004484206 -0.004484206 -0.008968412 0.000000000
dxy 1 0.015344325 0.015344325 0.030688651 0.000000000
dxz 1 0.003485635 0.003485635 0.006971270 0.000000000
dyz 1 0.003487590 0.003487590 0.006975180 0.000000000
sum over m 0.021303329 0.021303329 0.042606657 0.000000000
sum over m+mul 1.207058593 1.207058593 2.414117186 0.000000000
189 O Up spin Down spin Sum Diff
multiple
s 0 0.893905185 0.893905185 1.787810370 0.000000000
sum over m 0.893905185 0.893905185 1.787810370 0.000000000
s 1 -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m+mul 0.890862675 0.890862675 1.781725349 0.000000000
px 0 0.787002996 0.787002996 1.574005991 0.000000000
py 0 0.787059160 0.787059160 1.574118321 0.000000000
pz 0 0.779696595 0.779696595 1.559393190 0.000000000
sum over m 2.353758751 2.353758751 4.707517503 0.000000000
px 1 -0.008735018 -0.008735018 -0.017470036 0.000000000
py 1 -0.008733168 -0.008733168 -0.017466336 0.000000000
pz 1 -0.006457441 -0.006457441 -0.012914882 0.000000000
sum over m -0.023925627 -0.023925627 -0.047851254 0.000000000
sum over m+mul 2.329833124 2.329833124 4.659666249 0.000000000
d3z^2-r^2 0 -0.006390179 -0.006390179 -0.012780358 0.000000000
dx^2-y^2 0 -0.005053263 -0.005053263 -0.010106526 0.000000000
dxy 0 -0.005435079 -0.005435079 -0.010870159 0.000000000
dxz 0 -0.006924637 -0.006924637 -0.013849274 0.000000000
dyz 0 -0.006925305 -0.006925305 -0.013850609 0.000000000
sum over m -0.030728463 -0.030728463 -0.061456926 0.000000000
sum over m+mul -0.030728463 -0.030728463 -0.061456926 0.000000000
190 O Up spin Down spin Sum Diff
multiple
s 0 0.893888928 0.893888928 1.787777856 0.000000000
sum over m 0.893888928 0.893888928 1.787777856 0.000000000
s 1 -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m+mul 0.890848292 0.890848292 1.781696584 0.000000000
px 0 0.787028939 0.787028939 1.574057877 0.000000000
py 0 0.786865217 0.786865217 1.573730434 0.000000000
pz 0 0.779830101 0.779830101 1.559660202 0.000000000
sum over m 2.353724257 2.353724257 4.707448514 0.000000000
px 1 -0.008744757 -0.008744757 -0.017489514 0.000000000
py 1 -0.008732655 -0.008732655 -0.017465311 0.000000000
pz 1 -0.006466405 -0.006466405 -0.012932810 0.000000000
sum over m -0.023943817 -0.023943817 -0.047887635 0.000000000
sum over m+mul 2.329780439 2.329780439 4.659560879 0.000000000
d3z^2-r^2 0 -0.006391873 -0.006391873 -0.012783746 0.000000000
dx^2-y^2 0 -0.005060058 -0.005060058 -0.010120116 0.000000000
dxy 0 -0.005434637 -0.005434637 -0.010869275 0.000000000
dxz 0 -0.006930267 -0.006930267 -0.013860534 0.000000000
dyz 0 -0.006933241 -0.006933241 -0.013866483 0.000000000
sum over m -0.030750077 -0.030750077 -0.061500154 0.000000000
sum over m+mul -0.030750077 -0.030750077 -0.061500154 0.000000000
191 O Up spin Down spin Sum Diff
multiple
s 0 0.893877889 0.893877889 1.787755777 0.000000000
sum over m 0.893877889 0.893877889 1.787755777 0.000000000
s 1 -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m+mul 0.890836748 0.890836748 1.781673495 0.000000000
px 0 0.787030508 0.787030508 1.574061017 0.000000000
py 0 0.786864481 0.786864481 1.573728962 0.000000000
pz 0 0.779832476 0.779832476 1.559664951 0.000000000
sum over m 2.353727465 2.353727465 4.707454930 0.000000000
px 1 -0.008742331 -0.008742331 -0.017484663 0.000000000
py 1 -0.008727804 -0.008727804 -0.017455608 0.000000000
pz 1 -0.006466676 -0.006466676 -0.012933352 0.000000000
sum over m -0.023936811 -0.023936811 -0.047873622 0.000000000
sum over m+mul 2.329790654 2.329790654 4.659581308 0.000000000
d3z^2-r^2 0 -0.006390882 -0.006390882 -0.012781764 0.000000000
dx^2-y^2 0 -0.005059703 -0.005059703 -0.010119406 0.000000000
dxy 0 -0.005434362 -0.005434362 -0.010868723 0.000000000
dxz 0 -0.006929750 -0.006929750 -0.013859500 0.000000000
dyz 0 -0.006933518 -0.006933518 -0.013867035 0.000000000
sum over m -0.030748214 -0.030748214 -0.061496428 0.000000000
sum over m+mul -0.030748214 -0.030748214 -0.061496428 0.000000000
192 O Up spin Down spin Sum Diff
multiple
s 0 0.893912791 0.893912791 1.787825582 0.000000000
sum over m 0.893912791 0.893912791 1.787825582 0.000000000
s 1 -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m+mul 0.890871448 0.890871448 1.781742896 0.000000000
px 0 0.786870148 0.786870148 1.573740297 0.000000000
py 0 0.787115831 0.787115831 1.574231661 0.000000000
pz 0 0.779754650 0.779754650 1.559509300 0.000000000
sum over m 2.353740629 2.353740629 4.707481258 0.000000000
px 1 -0.008737390 -0.008737390 -0.017474781 0.000000000
py 1 -0.008744205 -0.008744205 -0.017488409 0.000000000
pz 1 -0.006463247 -0.006463247 -0.012926494 0.000000000
sum over m -0.023944842 -0.023944842 -0.047889684 0.000000000
sum over m+mul 2.329795787 2.329795787 4.659591574 0.000000000
d3z^2-r^2 0 -0.006392167 -0.006392167 -0.012784335 0.000000000
dx^2-y^2 0 -0.005057196 -0.005057196 -0.010114392 0.000000000
dxy 0 -0.005435295 -0.005435295 -0.010870589 0.000000000
dxz 0 -0.006930221 -0.006930221 -0.013860442 0.000000000
dyz 0 -0.006926335 -0.006926335 -0.013852670 0.000000000
sum over m -0.030741214 -0.030741214 -0.061482428 0.000000000
sum over m+mul -0.030741214 -0.030741214 -0.061482428 0.000000000
193 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778916 1.000778916 2.001557832 0.000000000
sum over m 1.000778916 1.000778916 2.001557832 0.000000000
s 1 0.207409563 0.207409563 0.414819127 0.000000000
sum over m 0.207409563 0.207409563 0.414819127 0.000000000
s 2 0.014724051 0.014724051 0.029448102 0.000000000
sum over m 0.014724051 0.014724051 0.029448102 0.000000000
sum over m+mul 1.222912530 1.222912530 2.445825061 0.000000000
px 0 1.006374183 1.006374183 2.012748366 0.000000000
py 0 1.006362420 1.006362420 2.012724841 0.000000000
pz 0 1.006209865 1.006209865 2.012419730 0.000000000
sum over m 3.018946468 3.018946468 6.037892936 0.000000000
px 1 0.065429433 0.065429433 0.130858866 0.000000000
py 1 0.065443904 0.065443904 0.130887809 0.000000000
pz 1 0.040370974 0.040370974 0.080741948 0.000000000
sum over m 0.171244311 0.171244311 0.342488622 0.000000000
sum over m+mul 3.190190779 3.190190779 6.380381559 0.000000000
d3z^2-r^2 0 0.196318572 0.196318572 0.392637143 0.000000000
dx^2-y^2 0 0.201518580 0.201518580 0.403037161 0.000000000
dxy 0 0.250943859 0.250943859 0.501887717 0.000000000
dxz 0 0.268483071 0.268483071 0.536966142 0.000000000
dyz 0 0.268501702 0.268501702 0.537003404 0.000000000
sum over m 1.185765783 1.185765783 2.371531567 0.000000000
d3z^2-r^2 1 0.003475678 0.003475678 0.006951357 0.000000000
dx^2-y^2 1 -0.004478521 -0.004478521 -0.008957041 0.000000000
dxy 1 0.015343154 0.015343154 0.030686307 0.000000000
dxz 1 0.003492711 0.003492711 0.006985422 0.000000000
dyz 1 0.003494748 0.003494748 0.006989496 0.000000000
sum over m 0.021327770 0.021327770 0.042655541 0.000000000
sum over m+mul 1.207093554 1.207093554 2.414187107 0.000000000
194 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000792991 1.000792991 2.001585981 0.000000000
sum over m 1.000792991 1.000792991 2.001585981 0.000000000
s 1 0.207390820 0.207390820 0.414781640 0.000000000
sum over m 0.207390820 0.207390820 0.414781640 0.000000000
s 2 0.014720510 0.014720510 0.029441020 0.000000000
sum over m 0.014720510 0.014720510 0.029441020 0.000000000
sum over m+mul 1.222904321 1.222904321 2.445808642 0.000000000
px 0 1.006384887 1.006384887 2.012769774 0.000000000
py 0 1.006377573 1.006377573 2.012755145 0.000000000
pz 0 1.006212343 1.006212343 2.012424686 0.000000000
sum over m 3.018974803 3.018974803 6.037949606 0.000000000
px 1 0.065437539 0.065437539 0.130875078 0.000000000
py 1 0.065446611 0.065446611 0.130893222 0.000000000
pz 1 0.040352263 0.040352263 0.080704526 0.000000000
sum over m 0.171236413 0.171236413 0.342472826 0.000000000
sum over m+mul 3.190211216 3.190211216 6.380422432 0.000000000
d3z^2-r^2 0 0.196306883 0.196306883 0.392613765 0.000000000
dx^2-y^2 0 0.201535544 0.201535544 0.403071088 0.000000000
dxy 0 0.250924809 0.250924809 0.501849618 0.000000000
dxz 0 0.268487707 0.268487707 0.536975415 0.000000000
dyz 0 0.268500321 0.268500321 0.537000642 0.000000000
sum over m 1.185755264 1.185755264 2.371510529 0.000000000
d3z^2-r^2 1 0.003469984 0.003469984 0.006939968 0.000000000
dx^2-y^2 1 -0.004484206 -0.004484206 -0.008968412 0.000000000
dxy 1 0.015344325 0.015344325 0.030688651 0.000000000
dxz 1 0.003485635 0.003485635 0.006971270 0.000000000
dyz 1 0.003487590 0.003487590 0.006975180 0.000000000
sum over m 0.021303329 0.021303329 0.042606657 0.000000000
sum over m+mul 1.207058593 1.207058593 2.414117186 0.000000000
195 O Up spin Down spin Sum Diff
multiple
s 0 0.893905185 0.893905185 1.787810370 0.000000000
sum over m 0.893905185 0.893905185 1.787810370 0.000000000
s 1 -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m+mul 0.890862675 0.890862675 1.781725349 0.000000000
px 0 0.787002996 0.787002996 1.574005991 0.000000000
py 0 0.787059160 0.787059160 1.574118321 0.000000000
pz 0 0.779696595 0.779696595 1.559393190 0.000000000
sum over m 2.353758751 2.353758751 4.707517502 0.000000000
px 1 -0.008735018 -0.008735018 -0.017470036 0.000000000
py 1 -0.008733168 -0.008733168 -0.017466336 0.000000000
pz 1 -0.006457441 -0.006457441 -0.012914882 0.000000000
sum over m -0.023925627 -0.023925627 -0.047851254 0.000000000
sum over m+mul 2.329833124 2.329833124 4.659666248 0.000000000
d3z^2-r^2 0 -0.006390179 -0.006390179 -0.012780358 0.000000000
dx^2-y^2 0 -0.005053263 -0.005053263 -0.010106526 0.000000000
dxy 0 -0.005435079 -0.005435079 -0.010870159 0.000000000
dxz 0 -0.006924637 -0.006924637 -0.013849274 0.000000000
dyz 0 -0.006925305 -0.006925305 -0.013850609 0.000000000
sum over m -0.030728463 -0.030728463 -0.061456926 0.000000000
sum over m+mul -0.030728463 -0.030728463 -0.061456926 0.000000000
196 O Up spin Down spin Sum Diff
multiple
s 0 0.893888928 0.893888928 1.787777856 0.000000000
sum over m 0.893888928 0.893888928 1.787777856 0.000000000
s 1 -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m+mul 0.890848292 0.890848292 1.781696584 0.000000000
px 0 0.787028939 0.787028939 1.574057878 0.000000000
py 0 0.786865217 0.786865217 1.573730434 0.000000000
pz 0 0.779830101 0.779830101 1.559660202 0.000000000
sum over m 2.353724257 2.353724257 4.707448514 0.000000000
px 1 -0.008744757 -0.008744757 -0.017489514 0.000000000
py 1 -0.008732655 -0.008732655 -0.017465311 0.000000000
pz 1 -0.006466405 -0.006466405 -0.012932810 0.000000000
sum over m -0.023943817 -0.023943817 -0.047887635 0.000000000
sum over m+mul 2.329780439 2.329780439 4.659560879 0.000000000
d3z^2-r^2 0 -0.006391873 -0.006391873 -0.012783746 0.000000000
dx^2-y^2 0 -0.005060058 -0.005060058 -0.010120116 0.000000000
dxy 0 -0.005434637 -0.005434637 -0.010869275 0.000000000
dxz 0 -0.006930267 -0.006930267 -0.013860534 0.000000000
dyz 0 -0.006933241 -0.006933241 -0.013866483 0.000000000
sum over m -0.030750077 -0.030750077 -0.061500154 0.000000000
sum over m+mul -0.030750077 -0.030750077 -0.061500154 0.000000000
197 O Up spin Down spin Sum Diff
multiple
s 0 0.893877889 0.893877889 1.787755777 0.000000000
sum over m 0.893877889 0.893877889 1.787755777 0.000000000
s 1 -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m+mul 0.890836748 0.890836748 1.781673495 0.000000000
px 0 0.787030508 0.787030508 1.574061017 0.000000000
py 0 0.786864481 0.786864481 1.573728963 0.000000000
pz 0 0.779832476 0.779832476 1.559664951 0.000000000
sum over m 2.353727465 2.353727465 4.707454931 0.000000000
px 1 -0.008742331 -0.008742331 -0.017484663 0.000000000
py 1 -0.008727804 -0.008727804 -0.017455608 0.000000000
pz 1 -0.006466676 -0.006466676 -0.012933352 0.000000000
sum over m -0.023936811 -0.023936811 -0.047873622 0.000000000
sum over m+mul 2.329790654 2.329790654 4.659581308 0.000000000
d3z^2-r^2 0 -0.006390882 -0.006390882 -0.012781764 0.000000000
dx^2-y^2 0 -0.005059703 -0.005059703 -0.010119406 0.000000000
dxy 0 -0.005434362 -0.005434362 -0.010868723 0.000000000
dxz 0 -0.006929750 -0.006929750 -0.013859500 0.000000000
dyz 0 -0.006933518 -0.006933518 -0.013867035 0.000000000
sum over m -0.030748214 -0.030748214 -0.061496428 0.000000000
sum over m+mul -0.030748214 -0.030748214 -0.061496428 0.000000000
198 O Up spin Down spin Sum Diff
multiple
s 0 0.893912791 0.893912791 1.787825582 0.000000000
sum over m 0.893912791 0.893912791 1.787825582 0.000000000
s 1 -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m+mul 0.890871448 0.890871448 1.781742896 0.000000000
px 0 0.786870148 0.786870148 1.573740297 0.000000000
py 0 0.787115831 0.787115831 1.574231662 0.000000000
pz 0 0.779754650 0.779754650 1.559509299 0.000000000
sum over m 2.353740629 2.353740629 4.707481258 0.000000000
px 1 -0.008737390 -0.008737390 -0.017474781 0.000000000
py 1 -0.008744205 -0.008744205 -0.017488409 0.000000000
pz 1 -0.006463247 -0.006463247 -0.012926494 0.000000000
sum over m -0.023944842 -0.023944842 -0.047889684 0.000000000
sum over m+mul 2.329795787 2.329795787 4.659591574 0.000000000
d3z^2-r^2 0 -0.006392167 -0.006392167 -0.012784335 0.000000000
dx^2-y^2 0 -0.005057196 -0.005057196 -0.010114392 0.000000000
dxy 0 -0.005435295 -0.005435295 -0.010870589 0.000000000
dxz 0 -0.006930221 -0.006930221 -0.013860442 0.000000000
dyz 0 -0.006926335 -0.006926335 -0.013852670 0.000000000
sum over m -0.030741214 -0.030741214 -0.061482428 0.000000000
sum over m+mul -0.030741214 -0.030741214 -0.061482428 0.000000000
199 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778916 1.000778916 2.001557832 0.000000000
sum over m 1.000778916 1.000778916 2.001557832 0.000000000
s 1 0.207409563 0.207409563 0.414819127 0.000000000
sum over m 0.207409563 0.207409563 0.414819127 0.000000000
s 2 0.014724051 0.014724051 0.029448102 0.000000000
sum over m 0.014724051 0.014724051 0.029448102 0.000000000
sum over m+mul 1.222912530 1.222912530 2.445825061 0.000000000
px 0 1.006374183 1.006374183 2.012748366 0.000000000
py 0 1.006362420 1.006362420 2.012724841 0.000000000
pz 0 1.006209865 1.006209865 2.012419730 0.000000000
sum over m 3.018946468 3.018946468 6.037892937 0.000000000
px 1 0.065429433 0.065429433 0.130858866 0.000000000
py 1 0.065443904 0.065443904 0.130887808 0.000000000
pz 1 0.040370974 0.040370974 0.080741948 0.000000000
sum over m 0.171244311 0.171244311 0.342488622 0.000000000
sum over m+mul 3.190190779 3.190190779 6.380381559 0.000000000
d3z^2-r^2 0 0.196318571 0.196318571 0.392637143 0.000000000
dx^2-y^2 0 0.201518580 0.201518580 0.403037160 0.000000000
dxy 0 0.250943858 0.250943858 0.501887717 0.000000000
dxz 0 0.268483071 0.268483071 0.536966142 0.000000000
dyz 0 0.268501702 0.268501702 0.537003404 0.000000000
sum over m 1.185765783 1.185765783 2.371531565 0.000000000
d3z^2-r^2 1 0.003475678 0.003475678 0.006951357 0.000000000
dx^2-y^2 1 -0.004478521 -0.004478521 -0.008957041 0.000000000
dxy 1 0.015343153 0.015343153 0.030686307 0.000000000
dxz 1 0.003492711 0.003492711 0.006985422 0.000000000
dyz 1 0.003494748 0.003494748 0.006989496 0.000000000
sum over m 0.021327770 0.021327770 0.042655541 0.000000000
sum over m+mul 1.207093553 1.207093553 2.414187106 0.000000000
200 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000792991 1.000792991 2.001585981 0.000000000
sum over m 1.000792991 1.000792991 2.001585981 0.000000000
s 1 0.207390820 0.207390820 0.414781640 0.000000000
sum over m 0.207390820 0.207390820 0.414781640 0.000000000
s 2 0.014720510 0.014720510 0.029441020 0.000000000
sum over m 0.014720510 0.014720510 0.029441020 0.000000000
sum over m+mul 1.222904321 1.222904321 2.445808642 0.000000000
px 0 1.006384887 1.006384887 2.012769774 0.000000000
py 0 1.006377573 1.006377573 2.012755145 0.000000000
pz 0 1.006212343 1.006212343 2.012424686 0.000000000
sum over m 3.018974803 3.018974803 6.037949606 0.000000000
px 1 0.065437539 0.065437539 0.130875078 0.000000000
py 1 0.065446611 0.065446611 0.130893222 0.000000000
pz 1 0.040352263 0.040352263 0.080704525 0.000000000
sum over m 0.171236413 0.171236413 0.342472826 0.000000000
sum over m+mul 3.190211216 3.190211216 6.380422432 0.000000000
d3z^2-r^2 0 0.196306883 0.196306883 0.392613765 0.000000000
dx^2-y^2 0 0.201535545 0.201535545 0.403071089 0.000000000
dxy 0 0.250924809 0.250924809 0.501849618 0.000000000
dxz 0 0.268487707 0.268487707 0.536975415 0.000000000
dyz 0 0.268500321 0.268500321 0.537000642 0.000000000
sum over m 1.185755265 1.185755265 2.371510529 0.000000000
d3z^2-r^2 1 0.003469984 0.003469984 0.006939968 0.000000000
dx^2-y^2 1 -0.004484206 -0.004484206 -0.008968412 0.000000000
dxy 1 0.015344325 0.015344325 0.030688651 0.000000000
dxz 1 0.003485635 0.003485635 0.006971270 0.000000000
dyz 1 0.003487590 0.003487590 0.006975180 0.000000000
sum over m 0.021303329 0.021303329 0.042606657 0.000000000
sum over m+mul 1.207058593 1.207058593 2.414117186 0.000000000
201 O Up spin Down spin Sum Diff
multiple
s 0 0.893905185 0.893905185 1.787810370 0.000000000
sum over m 0.893905185 0.893905185 1.787810370 0.000000000
s 1 -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m+mul 0.890862675 0.890862675 1.781725349 0.000000000
px 0 0.787002996 0.787002996 1.574005992 0.000000000
py 0 0.787059161 0.787059161 1.574118321 0.000000000
pz 0 0.779696595 0.779696595 1.559393190 0.000000000
sum over m 2.353758752 2.353758752 4.707517503 0.000000000
px 1 -0.008735018 -0.008735018 -0.017470036 0.000000000
py 1 -0.008733168 -0.008733168 -0.017466336 0.000000000
pz 1 -0.006457441 -0.006457441 -0.012914882 0.000000000
sum over m -0.023925627 -0.023925627 -0.047851254 0.000000000
sum over m+mul 2.329833125 2.329833125 4.659666249 0.000000000
d3z^2-r^2 0 -0.006390179 -0.006390179 -0.012780358 0.000000000
dx^2-y^2 0 -0.005053263 -0.005053263 -0.010106526 0.000000000
dxy 0 -0.005435079 -0.005435079 -0.010870159 0.000000000
dxz 0 -0.006924637 -0.006924637 -0.013849274 0.000000000
dyz 0 -0.006925305 -0.006925305 -0.013850609 0.000000000
sum over m -0.030728463 -0.030728463 -0.061456926 0.000000000
sum over m+mul -0.030728463 -0.030728463 -0.061456926 0.000000000
202 O Up spin Down spin Sum Diff
multiple
s 0 0.893888928 0.893888928 1.787777856 0.000000000
sum over m 0.893888928 0.893888928 1.787777856 0.000000000
s 1 -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m+mul 0.890848292 0.890848292 1.781696584 0.000000000
px 0 0.787028939 0.787028939 1.574057877 0.000000000
py 0 0.786865217 0.786865217 1.573730434 0.000000000
pz 0 0.779830101 0.779830101 1.559660202 0.000000000
sum over m 2.353724257 2.353724257 4.707448513 0.000000000
px 1 -0.008744757 -0.008744757 -0.017489514 0.000000000
py 1 -0.008732655 -0.008732655 -0.017465311 0.000000000
pz 1 -0.006466405 -0.006466405 -0.012932810 0.000000000
sum over m -0.023943817 -0.023943817 -0.047887635 0.000000000
sum over m+mul 2.329780439 2.329780439 4.659560878 0.000000000
d3z^2-r^2 0 -0.006391873 -0.006391873 -0.012783746 0.000000000
dx^2-y^2 0 -0.005060058 -0.005060058 -0.010120116 0.000000000
dxy 0 -0.005434637 -0.005434637 -0.010869275 0.000000000
dxz 0 -0.006930267 -0.006930267 -0.013860534 0.000000000
dyz 0 -0.006933241 -0.006933241 -0.013866483 0.000000000
sum over m -0.030750077 -0.030750077 -0.061500154 0.000000000
sum over m+mul -0.030750077 -0.030750077 -0.061500154 0.000000000
203 O Up spin Down spin Sum Diff
multiple
s 0 0.893877889 0.893877889 1.787755777 0.000000000
sum over m 0.893877889 0.893877889 1.787755777 0.000000000
s 1 -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m+mul 0.890836748 0.890836748 1.781673495 0.000000000
px 0 0.787030508 0.787030508 1.574061016 0.000000000
py 0 0.786864481 0.786864481 1.573728963 0.000000000
pz 0 0.779832476 0.779832476 1.559664952 0.000000000
sum over m 2.353727465 2.353727465 4.707454930 0.000000000
px 1 -0.008742331 -0.008742331 -0.017484663 0.000000000
py 1 -0.008727804 -0.008727804 -0.017455608 0.000000000
pz 1 -0.006466676 -0.006466676 -0.012933352 0.000000000
sum over m -0.023936811 -0.023936811 -0.047873622 0.000000000
sum over m+mul 2.329790654 2.329790654 4.659581308 0.000000000
d3z^2-r^2 0 -0.006390882 -0.006390882 -0.012781764 0.000000000
dx^2-y^2 0 -0.005059703 -0.005059703 -0.010119406 0.000000000
dxy 0 -0.005434362 -0.005434362 -0.010868723 0.000000000
dxz 0 -0.006929750 -0.006929750 -0.013859500 0.000000000
dyz 0 -0.006933518 -0.006933518 -0.013867035 0.000000000
sum over m -0.030748214 -0.030748214 -0.061496428 0.000000000
sum over m+mul -0.030748214 -0.030748214 -0.061496428 0.000000000
204 O Up spin Down spin Sum Diff
multiple
s 0 0.893912791 0.893912791 1.787825582 0.000000000
sum over m 0.893912791 0.893912791 1.787825582 0.000000000
s 1 -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m+mul 0.890871448 0.890871448 1.781742896 0.000000000
px 0 0.786870148 0.786870148 1.573740296 0.000000000
py 0 0.787115831 0.787115831 1.574231661 0.000000000
pz 0 0.779754650 0.779754650 1.559509300 0.000000000
sum over m 2.353740629 2.353740629 4.707481257 0.000000000
px 1 -0.008737390 -0.008737390 -0.017474781 0.000000000
py 1 -0.008744205 -0.008744205 -0.017488409 0.000000000
pz 1 -0.006463247 -0.006463247 -0.012926494 0.000000000
sum over m -0.023944842 -0.023944842 -0.047889684 0.000000000
sum over m+mul 2.329795787 2.329795787 4.659591573 0.000000000
d3z^2-r^2 0 -0.006392167 -0.006392167 -0.012784335 0.000000000
dx^2-y^2 0 -0.005057196 -0.005057196 -0.010114392 0.000000000
dxy 0 -0.005435295 -0.005435295 -0.010870589 0.000000000
dxz 0 -0.006930221 -0.006930221 -0.013860442 0.000000000
dyz 0 -0.006926335 -0.006926335 -0.013852670 0.000000000
sum over m -0.030741214 -0.030741214 -0.061482428 0.000000000
sum over m+mul -0.030741214 -0.030741214 -0.061482428 0.000000000
205 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778916 1.000778916 2.001557831 0.000000000
sum over m 1.000778916 1.000778916 2.001557831 0.000000000
s 1 0.207409563 0.207409563 0.414819127 0.000000000
sum over m 0.207409563 0.207409563 0.414819127 0.000000000
s 2 0.014724051 0.014724051 0.029448102 0.000000000
sum over m 0.014724051 0.014724051 0.029448102 0.000000000
sum over m+mul 1.222912530 1.222912530 2.445825060 0.000000000
px 0 1.006374183 1.006374183 2.012748366 0.000000000
py 0 1.006362420 1.006362420 2.012724841 0.000000000
pz 0 1.006209865 1.006209865 2.012419730 0.000000000
sum over m 3.018946468 3.018946468 6.037892937 0.000000000
px 1 0.065429433 0.065429433 0.130858866 0.000000000
py 1 0.065443904 0.065443904 0.130887808 0.000000000
pz 1 0.040370974 0.040370974 0.080741949 0.000000000
sum over m 0.171244311 0.171244311 0.342488623 0.000000000
sum over m+mul 3.190190780 3.190190780 6.380381559 0.000000000
d3z^2-r^2 0 0.196318571 0.196318571 0.392637143 0.000000000
dx^2-y^2 0 0.201518580 0.201518580 0.403037160 0.000000000
dxy 0 0.250943858 0.250943858 0.501887717 0.000000000
dxz 0 0.268483071 0.268483071 0.536966142 0.000000000
dyz 0 0.268501702 0.268501702 0.537003404 0.000000000
sum over m 1.185765783 1.185765783 2.371531565 0.000000000
d3z^2-r^2 1 0.003475678 0.003475678 0.006951357 0.000000000
dx^2-y^2 1 -0.004478521 -0.004478521 -0.008957041 0.000000000
dxy 1 0.015343153 0.015343153 0.030686307 0.000000000
dxz 1 0.003492711 0.003492711 0.006985422 0.000000000
dyz 1 0.003494748 0.003494748 0.006989496 0.000000000
sum over m 0.021327770 0.021327770 0.042655541 0.000000000
sum over m+mul 1.207093553 1.207093553 2.414187106 0.000000000
206 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000792991 1.000792991 2.001585981 0.000000000
sum over m 1.000792991 1.000792991 2.001585981 0.000000000
s 1 0.207390820 0.207390820 0.414781640 0.000000000
sum over m 0.207390820 0.207390820 0.414781640 0.000000000
s 2 0.014720510 0.014720510 0.029441020 0.000000000
sum over m 0.014720510 0.014720510 0.029441020 0.000000000
sum over m+mul 1.222904321 1.222904321 2.445808641 0.000000000
px 0 1.006384887 1.006384887 2.012769774 0.000000000
py 0 1.006377573 1.006377573 2.012755145 0.000000000
pz 0 1.006212343 1.006212343 2.012424686 0.000000000
sum over m 3.018974803 3.018974803 6.037949606 0.000000000
px 1 0.065437539 0.065437539 0.130875078 0.000000000
py 1 0.065446611 0.065446611 0.130893222 0.000000000
pz 1 0.040352263 0.040352263 0.080704526 0.000000000
sum over m 0.171236413 0.171236413 0.342472826 0.000000000
sum over m+mul 3.190211216 3.190211216 6.380422432 0.000000000
d3z^2-r^2 0 0.196306883 0.196306883 0.392613766 0.000000000
dx^2-y^2 0 0.201535544 0.201535544 0.403071088 0.000000000
dxy 0 0.250924809 0.250924809 0.501849619 0.000000000
dxz 0 0.268487708 0.268487708 0.536975415 0.000000000
dyz 0 0.268500321 0.268500321 0.537000642 0.000000000
sum over m 1.185755265 1.185755265 2.371510530 0.000000000
d3z^2-r^2 1 0.003469984 0.003469984 0.006939968 0.000000000
dx^2-y^2 1 -0.004484206 -0.004484206 -0.008968412 0.000000000
dxy 1 0.015344325 0.015344325 0.030688651 0.000000000
dxz 1 0.003485635 0.003485635 0.006971270 0.000000000
dyz 1 0.003487590 0.003487590 0.006975180 0.000000000
sum over m 0.021303329 0.021303329 0.042606657 0.000000000
sum over m+mul 1.207058593 1.207058593 2.414117187 0.000000000
207 O Up spin Down spin Sum Diff
multiple
s 0 0.893905185 0.893905185 1.787810370 0.000000000
sum over m 0.893905185 0.893905185 1.787810370 0.000000000
s 1 -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m+mul 0.890862675 0.890862675 1.781725349 0.000000000
px 0 0.787002996 0.787002996 1.574005991 0.000000000
py 0 0.787059160 0.787059160 1.574118321 0.000000000
pz 0 0.779696595 0.779696595 1.559393190 0.000000000
sum over m 2.353758751 2.353758751 4.707517503 0.000000000
px 1 -0.008735018 -0.008735018 -0.017470036 0.000000000
py 1 -0.008733168 -0.008733168 -0.017466336 0.000000000
pz 1 -0.006457441 -0.006457441 -0.012914882 0.000000000
sum over m -0.023925627 -0.023925627 -0.047851254 0.000000000
sum over m+mul 2.329833124 2.329833124 4.659666248 0.000000000
d3z^2-r^2 0 -0.006390179 -0.006390179 -0.012780358 0.000000000
dx^2-y^2 0 -0.005053263 -0.005053263 -0.010106526 0.000000000
dxy 0 -0.005435079 -0.005435079 -0.010870159 0.000000000
dxz 0 -0.006924637 -0.006924637 -0.013849274 0.000000000
dyz 0 -0.006925305 -0.006925305 -0.013850609 0.000000000
sum over m -0.030728463 -0.030728463 -0.061456926 0.000000000
sum over m+mul -0.030728463 -0.030728463 -0.061456926 0.000000000
208 O Up spin Down spin Sum Diff
multiple
s 0 0.893888928 0.893888928 1.787777856 0.000000000
sum over m 0.893888928 0.893888928 1.787777856 0.000000000
s 1 -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m+mul 0.890848292 0.890848292 1.781696584 0.000000000
px 0 0.787028939 0.787028939 1.574057877 0.000000000
py 0 0.786865217 0.786865217 1.573730434 0.000000000
pz 0 0.779830101 0.779830101 1.559660202 0.000000000
sum over m 2.353724257 2.353724257 4.707448513 0.000000000
px 1 -0.008744757 -0.008744757 -0.017489514 0.000000000
py 1 -0.008732655 -0.008732655 -0.017465311 0.000000000
pz 1 -0.006466405 -0.006466405 -0.012932810 0.000000000
sum over m -0.023943818 -0.023943818 -0.047887635 0.000000000
sum over m+mul 2.329780439 2.329780439 4.659560878 0.000000000
d3z^2-r^2 0 -0.006391873 -0.006391873 -0.012783746 0.000000000
dx^2-y^2 0 -0.005060058 -0.005060058 -0.010120116 0.000000000
dxy 0 -0.005434637 -0.005434637 -0.010869275 0.000000000
dxz 0 -0.006930267 -0.006930267 -0.013860534 0.000000000
dyz 0 -0.006933241 -0.006933241 -0.013866483 0.000000000
sum over m -0.030750077 -0.030750077 -0.061500154 0.000000000
sum over m+mul -0.030750077 -0.030750077 -0.061500154 0.000000000
209 O Up spin Down spin Sum Diff
multiple
s 0 0.893877889 0.893877889 1.787755777 0.000000000
sum over m 0.893877889 0.893877889 1.787755777 0.000000000
s 1 -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m+mul 0.890836748 0.890836748 1.781673495 0.000000000
px 0 0.787030508 0.787030508 1.574061016 0.000000000
py 0 0.786864481 0.786864481 1.573728963 0.000000000
pz 0 0.779832476 0.779832476 1.559664951 0.000000000
sum over m 2.353727465 2.353727465 4.707454930 0.000000000
px 1 -0.008742331 -0.008742331 -0.017484663 0.000000000
py 1 -0.008727804 -0.008727804 -0.017455608 0.000000000
pz 1 -0.006466676 -0.006466676 -0.012933352 0.000000000
sum over m -0.023936811 -0.023936811 -0.047873622 0.000000000
sum over m+mul 2.329790654 2.329790654 4.659581308 0.000000000
d3z^2-r^2 0 -0.006390882 -0.006390882 -0.012781764 0.000000000
dx^2-y^2 0 -0.005059703 -0.005059703 -0.010119406 0.000000000
dxy 0 -0.005434362 -0.005434362 -0.010868723 0.000000000
dxz 0 -0.006929750 -0.006929750 -0.013859500 0.000000000
dyz 0 -0.006933518 -0.006933518 -0.013867035 0.000000000
sum over m -0.030748214 -0.030748214 -0.061496428 0.000000000
sum over m+mul -0.030748214 -0.030748214 -0.061496428 0.000000000
210 O Up spin Down spin Sum Diff
multiple
s 0 0.893912791 0.893912791 1.787825582 0.000000000
sum over m 0.893912791 0.893912791 1.787825582 0.000000000
s 1 -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m+mul 0.890871448 0.890871448 1.781742896 0.000000000
px 0 0.786870148 0.786870148 1.573740296 0.000000000
py 0 0.787115831 0.787115831 1.574231661 0.000000000
pz 0 0.779754650 0.779754650 1.559509299 0.000000000
sum over m 2.353740628 2.353740628 4.707481257 0.000000000
px 1 -0.008737390 -0.008737390 -0.017474781 0.000000000
py 1 -0.008744205 -0.008744205 -0.017488409 0.000000000
pz 1 -0.006463247 -0.006463247 -0.012926494 0.000000000
sum over m -0.023944842 -0.023944842 -0.047889684 0.000000000
sum over m+mul 2.329795787 2.329795787 4.659591573 0.000000000
d3z^2-r^2 0 -0.006392167 -0.006392167 -0.012784335 0.000000000
dx^2-y^2 0 -0.005057196 -0.005057196 -0.010114392 0.000000000
dxy 0 -0.005435295 -0.005435295 -0.010870589 0.000000000
dxz 0 -0.006930221 -0.006930221 -0.013860442 0.000000000
dyz 0 -0.006926335 -0.006926335 -0.013852670 0.000000000
sum over m -0.030741214 -0.030741214 -0.061482428 0.000000000
sum over m+mul -0.030741214 -0.030741214 -0.061482428 0.000000000
211 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798134 1.000798134 2.001596268 0.000000000
sum over m 1.000798134 1.000798134 2.001596268 0.000000000
s 1 0.207380313 0.207380313 0.414760625 0.000000000
sum over m 0.207380313 0.207380313 0.414760625 0.000000000
s 2 0.014717122 0.014717122 0.029434244 0.000000000
sum over m 0.014717122 0.014717122 0.029434244 0.000000000
sum over m+mul 1.222895569 1.222895569 2.445791137 0.000000000
px 0 1.006399840 1.006399840 2.012799680 0.000000000
py 0 1.006395472 1.006395472 2.012790943 0.000000000
pz 0 1.006210919 1.006210919 2.012421838 0.000000000
sum over m 3.019006231 3.019006231 6.038012461 0.000000000
px 1 0.065452116 0.065452116 0.130904232 0.000000000
py 1 0.065458011 0.065458011 0.130916022 0.000000000
pz 1 0.040344786 0.040344786 0.080689572 0.000000000
sum over m 0.171254913 0.171254913 0.342509826 0.000000000
sum over m+mul 3.190261144 3.190261144 6.380522287 0.000000000
d3z^2-r^2 0 0.196308817 0.196308817 0.392617635 0.000000000
dx^2-y^2 0 0.201552618 0.201552618 0.403105236 0.000000000
dxy 0 0.250913136 0.250913136 0.501826271 0.000000000
dxz 0 0.268491880 0.268491880 0.536983760 0.000000000
dyz 0 0.268494472 0.268494472 0.536988944 0.000000000
sum over m 1.185760923 1.185760923 2.371521846 0.000000000
d3z^2-r^2 1 0.003468385 0.003468385 0.006936771 0.000000000
dx^2-y^2 1 -0.004487731 -0.004487731 -0.008975462 0.000000000
dxy 1 0.015348016 0.015348016 0.030696032 0.000000000
dxz 1 0.003485545 0.003485545 0.006971091 0.000000000
dyz 1 0.003485835 0.003485835 0.006971671 0.000000000
sum over m 0.021300051 0.021300051 0.042600102 0.000000000
sum over m+mul 1.207060974 1.207060974 2.414121948 0.000000000
212 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000799076 1.000799076 2.001598152 0.000000000
sum over m 1.000799076 1.000799076 2.001598152 0.000000000
s 1 0.207385090 0.207385090 0.414770180 0.000000000
sum over m 0.207385090 0.207385090 0.414770180 0.000000000
s 2 0.014717895 0.014717895 0.029435790 0.000000000
sum over m 0.014717895 0.014717895 0.029435790 0.000000000
sum over m+mul 1.222902061 1.222902061 2.445804121 0.000000000
px 0 1.006390549 1.006390549 2.012781099 0.000000000
py 0 1.006391330 1.006391330 2.012782660 0.000000000
pz 0 1.006204320 1.006204320 2.012408639 0.000000000
sum over m 3.018986199 3.018986199 6.037972398 0.000000000
px 1 0.065449797 0.065449797 0.130899594 0.000000000
py 1 0.065451380 0.065451380 0.130902760 0.000000000
pz 1 0.040353482 0.040353482 0.080706963 0.000000000
sum over m 0.171254659 0.171254659 0.342509318 0.000000000
sum over m+mul 3.190240858 3.190240858 6.380481716 0.000000000
d3z^2-r^2 0 0.196317011 0.196317011 0.392634022 0.000000000
dx^2-y^2 0 0.201551363 0.201551363 0.403102726 0.000000000
dxy 0 0.250916975 0.250916975 0.501833951 0.000000000
dxz 0 0.268489531 0.268489531 0.536979063 0.000000000
dyz 0 0.268486420 0.268486420 0.536972840 0.000000000
sum over m 1.185761301 1.185761301 2.371522601 0.000000000
d3z^2-r^2 1 0.003469509 0.003469509 0.006939018 0.000000000
dx^2-y^2 1 -0.004486723 -0.004486723 -0.008973445 0.000000000
dxy 1 0.015348878 0.015348878 0.030697756 0.000000000
dxz 1 0.003488409 0.003488409 0.006976818 0.000000000
dyz 1 0.003488438 0.003488438 0.006976875 0.000000000
sum over m 0.021308511 0.021308511 0.042617021 0.000000000
sum over m+mul 1.207069811 1.207069811 2.414139623 0.000000000
213 O Up spin Down spin Sum Diff
multiple
s 0 0.893914047 0.893914047 1.787828094 0.000000000
sum over m 0.893914047 0.893914047 1.787828094 0.000000000
s 1 -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m+mul 0.890873559 0.890873559 1.781747118 0.000000000
px 0 0.786884071 0.786884071 1.573768143 0.000000000
py 0 0.787076034 0.787076034 1.574152068 0.000000000
pz 0 0.779774738 0.779774738 1.559549477 0.000000000
sum over m 2.353734844 2.353734844 4.707469687 0.000000000
px 1 -0.008736786 -0.008736786 -0.017473571 0.000000000
py 1 -0.008745347 -0.008745347 -0.017490694 0.000000000
pz 1 -0.006463925 -0.006463925 -0.012927850 0.000000000
sum over m -0.023946057 -0.023946057 -0.047892115 0.000000000
sum over m+mul 2.329788786 2.329788786 4.659577572 0.000000000
d3z^2-r^2 0 -0.006392667 -0.006392667 -0.012785333 0.000000000
dx^2-y^2 0 -0.005058377 -0.005058377 -0.010116753 0.000000000
dxy 0 -0.005435601 -0.005435601 -0.010871202 0.000000000
dxz 0 -0.006930782 -0.006930782 -0.013861564 0.000000000
dyz 0 -0.006927428 -0.006927428 -0.013854856 0.000000000
sum over m -0.030744854 -0.030744854 -0.061489708 0.000000000
sum over m+mul -0.030744854 -0.030744854 -0.061489708 0.000000000
214 O Up spin Down spin Sum Diff
multiple
s 0 0.893913386 0.893913386 1.787826773 0.000000000
sum over m 0.893913386 0.893913386 1.787826773 0.000000000
s 1 -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m+mul 0.890871876 0.890871876 1.781743752 0.000000000
px 0 0.787082983 0.787082983 1.574165965 0.000000000
py 0 0.786936799 0.786936799 1.573873598 0.000000000
pz 0 0.779721609 0.779721609 1.559443218 0.000000000
sum over m 2.353741391 2.353741391 4.707482782 0.000000000
px 1 -0.008740597 -0.008740597 -0.017481195 0.000000000
py 1 -0.008738465 -0.008738465 -0.017476931 0.000000000
pz 1 -0.006462880 -0.006462880 -0.012925760 0.000000000
sum over m -0.023941942 -0.023941942 -0.047883885 0.000000000
sum over m+mul 2.329799449 2.329799449 4.659598897 0.000000000
d3z^2-r^2 0 -0.006391999 -0.006391999 -0.012783997 0.000000000
dx^2-y^2 0 -0.005055370 -0.005055370 -0.010110741 0.000000000
dxy 0 -0.005435327 -0.005435327 -0.010870653 0.000000000
dxz 0 -0.006925668 -0.006925668 -0.013851335 0.000000000
dyz 0 -0.006927532 -0.006927532 -0.013855065 0.000000000
sum over m -0.030735896 -0.030735896 -0.061471791 0.000000000
sum over m+mul -0.030735896 -0.030735896 -0.061471791 0.000000000
215 O Up spin Down spin Sum Diff
multiple
s 0 0.893869394 0.893869394 1.787738788 0.000000000
sum over m 0.893869394 0.893869394 1.787738788 0.000000000
s 1 -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m+mul 0.890828733 0.890828733 1.781657466 0.000000000
px 0 0.786883501 0.786883501 1.573767003 0.000000000
py 0 0.786946663 0.786946663 1.573893325 0.000000000
pz 0 0.779866123 0.779866123 1.559732245 0.000000000
sum over m 2.353696287 2.353696287 4.707392573 0.000000000
px 1 -0.008730798 -0.008730798 -0.017461596 0.000000000
py 1 -0.008736912 -0.008736912 -0.017473824 0.000000000
pz 1 -0.006468956 -0.006468956 -0.012937912 0.000000000
sum over m -0.023936666 -0.023936666 -0.047873332 0.000000000
sum over m+mul 2.329759621 2.329759621 4.659519242 0.000000000
d3z^2-r^2 0 -0.006391283 -0.006391283 -0.012782565 0.000000000
dx^2-y^2 0 -0.005060925 -0.005060925 -0.010121850 0.000000000
dxy 0 -0.005434026 -0.005434026 -0.010868052 0.000000000
dxz 0 -0.006933987 -0.006933987 -0.013867973 0.000000000
dyz 0 -0.006932730 -0.006932730 -0.013865459 0.000000000
sum over m -0.030752950 -0.030752950 -0.061505900 0.000000000
sum over m+mul -0.030752950 -0.030752950 -0.061505900 0.000000000
216 O Up spin Down spin Sum Diff
multiple
s 0 0.893919403 0.893919403 1.787838806 0.000000000
sum over m 0.893919403 0.893919403 1.787838806 0.000000000
s 1 -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m+mul 0.890878531 0.890878531 1.781757063 0.000000000
px 0 0.787043897 0.787043897 1.574087794 0.000000000
py 0 0.786951811 0.786951811 1.573903621 0.000000000
pz 0 0.779741404 0.779741404 1.559482808 0.000000000
sum over m 2.353737112 2.353737112 4.707474223 0.000000000
px 1 -0.008740843 -0.008740843 -0.017481686 0.000000000
py 1 -0.008739215 -0.008739215 -0.017478429 0.000000000
pz 1 -0.006464071 -0.006464071 -0.012928142 0.000000000
sum over m -0.023944129 -0.023944129 -0.047888257 0.000000000
sum over m+mul 2.329792983 2.329792983 4.659585966 0.000000000
d3z^2-r^2 0 -0.006392789 -0.006392789 -0.012785577 0.000000000
dx^2-y^2 0 -0.005056673 -0.005056673 -0.010113346 0.000000000
dxy 0 -0.005435497 -0.005435497 -0.010870994 0.000000000
dxz 0 -0.006926750 -0.006926750 -0.013853500 0.000000000
dyz 0 -0.006928318 -0.006928318 -0.013856635 0.000000000
sum over m -0.030740027 -0.030740027 -0.061480053 0.000000000
sum over m+mul -0.030740027 -0.030740027 -0.061480053 0.000000000
217 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798134 1.000798134 2.001596269 0.000000000
sum over m 1.000798134 1.000798134 2.001596269 0.000000000
s 1 0.207380312 0.207380312 0.414760625 0.000000000
sum over m 0.207380312 0.207380312 0.414760625 0.000000000
s 2 0.014717122 0.014717122 0.029434244 0.000000000
sum over m 0.014717122 0.014717122 0.029434244 0.000000000
sum over m+mul 1.222895568 1.222895568 2.445791137 0.000000000
px 0 1.006399840 1.006399840 2.012799680 0.000000000
py 0 1.006395472 1.006395472 2.012790943 0.000000000
pz 0 1.006210919 1.006210919 2.012421838 0.000000000
sum over m 3.019006230 3.019006230 6.038012461 0.000000000
px 1 0.065452116 0.065452116 0.130904232 0.000000000
py 1 0.065458011 0.065458011 0.130916022 0.000000000
pz 1 0.040344786 0.040344786 0.080689573 0.000000000
sum over m 0.171254913 0.171254913 0.342509826 0.000000000
sum over m+mul 3.190261144 3.190261144 6.380522287 0.000000000
d3z^2-r^2 0 0.196308817 0.196308817 0.392617635 0.000000000
dx^2-y^2 0 0.201552617 0.201552617 0.403105235 0.000000000
dxy 0 0.250913136 0.250913136 0.501826271 0.000000000
dxz 0 0.268491880 0.268491880 0.536983760 0.000000000
dyz 0 0.268494472 0.268494472 0.536988944 0.000000000
sum over m 1.185760922 1.185760922 2.371521845 0.000000000
d3z^2-r^2 1 0.003468385 0.003468385 0.006936771 0.000000000
dx^2-y^2 1 -0.004487731 -0.004487731 -0.008975462 0.000000000
dxy 1 0.015348016 0.015348016 0.030696032 0.000000000
dxz 1 0.003485545 0.003485545 0.006971091 0.000000000
dyz 1 0.003485835 0.003485835 0.006971671 0.000000000
sum over m 0.021300051 0.021300051 0.042600102 0.000000000
sum over m+mul 1.207060973 1.207060973 2.414121947 0.000000000
218 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000799076 1.000799076 2.001598151 0.000000000
sum over m 1.000799076 1.000799076 2.001598151 0.000000000
s 1 0.207385090 0.207385090 0.414770180 0.000000000
sum over m 0.207385090 0.207385090 0.414770180 0.000000000
s 2 0.014717895 0.014717895 0.029435790 0.000000000
sum over m 0.014717895 0.014717895 0.029435790 0.000000000
sum over m+mul 1.222902061 1.222902061 2.445804121 0.000000000
px 0 1.006390549 1.006390549 2.012781099 0.000000000
py 0 1.006391330 1.006391330 2.012782660 0.000000000
pz 0 1.006204320 1.006204320 2.012408639 0.000000000
sum over m 3.018986199 3.018986199 6.037972398 0.000000000
px 1 0.065449797 0.065449797 0.130899594 0.000000000
py 1 0.065451380 0.065451380 0.130902760 0.000000000
pz 1 0.040353482 0.040353482 0.080706963 0.000000000
sum over m 0.171254659 0.171254659 0.342509317 0.000000000
sum over m+mul 3.190240857 3.190240857 6.380481715 0.000000000
d3z^2-r^2 0 0.196317011 0.196317011 0.392634021 0.000000000
dx^2-y^2 0 0.201551363 0.201551363 0.403102726 0.000000000
dxy 0 0.250916975 0.250916975 0.501833950 0.000000000
dxz 0 0.268489531 0.268489531 0.536979062 0.000000000
dyz 0 0.268486420 0.268486420 0.536972840 0.000000000
sum over m 1.185761300 1.185761300 2.371522601 0.000000000
d3z^2-r^2 1 0.003469509 0.003469509 0.006939018 0.000000000
dx^2-y^2 1 -0.004486722 -0.004486722 -0.008973445 0.000000000
dxy 1 0.015348878 0.015348878 0.030697755 0.000000000
dxz 1 0.003488409 0.003488409 0.006976818 0.000000000
dyz 1 0.003488438 0.003488438 0.006976875 0.000000000
sum over m 0.021308511 0.021308511 0.042617021 0.000000000
sum over m+mul 1.207069811 1.207069811 2.414139622 0.000000000
219 O Up spin Down spin Sum Diff
multiple
s 0 0.893914047 0.893914047 1.787828094 0.000000000
sum over m 0.893914047 0.893914047 1.787828094 0.000000000
s 1 -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m+mul 0.890873559 0.890873559 1.781747118 0.000000000
px 0 0.786884071 0.786884071 1.573768142 0.000000000
py 0 0.787076034 0.787076034 1.574152068 0.000000000
pz 0 0.779774738 0.779774738 1.559549477 0.000000000
sum over m 2.353734843 2.353734843 4.707469687 0.000000000
px 1 -0.008736786 -0.008736786 -0.017473571 0.000000000
py 1 -0.008745347 -0.008745347 -0.017490694 0.000000000
pz 1 -0.006463925 -0.006463925 -0.012927850 0.000000000
sum over m -0.023946058 -0.023946058 -0.047892115 0.000000000
sum over m+mul 2.329788786 2.329788786 4.659577571 0.000000000
d3z^2-r^2 0 -0.006392667 -0.006392667 -0.012785333 0.000000000
dx^2-y^2 0 -0.005058377 -0.005058377 -0.010116753 0.000000000
dxy 0 -0.005435601 -0.005435601 -0.010871202 0.000000000
dxz 0 -0.006930782 -0.006930782 -0.013861564 0.000000000
dyz 0 -0.006927428 -0.006927428 -0.013854856 0.000000000
sum over m -0.030744854 -0.030744854 -0.061489707 0.000000000
sum over m+mul -0.030744854 -0.030744854 -0.061489707 0.000000000
220 O Up spin Down spin Sum Diff
multiple
s 0 0.893913386 0.893913386 1.787826773 0.000000000
sum over m 0.893913386 0.893913386 1.787826773 0.000000000
s 1 -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m+mul 0.890871876 0.890871876 1.781743752 0.000000000
px 0 0.787082983 0.787082983 1.574165965 0.000000000
py 0 0.786936799 0.786936799 1.573873599 0.000000000
pz 0 0.779721609 0.779721609 1.559443219 0.000000000
sum over m 2.353741391 2.353741391 4.707482782 0.000000000
px 1 -0.008740597 -0.008740597 -0.017481194 0.000000000
py 1 -0.008738465 -0.008738465 -0.017476931 0.000000000
pz 1 -0.006462880 -0.006462880 -0.012925760 0.000000000
sum over m -0.023941942 -0.023941942 -0.047883885 0.000000000
sum over m+mul 2.329799449 2.329799449 4.659598897 0.000000000
d3z^2-r^2 0 -0.006391999 -0.006391999 -0.012783997 0.000000000
dx^2-y^2 0 -0.005055370 -0.005055370 -0.010110741 0.000000000
dxy 0 -0.005435327 -0.005435327 -0.010870653 0.000000000
dxz 0 -0.006925668 -0.006925668 -0.013851335 0.000000000
dyz 0 -0.006927532 -0.006927532 -0.013855065 0.000000000
sum over m -0.030735896 -0.030735896 -0.061471791 0.000000000
sum over m+mul -0.030735896 -0.030735896 -0.061471791 0.000000000
221 O Up spin Down spin Sum Diff
multiple
s 0 0.893869394 0.893869394 1.787738788 0.000000000
sum over m 0.893869394 0.893869394 1.787738788 0.000000000
s 1 -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m+mul 0.890828733 0.890828733 1.781657466 0.000000000
px 0 0.786883501 0.786883501 1.573767002 0.000000000
py 0 0.786946663 0.786946663 1.573893326 0.000000000
pz 0 0.779866123 0.779866123 1.559732245 0.000000000
sum over m 2.353696287 2.353696287 4.707392573 0.000000000
px 1 -0.008730798 -0.008730798 -0.017461596 0.000000000
py 1 -0.008736912 -0.008736912 -0.017473824 0.000000000
pz 1 -0.006468956 -0.006468956 -0.012937911 0.000000000
sum over m -0.023936666 -0.023936666 -0.047873331 0.000000000
sum over m+mul 2.329759621 2.329759621 4.659519242 0.000000000
d3z^2-r^2 0 -0.006391283 -0.006391283 -0.012782565 0.000000000
dx^2-y^2 0 -0.005060925 -0.005060925 -0.010121850 0.000000000
dxy 0 -0.005434026 -0.005434026 -0.010868052 0.000000000
dxz 0 -0.006933987 -0.006933987 -0.013867973 0.000000000
dyz 0 -0.006932730 -0.006932730 -0.013865459 0.000000000
sum over m -0.030752950 -0.030752950 -0.061505900 0.000000000
sum over m+mul -0.030752950 -0.030752950 -0.061505900 0.000000000
222 O Up spin Down spin Sum Diff
multiple
s 0 0.893919403 0.893919403 1.787838806 0.000000000
sum over m 0.893919403 0.893919403 1.787838806 0.000000000
s 1 -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m+mul 0.890878531 0.890878531 1.781757063 0.000000000
px 0 0.787043897 0.787043897 1.574087794 0.000000000
py 0 0.786951811 0.786951811 1.573903621 0.000000000
pz 0 0.779741404 0.779741404 1.559482808 0.000000000
sum over m 2.353737112 2.353737112 4.707474224 0.000000000
px 1 -0.008740843 -0.008740843 -0.017481686 0.000000000
py 1 -0.008739215 -0.008739215 -0.017478429 0.000000000
pz 1 -0.006464071 -0.006464071 -0.012928142 0.000000000
sum over m -0.023944129 -0.023944129 -0.047888257 0.000000000
sum over m+mul 2.329792983 2.329792983 4.659585966 0.000000000
d3z^2-r^2 0 -0.006392789 -0.006392789 -0.012785577 0.000000000
dx^2-y^2 0 -0.005056673 -0.005056673 -0.010113346 0.000000000
dxy 0 -0.005435497 -0.005435497 -0.010870994 0.000000000
dxz 0 -0.006926750 -0.006926750 -0.013853500 0.000000000
dyz 0 -0.006928318 -0.006928318 -0.013856635 0.000000000
sum over m -0.030740027 -0.030740027 -0.061480053 0.000000000
sum over m+mul -0.030740027 -0.030740027 -0.061480053 0.000000000
223 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798134 1.000798134 2.001596268 0.000000000
sum over m 1.000798134 1.000798134 2.001596268 0.000000000
s 1 0.207380313 0.207380313 0.414760625 0.000000000
sum over m 0.207380313 0.207380313 0.414760625 0.000000000
s 2 0.014717122 0.014717122 0.029434244 0.000000000
sum over m 0.014717122 0.014717122 0.029434244 0.000000000
sum over m+mul 1.222895569 1.222895569 2.445791137 0.000000000
px 0 1.006399840 1.006399840 2.012799680 0.000000000
py 0 1.006395472 1.006395472 2.012790943 0.000000000
pz 0 1.006210919 1.006210919 2.012421838 0.000000000
sum over m 3.019006230 3.019006230 6.038012461 0.000000000
px 1 0.065452116 0.065452116 0.130904232 0.000000000
py 1 0.065458011 0.065458011 0.130916022 0.000000000
pz 1 0.040344786 0.040344786 0.080689572 0.000000000
sum over m 0.171254913 0.171254913 0.342509826 0.000000000
sum over m+mul 3.190261143 3.190261143 6.380522287 0.000000000
d3z^2-r^2 0 0.196308817 0.196308817 0.392617635 0.000000000
dx^2-y^2 0 0.201552617 0.201552617 0.403105235 0.000000000
dxy 0 0.250913136 0.250913136 0.501826272 0.000000000
dxz 0 0.268491880 0.268491880 0.536983760 0.000000000
dyz 0 0.268494472 0.268494472 0.536988944 0.000000000
sum over m 1.185760922 1.185760922 2.371521845 0.000000000
d3z^2-r^2 1 0.003468385 0.003468385 0.006936771 0.000000000
dx^2-y^2 1 -0.004487731 -0.004487731 -0.008975462 0.000000000
dxy 1 0.015348016 0.015348016 0.030696032 0.000000000
dxz 1 0.003485545 0.003485545 0.006971091 0.000000000
dyz 1 0.003485835 0.003485835 0.006971671 0.000000000
sum over m 0.021300051 0.021300051 0.042600102 0.000000000
sum over m+mul 1.207060974 1.207060974 2.414121947 0.000000000
224 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000799076 1.000799076 2.001598152 0.000000000
sum over m 1.000799076 1.000799076 2.001598152 0.000000000
s 1 0.207385090 0.207385090 0.414770180 0.000000000
sum over m 0.207385090 0.207385090 0.414770180 0.000000000
s 2 0.014717895 0.014717895 0.029435790 0.000000000
sum over m 0.014717895 0.014717895 0.029435790 0.000000000
sum over m+mul 1.222902061 1.222902061 2.445804122 0.000000000
px 0 1.006390549 1.006390549 2.012781099 0.000000000
py 0 1.006391330 1.006391330 2.012782660 0.000000000
pz 0 1.006204320 1.006204320 2.012408639 0.000000000
sum over m 3.018986199 3.018986199 6.037972398 0.000000000
px 1 0.065449797 0.065449797 0.130899594 0.000000000
py 1 0.065451380 0.065451380 0.130902760 0.000000000
pz 1 0.040353482 0.040353482 0.080706963 0.000000000
sum over m 0.171254659 0.171254659 0.342509317 0.000000000
sum over m+mul 3.190240858 3.190240858 6.380481715 0.000000000
d3z^2-r^2 0 0.196317011 0.196317011 0.392634022 0.000000000
dx^2-y^2 0 0.201551363 0.201551363 0.403102726 0.000000000
dxy 0 0.250916975 0.250916975 0.501833950 0.000000000
dxz 0 0.268489531 0.268489531 0.536979062 0.000000000
dyz 0 0.268486420 0.268486420 0.536972839 0.000000000
sum over m 1.185761300 1.185761300 2.371522600 0.000000000
d3z^2-r^2 1 0.003469509 0.003469509 0.006939018 0.000000000
dx^2-y^2 1 -0.004486723 -0.004486723 -0.008973445 0.000000000
dxy 1 0.015348878 0.015348878 0.030697755 0.000000000
dxz 1 0.003488409 0.003488409 0.006976818 0.000000000
dyz 1 0.003488438 0.003488438 0.006976875 0.000000000
sum over m 0.021308511 0.021308511 0.042617021 0.000000000
sum over m+mul 1.207069811 1.207069811 2.414139621 0.000000000
225 O Up spin Down spin Sum Diff
multiple
s 0 0.893914047 0.893914047 1.787828094 0.000000000
sum over m 0.893914047 0.893914047 1.787828094 0.000000000
s 1 -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m+mul 0.890873559 0.890873559 1.781747118 0.000000000
px 0 0.786884071 0.786884071 1.573768142 0.000000000
py 0 0.787076034 0.787076034 1.574152068 0.000000000
pz 0 0.779774738 0.779774738 1.559549477 0.000000000
sum over m 2.353734844 2.353734844 4.707469687 0.000000000
px 1 -0.008736786 -0.008736786 -0.017473571 0.000000000
py 1 -0.008745347 -0.008745347 -0.017490694 0.000000000
pz 1 -0.006463925 -0.006463925 -0.012927850 0.000000000
sum over m -0.023946058 -0.023946058 -0.047892115 0.000000000
sum over m+mul 2.329788786 2.329788786 4.659577572 0.000000000
d3z^2-r^2 0 -0.006392667 -0.006392667 -0.012785333 0.000000000
dx^2-y^2 0 -0.005058377 -0.005058377 -0.010116753 0.000000000
dxy 0 -0.005435601 -0.005435601 -0.010871202 0.000000000
dxz 0 -0.006930782 -0.006930782 -0.013861564 0.000000000
dyz 0 -0.006927428 -0.006927428 -0.013854856 0.000000000
sum over m -0.030744854 -0.030744854 -0.061489707 0.000000000
sum over m+mul -0.030744854 -0.030744854 -0.061489707 0.000000000
226 O Up spin Down spin Sum Diff
multiple
s 0 0.893913386 0.893913386 1.787826773 0.000000000
sum over m 0.893913386 0.893913386 1.787826773 0.000000000
s 1 -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m+mul 0.890871876 0.890871876 1.781743752 0.000000000
px 0 0.787082983 0.787082983 1.574165965 0.000000000
py 0 0.786936799 0.786936799 1.573873599 0.000000000
pz 0 0.779721610 0.779721610 1.559443219 0.000000000
sum over m 2.353741392 2.353741392 4.707482783 0.000000000
px 1 -0.008740597 -0.008740597 -0.017481194 0.000000000
py 1 -0.008738465 -0.008738465 -0.017476931 0.000000000
pz 1 -0.006462880 -0.006462880 -0.012925760 0.000000000
sum over m -0.023941942 -0.023941942 -0.047883885 0.000000000
sum over m+mul 2.329799449 2.329799449 4.659598898 0.000000000
d3z^2-r^2 0 -0.006391999 -0.006391999 -0.012783997 0.000000000
dx^2-y^2 0 -0.005055370 -0.005055370 -0.010110741 0.000000000
dxy 0 -0.005435327 -0.005435327 -0.010870653 0.000000000
dxz 0 -0.006925668 -0.006925668 -0.013851335 0.000000000
dyz 0 -0.006927532 -0.006927532 -0.013855065 0.000000000
sum over m -0.030735896 -0.030735896 -0.061471791 0.000000000
sum over m+mul -0.030735896 -0.030735896 -0.061471791 0.000000000
227 O Up spin Down spin Sum Diff
multiple
s 0 0.893869394 0.893869394 1.787738788 0.000000000
sum over m 0.893869394 0.893869394 1.787738788 0.000000000
s 1 -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m+mul 0.890828733 0.890828733 1.781657466 0.000000000
px 0 0.786883501 0.786883501 1.573767002 0.000000000
py 0 0.786946663 0.786946663 1.573893325 0.000000000
pz 0 0.779866123 0.779866123 1.559732245 0.000000000
sum over m 2.353696287 2.353696287 4.707392573 0.000000000
px 1 -0.008730798 -0.008730798 -0.017461596 0.000000000
py 1 -0.008736912 -0.008736912 -0.017473824 0.000000000
pz 1 -0.006468956 -0.006468956 -0.012937911 0.000000000
sum over m -0.023936666 -0.023936666 -0.047873332 0.000000000
sum over m+mul 2.329759621 2.329759621 4.659519241 0.000000000
d3z^2-r^2 0 -0.006391283 -0.006391283 -0.012782565 0.000000000
dx^2-y^2 0 -0.005060925 -0.005060925 -0.010121850 0.000000000
dxy 0 -0.005434026 -0.005434026 -0.010868052 0.000000000
dxz 0 -0.006933987 -0.006933987 -0.013867973 0.000000000
dyz 0 -0.006932730 -0.006932730 -0.013865459 0.000000000
sum over m -0.030752950 -0.030752950 -0.061505900 0.000000000
sum over m+mul -0.030752950 -0.030752950 -0.061505900 0.000000000
228 O Up spin Down spin Sum Diff
multiple
s 0 0.893919403 0.893919403 1.787838806 0.000000000
sum over m 0.893919403 0.893919403 1.787838806 0.000000000
s 1 -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m+mul 0.890878531 0.890878531 1.781757063 0.000000000
px 0 0.787043897 0.787043897 1.574087794 0.000000000
py 0 0.786951810 0.786951810 1.573903621 0.000000000
pz 0 0.779741404 0.779741404 1.559482808 0.000000000
sum over m 2.353737111 2.353737111 4.707474223 0.000000000
px 1 -0.008740843 -0.008740843 -0.017481686 0.000000000
py 1 -0.008739215 -0.008739215 -0.017478430 0.000000000
pz 1 -0.006464071 -0.006464071 -0.012928142 0.000000000
sum over m -0.023944129 -0.023944129 -0.047888257 0.000000000
sum over m+mul 2.329792983 2.329792983 4.659585965 0.000000000
d3z^2-r^2 0 -0.006392789 -0.006392789 -0.012785577 0.000000000
dx^2-y^2 0 -0.005056673 -0.005056673 -0.010113346 0.000000000
dxy 0 -0.005435497 -0.005435497 -0.010870994 0.000000000
dxz 0 -0.006926750 -0.006926750 -0.013853500 0.000000000
dyz 0 -0.006928318 -0.006928318 -0.013856635 0.000000000
sum over m -0.030740027 -0.030740027 -0.061480053 0.000000000
sum over m+mul -0.030740027 -0.030740027 -0.061480053 0.000000000
229 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798134 1.000798134 2.001596268 0.000000000
sum over m 1.000798134 1.000798134 2.001596268 0.000000000
s 1 0.207380312 0.207380312 0.414760625 0.000000000
sum over m 0.207380312 0.207380312 0.414760625 0.000000000
s 2 0.014717122 0.014717122 0.029434244 0.000000000
sum over m 0.014717122 0.014717122 0.029434244 0.000000000
sum over m+mul 1.222895568 1.222895568 2.445791137 0.000000000
px 0 1.006399840 1.006399840 2.012799680 0.000000000
py 0 1.006395472 1.006395472 2.012790943 0.000000000
pz 0 1.006210919 1.006210919 2.012421838 0.000000000
sum over m 3.019006230 3.019006230 6.038012461 0.000000000
px 1 0.065452116 0.065452116 0.130904232 0.000000000
py 1 0.065458011 0.065458011 0.130916021 0.000000000
pz 1 0.040344786 0.040344786 0.080689572 0.000000000
sum over m 0.171254913 0.171254913 0.342509826 0.000000000
sum over m+mul 3.190261144 3.190261144 6.380522287 0.000000000
d3z^2-r^2 0 0.196308817 0.196308817 0.392617635 0.000000000
dx^2-y^2 0 0.201552617 0.201552617 0.403105235 0.000000000
dxy 0 0.250913136 0.250913136 0.501826272 0.000000000
dxz 0 0.268491879 0.268491879 0.536983759 0.000000000
dyz 0 0.268494472 0.268494472 0.536988944 0.000000000
sum over m 1.185760922 1.185760922 2.371521844 0.000000000
d3z^2-r^2 1 0.003468385 0.003468385 0.006936771 0.000000000
dx^2-y^2 1 -0.004487731 -0.004487731 -0.008975462 0.000000000
dxy 1 0.015348016 0.015348016 0.030696032 0.000000000
dxz 1 0.003485545 0.003485545 0.006971091 0.000000000
dyz 1 0.003485835 0.003485835 0.006971671 0.000000000
sum over m 0.021300051 0.021300051 0.042600102 0.000000000
sum over m+mul 1.207060973 1.207060973 2.414121946 0.000000000
230 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000799076 1.000799076 2.001598152 0.000000000
sum over m 1.000799076 1.000799076 2.001598152 0.000000000
s 1 0.207385090 0.207385090 0.414770180 0.000000000
sum over m 0.207385090 0.207385090 0.414770180 0.000000000
s 2 0.014717895 0.014717895 0.029435790 0.000000000
sum over m 0.014717895 0.014717895 0.029435790 0.000000000
sum over m+mul 1.222902061 1.222902061 2.445804122 0.000000000
px 0 1.006390549 1.006390549 2.012781099 0.000000000
py 0 1.006391330 1.006391330 2.012782660 0.000000000
pz 0 1.006204320 1.006204320 2.012408639 0.000000000
sum over m 3.018986199 3.018986199 6.037972398 0.000000000
px 1 0.065449797 0.065449797 0.130899594 0.000000000
py 1 0.065451380 0.065451380 0.130902760 0.000000000
pz 1 0.040353482 0.040353482 0.080706963 0.000000000
sum over m 0.171254659 0.171254659 0.342509317 0.000000000
sum over m+mul 3.190240857 3.190240857 6.380481715 0.000000000
d3z^2-r^2 0 0.196317011 0.196317011 0.392634022 0.000000000
dx^2-y^2 0 0.201551363 0.201551363 0.403102726 0.000000000
dxy 0 0.250916975 0.250916975 0.501833950 0.000000000
dxz 0 0.268489531 0.268489531 0.536979062 0.000000000
dyz 0 0.268486420 0.268486420 0.536972840 0.000000000
sum over m 1.185761300 1.185761300 2.371522600 0.000000000
d3z^2-r^2 1 0.003469509 0.003469509 0.006939018 0.000000000
dx^2-y^2 1 -0.004486722 -0.004486722 -0.008973445 0.000000000
dxy 1 0.015348878 0.015348878 0.030697755 0.000000000
dxz 1 0.003488409 0.003488409 0.006976818 0.000000000
dyz 1 0.003488438 0.003488438 0.006976875 0.000000000
sum over m 0.021308511 0.021308511 0.042617021 0.000000000
sum over m+mul 1.207069811 1.207069811 2.414139621 0.000000000
231 O Up spin Down spin Sum Diff
multiple
s 0 0.893914047 0.893914047 1.787828094 0.000000000
sum over m 0.893914047 0.893914047 1.787828094 0.000000000
s 1 -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m+mul 0.890873559 0.890873559 1.781747118 0.000000000
px 0 0.786884071 0.786884071 1.573768142 0.000000000
py 0 0.787076034 0.787076034 1.574152068 0.000000000
pz 0 0.779774739 0.779774739 1.559549477 0.000000000
sum over m 2.353734844 2.353734844 4.707469688 0.000000000
px 1 -0.008736786 -0.008736786 -0.017473571 0.000000000
py 1 -0.008745347 -0.008745347 -0.017490694 0.000000000
pz 1 -0.006463925 -0.006463925 -0.012927850 0.000000000
sum over m -0.023946058 -0.023946058 -0.047892115 0.000000000
sum over m+mul 2.329788786 2.329788786 4.659577573 0.000000000
d3z^2-r^2 0 -0.006392667 -0.006392667 -0.012785333 0.000000000
dx^2-y^2 0 -0.005058377 -0.005058377 -0.010116753 0.000000000
dxy 0 -0.005435601 -0.005435601 -0.010871202 0.000000000
dxz 0 -0.006930782 -0.006930782 -0.013861564 0.000000000
dyz 0 -0.006927428 -0.006927428 -0.013854856 0.000000000
sum over m -0.030744854 -0.030744854 -0.061489708 0.000000000
sum over m+mul -0.030744854 -0.030744854 -0.061489708 0.000000000
232 O Up spin Down spin Sum Diff
multiple
s 0 0.893913386 0.893913386 1.787826773 0.000000000
sum over m 0.893913386 0.893913386 1.787826773 0.000000000
s 1 -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m+mul 0.890871876 0.890871876 1.781743752 0.000000000
px 0 0.787082983 0.787082983 1.574165966 0.000000000
py 0 0.786936799 0.786936799 1.573873599 0.000000000
pz 0 0.779721609 0.779721609 1.559443219 0.000000000
sum over m 2.353741392 2.353741392 4.707482783 0.000000000
px 1 -0.008740597 -0.008740597 -0.017481195 0.000000000
py 1 -0.008738465 -0.008738465 -0.017476931 0.000000000
pz 1 -0.006462880 -0.006462880 -0.012925760 0.000000000
sum over m -0.023941942 -0.023941942 -0.047883885 0.000000000
sum over m+mul 2.329799449 2.329799449 4.659598898 0.000000000
d3z^2-r^2 0 -0.006391999 -0.006391999 -0.012783997 0.000000000
dx^2-y^2 0 -0.005055370 -0.005055370 -0.010110741 0.000000000
dxy 0 -0.005435327 -0.005435327 -0.010870653 0.000000000
dxz 0 -0.006925668 -0.006925668 -0.013851335 0.000000000
dyz 0 -0.006927532 -0.006927532 -0.013855065 0.000000000
sum over m -0.030735896 -0.030735896 -0.061471791 0.000000000
sum over m+mul -0.030735896 -0.030735896 -0.061471791 0.000000000
233 O Up spin Down spin Sum Diff
multiple
s 0 0.893869394 0.893869394 1.787738788 0.000000000
sum over m 0.893869394 0.893869394 1.787738788 0.000000000
s 1 -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m+mul 0.890828733 0.890828733 1.781657466 0.000000000
px 0 0.786883501 0.786883501 1.573767002 0.000000000
py 0 0.786946663 0.786946663 1.573893326 0.000000000
pz 0 0.779866123 0.779866123 1.559732245 0.000000000
sum over m 2.353696286 2.353696286 4.707392573 0.000000000
px 1 -0.008730798 -0.008730798 -0.017461596 0.000000000
py 1 -0.008736912 -0.008736912 -0.017473824 0.000000000
pz 1 -0.006468956 -0.006468956 -0.012937911 0.000000000
sum over m -0.023936666 -0.023936666 -0.047873331 0.000000000
sum over m+mul 2.329759621 2.329759621 4.659519242 0.000000000
d3z^2-r^2 0 -0.006391283 -0.006391283 -0.012782565 0.000000000
dx^2-y^2 0 -0.005060925 -0.005060925 -0.010121850 0.000000000
dxy 0 -0.005434026 -0.005434026 -0.010868052 0.000000000
dxz 0 -0.006933987 -0.006933987 -0.013867973 0.000000000
dyz 0 -0.006932730 -0.006932730 -0.013865459 0.000000000
sum over m -0.030752950 -0.030752950 -0.061505900 0.000000000
sum over m+mul -0.030752950 -0.030752950 -0.061505900 0.000000000
234 O Up spin Down spin Sum Diff
multiple
s 0 0.893919403 0.893919403 1.787838806 0.000000000
sum over m 0.893919403 0.893919403 1.787838806 0.000000000
s 1 -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m+mul 0.890878531 0.890878531 1.781757063 0.000000000
px 0 0.787043897 0.787043897 1.574087793 0.000000000
py 0 0.786951810 0.786951810 1.573903621 0.000000000
pz 0 0.779741404 0.779741404 1.559482808 0.000000000
sum over m 2.353737111 2.353737111 4.707474222 0.000000000
px 1 -0.008740843 -0.008740843 -0.017481686 0.000000000
py 1 -0.008739215 -0.008739215 -0.017478429 0.000000000
pz 1 -0.006464071 -0.006464071 -0.012928142 0.000000000
sum over m -0.023944129 -0.023944129 -0.047888257 0.000000000
sum over m+mul 2.329792982 2.329792982 4.659585965 0.000000000
d3z^2-r^2 0 -0.006392789 -0.006392789 -0.012785577 0.000000000
dx^2-y^2 0 -0.005056673 -0.005056673 -0.010113346 0.000000000
dxy 0 -0.005435497 -0.005435497 -0.010870994 0.000000000
dxz 0 -0.006926750 -0.006926750 -0.013853500 0.000000000
dyz 0 -0.006928318 -0.006928318 -0.013856635 0.000000000
sum over m -0.030740027 -0.030740027 -0.061480053 0.000000000
sum over m+mul -0.030740027 -0.030740027 -0.061480053 0.000000000
235 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798134 1.000798134 2.001596268 0.000000000
sum over m 1.000798134 1.000798134 2.001596268 0.000000000
s 1 0.207380312 0.207380312 0.414760625 0.000000000
sum over m 0.207380312 0.207380312 0.414760625 0.000000000
s 2 0.014717122 0.014717122 0.029434244 0.000000000
sum over m 0.014717122 0.014717122 0.029434244 0.000000000
sum over m+mul 1.222895568 1.222895568 2.445791137 0.000000000
px 0 1.006399840 1.006399840 2.012799680 0.000000000
py 0 1.006395472 1.006395472 2.012790943 0.000000000
pz 0 1.006210919 1.006210919 2.012421838 0.000000000
sum over m 3.019006230 3.019006230 6.038012461 0.000000000
px 1 0.065452116 0.065452116 0.130904232 0.000000000
py 1 0.065458011 0.065458011 0.130916022 0.000000000
pz 1 0.040344786 0.040344786 0.080689572 0.000000000
sum over m 0.171254913 0.171254913 0.342509826 0.000000000
sum over m+mul 3.190261143 3.190261143 6.380522287 0.000000000
d3z^2-r^2 0 0.196308817 0.196308817 0.392617635 0.000000000
dx^2-y^2 0 0.201552618 0.201552618 0.403105235 0.000000000
dxy 0 0.250913136 0.250913136 0.501826271 0.000000000
dxz 0 0.268491880 0.268491880 0.536983759 0.000000000
dyz 0 0.268494472 0.268494472 0.536988944 0.000000000
sum over m 1.185760922 1.185760922 2.371521844 0.000000000
d3z^2-r^2 1 0.003468385 0.003468385 0.006936771 0.000000000
dx^2-y^2 1 -0.004487731 -0.004487731 -0.008975462 0.000000000
dxy 1 0.015348016 0.015348016 0.030696032 0.000000000
dxz 1 0.003485545 0.003485545 0.006971091 0.000000000
dyz 1 0.003485835 0.003485835 0.006971671 0.000000000
sum over m 0.021300051 0.021300051 0.042600102 0.000000000
sum over m+mul 1.207060973 1.207060973 2.414121946 0.000000000
236 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000799076 1.000799076 2.001598152 0.000000000
sum over m 1.000799076 1.000799076 2.001598152 0.000000000
s 1 0.207385090 0.207385090 0.414770180 0.000000000
sum over m 0.207385090 0.207385090 0.414770180 0.000000000
s 2 0.014717895 0.014717895 0.029435790 0.000000000
sum over m 0.014717895 0.014717895 0.029435790 0.000000000
sum over m+mul 1.222902061 1.222902061 2.445804122 0.000000000
px 0 1.006390549 1.006390549 2.012781099 0.000000000
py 0 1.006391330 1.006391330 2.012782660 0.000000000
pz 0 1.006204320 1.006204320 2.012408639 0.000000000
sum over m 3.018986199 3.018986199 6.037972398 0.000000000
px 1 0.065449797 0.065449797 0.130899594 0.000000000
py 1 0.065451380 0.065451380 0.130902760 0.000000000
pz 1 0.040353482 0.040353482 0.080706963 0.000000000
sum over m 0.171254659 0.171254659 0.342509317 0.000000000
sum over m+mul 3.190240857 3.190240857 6.380481715 0.000000000
d3z^2-r^2 0 0.196317011 0.196317011 0.392634022 0.000000000
dx^2-y^2 0 0.201551363 0.201551363 0.403102726 0.000000000
dxy 0 0.250916975 0.250916975 0.501833950 0.000000000
dxz 0 0.268489531 0.268489531 0.536979062 0.000000000
dyz 0 0.268486420 0.268486420 0.536972840 0.000000000
sum over m 1.185761300 1.185761300 2.371522600 0.000000000
d3z^2-r^2 1 0.003469509 0.003469509 0.006939018 0.000000000
dx^2-y^2 1 -0.004486723 -0.004486723 -0.008973445 0.000000000
dxy 1 0.015348878 0.015348878 0.030697756 0.000000000
dxz 1 0.003488409 0.003488409 0.006976818 0.000000000
dyz 1 0.003488438 0.003488438 0.006976875 0.000000000
sum over m 0.021308511 0.021308511 0.042617021 0.000000000
sum over m+mul 1.207069811 1.207069811 2.414139621 0.000000000
237 O Up spin Down spin Sum Diff
multiple
s 0 0.893914047 0.893914047 1.787828094 0.000000000
sum over m 0.893914047 0.893914047 1.787828094 0.000000000
s 1 -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m+mul 0.890873559 0.890873559 1.781747118 0.000000000
px 0 0.786884071 0.786884071 1.573768142 0.000000000
py 0 0.787076034 0.787076034 1.574152068 0.000000000
pz 0 0.779774738 0.779774738 1.559549477 0.000000000
sum over m 2.353734844 2.353734844 4.707469687 0.000000000
px 1 -0.008736786 -0.008736786 -0.017473571 0.000000000
py 1 -0.008745347 -0.008745347 -0.017490694 0.000000000
pz 1 -0.006463925 -0.006463925 -0.012927850 0.000000000
sum over m -0.023946058 -0.023946058 -0.047892115 0.000000000
sum over m+mul 2.329788786 2.329788786 4.659577572 0.000000000
d3z^2-r^2 0 -0.006392667 -0.006392667 -0.012785333 0.000000000
dx^2-y^2 0 -0.005058377 -0.005058377 -0.010116753 0.000000000
dxy 0 -0.005435601 -0.005435601 -0.010871202 0.000000000
dxz 0 -0.006930782 -0.006930782 -0.013861564 0.000000000
dyz 0 -0.006927428 -0.006927428 -0.013854856 0.000000000
sum over m -0.030744854 -0.030744854 -0.061489708 0.000000000
sum over m+mul -0.030744854 -0.030744854 -0.061489708 0.000000000
238 O Up spin Down spin Sum Diff
multiple
s 0 0.893913386 0.893913386 1.787826773 0.000000000
sum over m 0.893913386 0.893913386 1.787826773 0.000000000
s 1 -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m+mul 0.890871876 0.890871876 1.781743752 0.000000000
px 0 0.787082983 0.787082983 1.574165965 0.000000000
py 0 0.786936799 0.786936799 1.573873598 0.000000000
pz 0 0.779721609 0.779721609 1.559443219 0.000000000
sum over m 2.353741391 2.353741391 4.707482782 0.000000000
px 1 -0.008740597 -0.008740597 -0.017481195 0.000000000
py 1 -0.008738465 -0.008738465 -0.017476931 0.000000000
pz 1 -0.006462880 -0.006462880 -0.012925760 0.000000000
sum over m -0.023941942 -0.023941942 -0.047883885 0.000000000
sum over m+mul 2.329799449 2.329799449 4.659598897 0.000000000
d3z^2-r^2 0 -0.006391999 -0.006391999 -0.012783997 0.000000000
dx^2-y^2 0 -0.005055370 -0.005055370 -0.010110741 0.000000000
dxy 0 -0.005435327 -0.005435327 -0.010870653 0.000000000
dxz 0 -0.006925668 -0.006925668 -0.013851335 0.000000000
dyz 0 -0.006927532 -0.006927532 -0.013855065 0.000000000
sum over m -0.030735896 -0.030735896 -0.061471791 0.000000000
sum over m+mul -0.030735896 -0.030735896 -0.061471791 0.000000000
239 O Up spin Down spin Sum Diff
multiple
s 0 0.893869394 0.893869394 1.787738788 0.000000000
sum over m 0.893869394 0.893869394 1.787738788 0.000000000
s 1 -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m+mul 0.890828733 0.890828733 1.781657466 0.000000000
px 0 0.786883501 0.786883501 1.573767002 0.000000000
py 0 0.786946663 0.786946663 1.573893325 0.000000000
pz 0 0.779866123 0.779866123 1.559732245 0.000000000
sum over m 2.353696287 2.353696287 4.707392573 0.000000000
px 1 -0.008730798 -0.008730798 -0.017461596 0.000000000
py 1 -0.008736912 -0.008736912 -0.017473824 0.000000000
pz 1 -0.006468956 -0.006468956 -0.012937911 0.000000000
sum over m -0.023936666 -0.023936666 -0.047873331 0.000000000
sum over m+mul 2.329759621 2.329759621 4.659519242 0.000000000
d3z^2-r^2 0 -0.006391283 -0.006391283 -0.012782565 0.000000000
dx^2-y^2 0 -0.005060925 -0.005060925 -0.010121850 0.000000000
dxy 0 -0.005434026 -0.005434026 -0.010868052 0.000000000
dxz 0 -0.006933987 -0.006933987 -0.013867973 0.000000000
dyz 0 -0.006932730 -0.006932730 -0.013865459 0.000000000
sum over m -0.030752950 -0.030752950 -0.061505900 0.000000000
sum over m+mul -0.030752950 -0.030752950 -0.061505900 0.000000000
240 O Up spin Down spin Sum Diff
multiple
s 0 0.893919403 0.893919403 1.787838806 0.000000000
sum over m 0.893919403 0.893919403 1.787838806 0.000000000
s 1 -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m+mul 0.890878531 0.890878531 1.781757063 0.000000000
px 0 0.787043897 0.787043897 1.574087794 0.000000000
py 0 0.786951810 0.786951810 1.573903621 0.000000000
pz 0 0.779741404 0.779741404 1.559482809 0.000000000
sum over m 2.353737112 2.353737112 4.707474223 0.000000000
px 1 -0.008740843 -0.008740843 -0.017481686 0.000000000
py 1 -0.008739215 -0.008739215 -0.017478430 0.000000000
pz 1 -0.006464071 -0.006464071 -0.012928142 0.000000000
sum over m -0.023944129 -0.023944129 -0.047888257 0.000000000
sum over m+mul 2.329792983 2.329792983 4.659585966 0.000000000
d3z^2-r^2 0 -0.006392789 -0.006392789 -0.012785577 0.000000000
dx^2-y^2 0 -0.005056673 -0.005056673 -0.010113346 0.000000000
dxy 0 -0.005435497 -0.005435497 -0.010870994 0.000000000
dxz 0 -0.006926750 -0.006926750 -0.013853500 0.000000000
dyz 0 -0.006928318 -0.006928318 -0.013856635 0.000000000
sum over m -0.030740026 -0.030740026 -0.061480053 0.000000000
sum over m+mul -0.030740026 -0.030740026 -0.061480053 0.000000000
241 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798134 1.000798134 2.001596268 0.000000000
sum over m 1.000798134 1.000798134 2.001596268 0.000000000
s 1 0.207380313 0.207380313 0.414760625 0.000000000
sum over m 0.207380313 0.207380313 0.414760625 0.000000000
s 2 0.014717122 0.014717122 0.029434244 0.000000000
sum over m 0.014717122 0.014717122 0.029434244 0.000000000
sum over m+mul 1.222895568 1.222895568 2.445791137 0.000000000
px 0 1.006399840 1.006399840 2.012799680 0.000000000
py 0 1.006395472 1.006395472 2.012790943 0.000000000
pz 0 1.006210919 1.006210919 2.012421838 0.000000000
sum over m 3.019006231 3.019006231 6.038012461 0.000000000
px 1 0.065452116 0.065452116 0.130904232 0.000000000
py 1 0.065458011 0.065458011 0.130916022 0.000000000
pz 1 0.040344786 0.040344786 0.080689572 0.000000000
sum over m 0.171254913 0.171254913 0.342509826 0.000000000
sum over m+mul 3.190261144 3.190261144 6.380522288 0.000000000
d3z^2-r^2 0 0.196308817 0.196308817 0.392617635 0.000000000
dx^2-y^2 0 0.201552617 0.201552617 0.403105235 0.000000000
dxy 0 0.250913136 0.250913136 0.501826271 0.000000000
dxz 0 0.268491880 0.268491880 0.536983760 0.000000000
dyz 0 0.268494472 0.268494472 0.536988944 0.000000000
sum over m 1.185760923 1.185760923 2.371521845 0.000000000
d3z^2-r^2 1 0.003468385 0.003468385 0.006936771 0.000000000
dx^2-y^2 1 -0.004487731 -0.004487731 -0.008975462 0.000000000
dxy 1 0.015348016 0.015348016 0.030696032 0.000000000
dxz 1 0.003485545 0.003485545 0.006971091 0.000000000
dyz 1 0.003485835 0.003485835 0.006971671 0.000000000
sum over m 0.021300051 0.021300051 0.042600102 0.000000000
sum over m+mul 1.207060974 1.207060974 2.414121947 0.000000000
242 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000799076 1.000799076 2.001598152 0.000000000
sum over m 1.000799076 1.000799076 2.001598152 0.000000000
s 1 0.207385090 0.207385090 0.414770180 0.000000000
sum over m 0.207385090 0.207385090 0.414770180 0.000000000
s 2 0.014717895 0.014717895 0.029435790 0.000000000
sum over m 0.014717895 0.014717895 0.029435790 0.000000000
sum over m+mul 1.222902061 1.222902061 2.445804121 0.000000000
px 0 1.006390549 1.006390549 2.012781099 0.000000000
py 0 1.006391330 1.006391330 2.012782660 0.000000000
pz 0 1.006204320 1.006204320 2.012408639 0.000000000
sum over m 3.018986199 3.018986199 6.037972398 0.000000000
px 1 0.065449797 0.065449797 0.130899595 0.000000000
py 1 0.065451380 0.065451380 0.130902760 0.000000000
pz 1 0.040353481 0.040353481 0.080706963 0.000000000
sum over m 0.171254659 0.171254659 0.342509317 0.000000000
sum over m+mul 3.190240858 3.190240858 6.380481715 0.000000000
d3z^2-r^2 0 0.196317011 0.196317011 0.392634021 0.000000000
dx^2-y^2 0 0.201551363 0.201551363 0.403102726 0.000000000
dxy 0 0.250916975 0.250916975 0.501833951 0.000000000
dxz 0 0.268489531 0.268489531 0.536979062 0.000000000
dyz 0 0.268486420 0.268486420 0.536972840 0.000000000
sum over m 1.185761300 1.185761300 2.371522600 0.000000000
d3z^2-r^2 1 0.003469509 0.003469509 0.006939018 0.000000000
dx^2-y^2 1 -0.004486723 -0.004486723 -0.008973445 0.000000000
dxy 1 0.015348878 0.015348878 0.030697755 0.000000000
dxz 1 0.003488409 0.003488409 0.006976818 0.000000000
dyz 1 0.003488438 0.003488438 0.006976875 0.000000000
sum over m 0.021308511 0.021308511 0.042617021 0.000000000
sum over m+mul 1.207069811 1.207069811 2.414139621 0.000000000
243 O Up spin Down spin Sum Diff
multiple
s 0 0.893914047 0.893914047 1.787828094 0.000000000
sum over m 0.893914047 0.893914047 1.787828094 0.000000000
s 1 -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m+mul 0.890873559 0.890873559 1.781747118 0.000000000
px 0 0.786884071 0.786884071 1.573768142 0.000000000
py 0 0.787076034 0.787076034 1.574152068 0.000000000
pz 0 0.779774738 0.779774738 1.559549477 0.000000000
sum over m 2.353734844 2.353734844 4.707469687 0.000000000
px 1 -0.008736786 -0.008736786 -0.017473571 0.000000000
py 1 -0.008745347 -0.008745347 -0.017490694 0.000000000
pz 1 -0.006463925 -0.006463925 -0.012927850 0.000000000
sum over m -0.023946058 -0.023946058 -0.047892115 0.000000000
sum over m+mul 2.329788786 2.329788786 4.659577572 0.000000000
d3z^2-r^2 0 -0.006392667 -0.006392667 -0.012785333 0.000000000
dx^2-y^2 0 -0.005058377 -0.005058377 -0.010116753 0.000000000
dxy 0 -0.005435601 -0.005435601 -0.010871202 0.000000000
dxz 0 -0.006930782 -0.006930782 -0.013861564 0.000000000
dyz 0 -0.006927428 -0.006927428 -0.013854856 0.000000000
sum over m -0.030744854 -0.030744854 -0.061489708 0.000000000
sum over m+mul -0.030744854 -0.030744854 -0.061489708 0.000000000
244 O Up spin Down spin Sum Diff
multiple
s 0 0.893913386 0.893913386 1.787826773 0.000000000
sum over m 0.893913386 0.893913386 1.787826773 0.000000000
s 1 -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m+mul 0.890871876 0.890871876 1.781743752 0.000000000
px 0 0.787082983 0.787082983 1.574165966 0.000000000
py 0 0.786936799 0.786936799 1.573873599 0.000000000
pz 0 0.779721609 0.779721609 1.559443219 0.000000000
sum over m 2.353741392 2.353741392 4.707482783 0.000000000
px 1 -0.008740597 -0.008740597 -0.017481195 0.000000000
py 1 -0.008738465 -0.008738465 -0.017476931 0.000000000
pz 1 -0.006462880 -0.006462880 -0.012925760 0.000000000
sum over m -0.023941942 -0.023941942 -0.047883885 0.000000000
sum over m+mul 2.329799449 2.329799449 4.659598898 0.000000000
d3z^2-r^2 0 -0.006391999 -0.006391999 -0.012783997 0.000000000
dx^2-y^2 0 -0.005055370 -0.005055370 -0.010110741 0.000000000
dxy 0 -0.005435327 -0.005435327 -0.010870653 0.000000000
dxz 0 -0.006925668 -0.006925668 -0.013851335 0.000000000
dyz 0 -0.006927532 -0.006927532 -0.013855065 0.000000000
sum over m -0.030735896 -0.030735896 -0.061471791 0.000000000
sum over m+mul -0.030735896 -0.030735896 -0.061471791 0.000000000
245 O Up spin Down spin Sum Diff
multiple
s 0 0.893869394 0.893869394 1.787738788 0.000000000
sum over m 0.893869394 0.893869394 1.787738788 0.000000000
s 1 -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m+mul 0.890828733 0.890828733 1.781657466 0.000000000
px 0 0.786883501 0.786883501 1.573767003 0.000000000
py 0 0.786946663 0.786946663 1.573893325 0.000000000
pz 0 0.779866123 0.779866123 1.559732245 0.000000000
sum over m 2.353696287 2.353696287 4.707392573 0.000000000
px 1 -0.008730798 -0.008730798 -0.017461596 0.000000000
py 1 -0.008736912 -0.008736912 -0.017473824 0.000000000
pz 1 -0.006468956 -0.006468956 -0.012937911 0.000000000
sum over m -0.023936666 -0.023936666 -0.047873331 0.000000000
sum over m+mul 2.329759621 2.329759621 4.659519242 0.000000000
d3z^2-r^2 0 -0.006391283 -0.006391283 -0.012782565 0.000000000
dx^2-y^2 0 -0.005060925 -0.005060925 -0.010121850 0.000000000
dxy 0 -0.005434026 -0.005434026 -0.010868052 0.000000000
dxz 0 -0.006933987 -0.006933987 -0.013867973 0.000000000
dyz 0 -0.006932730 -0.006932730 -0.013865459 0.000000000
sum over m -0.030752950 -0.030752950 -0.061505900 0.000000000
sum over m+mul -0.030752950 -0.030752950 -0.061505900 0.000000000
246 O Up spin Down spin Sum Diff
multiple
s 0 0.893919403 0.893919403 1.787838806 0.000000000
sum over m 0.893919403 0.893919403 1.787838806 0.000000000
s 1 -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m+mul 0.890878531 0.890878531 1.781757063 0.000000000
px 0 0.787043897 0.787043897 1.574087794 0.000000000
py 0 0.786951810 0.786951810 1.573903621 0.000000000
pz 0 0.779741404 0.779741404 1.559482809 0.000000000
sum over m 2.353737112 2.353737112 4.707474223 0.000000000
px 1 -0.008740843 -0.008740843 -0.017481686 0.000000000
py 1 -0.008739215 -0.008739215 -0.017478429 0.000000000
pz 1 -0.006464071 -0.006464071 -0.012928142 0.000000000
sum over m -0.023944129 -0.023944129 -0.047888257 0.000000000
sum over m+mul 2.329792983 2.329792983 4.659585966 0.000000000
d3z^2-r^2 0 -0.006392789 -0.006392789 -0.012785577 0.000000000
dx^2-y^2 0 -0.005056673 -0.005056673 -0.010113346 0.000000000
dxy 0 -0.005435497 -0.005435497 -0.010870994 0.000000000
dxz 0 -0.006926750 -0.006926750 -0.013853500 0.000000000
dyz 0 -0.006928318 -0.006928318 -0.013856635 0.000000000
sum over m -0.030740027 -0.030740027 -0.061480053 0.000000000
sum over m+mul -0.030740027 -0.030740027 -0.061480053 0.000000000
247 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798134 1.000798134 2.001596268 0.000000000
sum over m 1.000798134 1.000798134 2.001596268 0.000000000
s 1 0.207380313 0.207380313 0.414760625 0.000000000
sum over m 0.207380313 0.207380313 0.414760625 0.000000000
s 2 0.014717122 0.014717122 0.029434244 0.000000000
sum over m 0.014717122 0.014717122 0.029434244 0.000000000
sum over m+mul 1.222895568 1.222895568 2.445791137 0.000000000
px 0 1.006399840 1.006399840 2.012799680 0.000000000
py 0 1.006395472 1.006395472 2.012790943 0.000000000
pz 0 1.006210919 1.006210919 2.012421838 0.000000000
sum over m 3.019006231 3.019006231 6.038012461 0.000000000
px 1 0.065452116 0.065452116 0.130904232 0.000000000
py 1 0.065458011 0.065458011 0.130916022 0.000000000
pz 1 0.040344786 0.040344786 0.080689572 0.000000000
sum over m 0.171254913 0.171254913 0.342509826 0.000000000
sum over m+mul 3.190261144 3.190261144 6.380522287 0.000000000
d3z^2-r^2 0 0.196308817 0.196308817 0.392617635 0.000000000
dx^2-y^2 0 0.201552617 0.201552617 0.403105235 0.000000000
dxy 0 0.250913136 0.250913136 0.501826272 0.000000000
dxz 0 0.268491880 0.268491880 0.536983759 0.000000000
dyz 0 0.268494472 0.268494472 0.536988944 0.000000000
sum over m 1.185760922 1.185760922 2.371521845 0.000000000
d3z^2-r^2 1 0.003468385 0.003468385 0.006936771 0.000000000
dx^2-y^2 1 -0.004487731 -0.004487731 -0.008975462 0.000000000
dxy 1 0.015348016 0.015348016 0.030696032 0.000000000
dxz 1 0.003485545 0.003485545 0.006971091 0.000000000
dyz 1 0.003485835 0.003485835 0.006971671 0.000000000
sum over m 0.021300051 0.021300051 0.042600102 0.000000000
sum over m+mul 1.207060973 1.207060973 2.414121947 0.000000000
248 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000799076 1.000799076 2.001598151 0.000000000
sum over m 1.000799076 1.000799076 2.001598151 0.000000000
s 1 0.207385090 0.207385090 0.414770180 0.000000000
sum over m 0.207385090 0.207385090 0.414770180 0.000000000
s 2 0.014717895 0.014717895 0.029435790 0.000000000
sum over m 0.014717895 0.014717895 0.029435790 0.000000000
sum over m+mul 1.222902061 1.222902061 2.445804121 0.000000000
px 0 1.006390549 1.006390549 2.012781099 0.000000000
py 0 1.006391330 1.006391330 2.012782660 0.000000000
pz 0 1.006204320 1.006204320 2.012408639 0.000000000
sum over m 3.018986199 3.018986199 6.037972398 0.000000000
px 1 0.065449797 0.065449797 0.130899594 0.000000000
py 1 0.065451380 0.065451380 0.130902760 0.000000000
pz 1 0.040353482 0.040353482 0.080706963 0.000000000
sum over m 0.171254658 0.171254658 0.342509317 0.000000000
sum over m+mul 3.190240857 3.190240857 6.380481715 0.000000000
d3z^2-r^2 0 0.196317011 0.196317011 0.392634022 0.000000000
dx^2-y^2 0 0.201551363 0.201551363 0.403102726 0.000000000
dxy 0 0.250916975 0.250916975 0.501833951 0.000000000
dxz 0 0.268489531 0.268489531 0.536979062 0.000000000
dyz 0 0.268486420 0.268486420 0.536972840 0.000000000
sum over m 1.185761300 1.185761300 2.371522601 0.000000000
d3z^2-r^2 1 0.003469509 0.003469509 0.006939018 0.000000000
dx^2-y^2 1 -0.004486722 -0.004486722 -0.008973445 0.000000000
dxy 1 0.015348878 0.015348878 0.030697756 0.000000000
dxz 1 0.003488409 0.003488409 0.006976818 0.000000000
dyz 1 0.003488438 0.003488438 0.006976875 0.000000000
sum over m 0.021308511 0.021308511 0.042617021 0.000000000
sum over m+mul 1.207069811 1.207069811 2.414139622 0.000000000
249 O Up spin Down spin Sum Diff
multiple
s 0 0.893914047 0.893914047 1.787828094 0.000000000
sum over m 0.893914047 0.893914047 1.787828094 0.000000000
s 1 -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m -0.003040488 -0.003040488 -0.006080976 0.000000000
sum over m+mul 0.890873559 0.890873559 1.781747118 0.000000000
px 0 0.786884071 0.786884071 1.573768142 0.000000000
py 0 0.787076034 0.787076034 1.574152068 0.000000000
pz 0 0.779774739 0.779774739 1.559549477 0.000000000
sum over m 2.353734844 2.353734844 4.707469687 0.000000000
px 1 -0.008736786 -0.008736786 -0.017473571 0.000000000
py 1 -0.008745347 -0.008745347 -0.017490694 0.000000000
pz 1 -0.006463925 -0.006463925 -0.012927850 0.000000000
sum over m -0.023946058 -0.023946058 -0.047892115 0.000000000
sum over m+mul 2.329788786 2.329788786 4.659577572 0.000000000
d3z^2-r^2 0 -0.006392667 -0.006392667 -0.012785333 0.000000000
dx^2-y^2 0 -0.005058377 -0.005058377 -0.010116753 0.000000000
dxy 0 -0.005435601 -0.005435601 -0.010871202 0.000000000
dxz 0 -0.006930782 -0.006930782 -0.013861564 0.000000000
dyz 0 -0.006927428 -0.006927428 -0.013854856 0.000000000
sum over m -0.030744854 -0.030744854 -0.061489708 0.000000000
sum over m+mul -0.030744854 -0.030744854 -0.061489708 0.000000000
250 O Up spin Down spin Sum Diff
multiple
s 0 0.893913386 0.893913386 1.787826773 0.000000000
sum over m 0.893913386 0.893913386 1.787826773 0.000000000
s 1 -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m -0.003041510 -0.003041510 -0.006083021 0.000000000
sum over m+mul 0.890871876 0.890871876 1.781743752 0.000000000
px 0 0.787082983 0.787082983 1.574165966 0.000000000
py 0 0.786936799 0.786936799 1.573873598 0.000000000
pz 0 0.779721609 0.779721609 1.559443219 0.000000000
sum over m 2.353741391 2.353741391 4.707482783 0.000000000
px 1 -0.008740597 -0.008740597 -0.017481195 0.000000000
py 1 -0.008738465 -0.008738465 -0.017476931 0.000000000
pz 1 -0.006462880 -0.006462880 -0.012925760 0.000000000
sum over m -0.023941942 -0.023941942 -0.047883885 0.000000000
sum over m+mul 2.329799449 2.329799449 4.659598898 0.000000000
d3z^2-r^2 0 -0.006391999 -0.006391999 -0.012783997 0.000000000
dx^2-y^2 0 -0.005055370 -0.005055370 -0.010110741 0.000000000
dxy 0 -0.005435327 -0.005435327 -0.010870653 0.000000000
dxz 0 -0.006925668 -0.006925668 -0.013851335 0.000000000
dyz 0 -0.006927532 -0.006927532 -0.013855065 0.000000000
sum over m -0.030735896 -0.030735896 -0.061471791 0.000000000
sum over m+mul -0.030735896 -0.030735896 -0.061471791 0.000000000
251 O Up spin Down spin Sum Diff
multiple
s 0 0.893869394 0.893869394 1.787738788 0.000000000
sum over m 0.893869394 0.893869394 1.787738788 0.000000000
s 1 -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m -0.003040661 -0.003040661 -0.006081322 0.000000000
sum over m+mul 0.890828733 0.890828733 1.781657466 0.000000000
px 0 0.786883501 0.786883501 1.573767002 0.000000000
py 0 0.786946663 0.786946663 1.573893326 0.000000000
pz 0 0.779866123 0.779866123 1.559732245 0.000000000
sum over m 2.353696287 2.353696287 4.707392573 0.000000000
px 1 -0.008730798 -0.008730798 -0.017461596 0.000000000
py 1 -0.008736912 -0.008736912 -0.017473824 0.000000000
pz 1 -0.006468956 -0.006468956 -0.012937911 0.000000000
sum over m -0.023936666 -0.023936666 -0.047873331 0.000000000
sum over m+mul 2.329759621 2.329759621 4.659519242 0.000000000
d3z^2-r^2 0 -0.006391283 -0.006391283 -0.012782565 0.000000000
dx^2-y^2 0 -0.005060925 -0.005060925 -0.010121850 0.000000000
dxy 0 -0.005434026 -0.005434026 -0.010868052 0.000000000
dxz 0 -0.006933987 -0.006933987 -0.013867973 0.000000000
dyz 0 -0.006932730 -0.006932730 -0.013865459 0.000000000
sum over m -0.030752950 -0.030752950 -0.061505900 0.000000000
sum over m+mul -0.030752950 -0.030752950 -0.061505900 0.000000000
252 O Up spin Down spin Sum Diff
multiple
s 0 0.893919403 0.893919403 1.787838806 0.000000000
sum over m 0.893919403 0.893919403 1.787838806 0.000000000
s 1 -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m -0.003040872 -0.003040872 -0.006081744 0.000000000
sum over m+mul 0.890878531 0.890878531 1.781757063 0.000000000
px 0 0.787043897 0.787043897 1.574087794 0.000000000
py 0 0.786951810 0.786951810 1.573903621 0.000000000
pz 0 0.779741404 0.779741404 1.559482809 0.000000000
sum over m 2.353737112 2.353737112 4.707474223 0.000000000
px 1 -0.008740843 -0.008740843 -0.017481686 0.000000000
py 1 -0.008739215 -0.008739215 -0.017478429 0.000000000
pz 1 -0.006464071 -0.006464071 -0.012928142 0.000000000
sum over m -0.023944129 -0.023944129 -0.047888257 0.000000000
sum over m+mul 2.329792983 2.329792983 4.659585966 0.000000000
d3z^2-r^2 0 -0.006392789 -0.006392789 -0.012785577 0.000000000
dx^2-y^2 0 -0.005056673 -0.005056673 -0.010113346 0.000000000
dxy 0 -0.005435497 -0.005435497 -0.010870994 0.000000000
dxz 0 -0.006926750 -0.006926750 -0.013853500 0.000000000
dyz 0 -0.006928318 -0.006928318 -0.013856635 0.000000000
sum over m -0.030740027 -0.030740027 -0.061480053 0.000000000
sum over m+mul -0.030740027 -0.030740027 -0.061480053 0.000000000
253 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798826 1.000798826 2.001597652 0.000000000
sum over m 1.000798826 1.000798826 2.001597652 0.000000000
s 1 0.207372705 0.207372705 0.414745410 0.000000000
sum over m 0.207372705 0.207372705 0.414745410 0.000000000
s 2 0.014715939 0.014715939 0.029431878 0.000000000
sum over m 0.014715939 0.014715939 0.029431878 0.000000000
sum over m+mul 1.222887470 1.222887470 2.445774940 0.000000000
px 0 1.006402702 1.006402702 2.012805403 0.000000000
py 0 1.006402702 1.006402702 2.012805403 0.000000000
pz 0 1.006204107 1.006204107 2.012408213 0.000000000
sum over m 3.019009510 3.019009510 6.038019020 0.000000000
px 1 0.065463753 0.065463753 0.130927505 0.000000000
py 1 0.065463753 0.065463753 0.130927506 0.000000000
pz 1 0.040336970 0.040336970 0.080673939 0.000000000
sum over m 0.171264475 0.171264475 0.342528950 0.000000000
sum over m+mul 3.190273985 3.190273985 6.380547970 0.000000000
d3z^2-r^2 0 0.196315114 0.196315114 0.392630228 0.000000000
dx^2-y^2 0 0.201562348 0.201562348 0.403124697 0.000000000
dxy 0 0.250911163 0.250911163 0.501822326 0.000000000
dxz 0 0.268489436 0.268489436 0.536978872 0.000000000
dyz 0 0.268489436 0.268489436 0.536978873 0.000000000
sum over m 1.185767498 1.185767498 2.371534996 0.000000000
d3z^2-r^2 1 0.003468094 0.003468094 0.006936188 0.000000000
dx^2-y^2 1 -0.004487844 -0.004487844 -0.008975688 0.000000000
dxy 1 0.015351333 0.015351333 0.030702666 0.000000000
dxz 1 0.003487596 0.003487596 0.006975192 0.000000000
dyz 1 0.003487596 0.003487596 0.006975192 0.000000000
sum over m 0.021306775 0.021306775 0.042613550 0.000000000
sum over m+mul 1.207074273 1.207074273 2.414148546 0.000000000
254 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000789563 1.000789563 2.001579126 0.000000000
sum over m 1.000789563 1.000789563 2.001579126 0.000000000
s 1 0.207379503 0.207379503 0.414759006 0.000000000
sum over m 0.207379503 0.207379503 0.414759006 0.000000000
s 2 0.014718603 0.014718603 0.029437206 0.000000000
sum over m 0.014718603 0.014718603 0.029437206 0.000000000
sum over m+mul 1.222887669 1.222887669 2.445775339 0.000000000
px 0 1.006397619 1.006397619 2.012795239 0.000000000
py 0 1.006397619 1.006397619 2.012795239 0.000000000
pz 0 1.006209583 1.006209583 2.012419165 0.000000000
sum over m 3.019004821 3.019004821 6.038009643 0.000000000
px 1 0.065443633 0.065443633 0.130887266 0.000000000
py 1 0.065443633 0.065443633 0.130887265 0.000000000
pz 1 0.040342919 0.040342919 0.080685838 0.000000000
sum over m 0.171230185 0.171230185 0.342460369 0.000000000
sum over m+mul 3.190235006 3.190235006 6.380470012 0.000000000
d3z^2-r^2 0 0.196301291 0.196301291 0.392602583 0.000000000
dx^2-y^2 0 0.201546457 0.201546457 0.403092913 0.000000000
dxy 0 0.250915052 0.250915052 0.501830104 0.000000000
dxz 0 0.268498059 0.268498059 0.536996118 0.000000000
dyz 0 0.268498059 0.268498059 0.536996118 0.000000000
sum over m 1.185758918 1.185758918 2.371517835 0.000000000
d3z^2-r^2 1 0.003468289 0.003468289 0.006936578 0.000000000
dx^2-y^2 1 -0.004485457 -0.004485457 -0.008970914 0.000000000
dxy 1 0.015348080 0.015348080 0.030696160 0.000000000
dxz 1 0.003484377 0.003484377 0.006968753 0.000000000
dyz 1 0.003484376 0.003484376 0.006968753 0.000000000
sum over m 0.021299665 0.021299665 0.042599330 0.000000000
sum over m+mul 1.207058583 1.207058583 2.414117165 0.000000000
255 O Up spin Down spin Sum Diff
multiple
s 0 0.893887596 0.893887596 1.787775192 0.000000000
sum over m 0.893887596 0.893887596 1.787775192 0.000000000
s 1 -0.003040335 -0.003040335 -0.006080670 0.000000000
sum over m -0.003040335 -0.003040335 -0.006080670 0.000000000
sum over m+mul 0.890847261 0.890847261 1.781694521 0.000000000
px 0 0.786934586 0.786934586 1.573869171 0.000000000
py 0 0.786934586 0.786934586 1.573869172 0.000000000
pz 0 0.779842397 0.779842397 1.559684793 0.000000000
sum over m 2.353711568 2.353711568 4.707423136 0.000000000
px 1 -0.008738414 -0.008738414 -0.017476828 0.000000000
py 1 -0.008738414 -0.008738414 -0.017476828 0.000000000
pz 1 -0.006468379 -0.006468379 -0.012936758 0.000000000
sum over m -0.023945207 -0.023945207 -0.047890414 0.000000000
sum over m+mul 2.329766361 2.329766361 4.659532723 0.000000000
d3z^2-r^2 0 -0.006392302 -0.006392302 -0.012784604 0.000000000
dx^2-y^2 0 -0.005060774 -0.005060774 -0.010121547 0.000000000
dxy 0 -0.005434442 -0.005434442 -0.010868884 0.000000000
dxz 0 -0.006932725 -0.006932725 -0.013865450 0.000000000
dyz 0 -0.006932725 -0.006932725 -0.013865450 0.000000000
sum over m -0.030752967 -0.030752967 -0.061505935 0.000000000
sum over m+mul -0.030752967 -0.030752967 -0.061505935 0.000000000
256 O Up spin Down spin Sum Diff
multiple
s 0 0.893910072 0.893910072 1.787820143 0.000000000
sum over m 0.893910072 0.893910072 1.787820143 0.000000000
s 1 -0.003042497 -0.003042497 -0.006084994 0.000000000
sum over m -0.003042497 -0.003042497 -0.006084994 0.000000000
sum over m+mul 0.890867575 0.890867575 1.781735149 0.000000000
px 0 0.787042238 0.787042238 1.574084476 0.000000000
py 0 0.787042238 0.787042238 1.574084475 0.000000000
pz 0 0.779680403 0.779680403 1.559360807 0.000000000
sum over m 2.353764879 2.353764879 4.707529758 0.000000000
px 1 -0.008733007 -0.008733007 -0.017466015 0.000000000
py 1 -0.008733008 -0.008733008 -0.017466015 0.000000000
pz 1 -0.006457064 -0.006457064 -0.012914128 0.000000000
sum over m -0.023923079 -0.023923079 -0.047846158 0.000000000
sum over m+mul 2.329841800 2.329841800 4.659683600 0.000000000
d3z^2-r^2 0 -0.006390428 -0.006390428 -0.012780855 0.000000000
dx^2-y^2 0 -0.005052107 -0.005052107 -0.010104215 0.000000000
dxy 0 -0.005435063 -0.005435063 -0.010870126 0.000000000
dxz 0 -0.006924042 -0.006924042 -0.013848083 0.000000000
dyz 0 -0.006924042 -0.006924042 -0.013848083 0.000000000
sum over m -0.030725681 -0.030725681 -0.061451362 0.000000000
sum over m+mul -0.030725681 -0.030725681 -0.061451362 0.000000000
257 O Up spin Down spin Sum Diff
multiple
s 0 0.893903601 0.893903601 1.787807203 0.000000000
sum over m 0.893903601 0.893903601 1.787807203 0.000000000
s 1 -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m+mul 0.890862791 0.890862791 1.781725582 0.000000000
px 0 0.786842319 0.786842319 1.573684639 0.000000000
py 0 0.787104850 0.787104850 1.574209700 0.000000000
pz 0 0.779795861 0.779795861 1.559591721 0.000000000
sum over m 2.353743030 2.353743030 4.707486059 0.000000000
px 1 -0.008734160 -0.008734160 -0.017468319 0.000000000
py 1 -0.008748973 -0.008748973 -0.017497946 0.000000000
pz 1 -0.006464610 -0.006464610 -0.012929219 0.000000000
sum over m -0.023947742 -0.023947742 -0.047895484 0.000000000
sum over m+mul 2.329795288 2.329795288 4.659590575 0.000000000
d3z^2-r^2 0 -0.006391992 -0.006391992 -0.012783985 0.000000000
dx^2-y^2 0 -0.005059009 -0.005059009 -0.010118018 0.000000000
dxy 0 -0.005434991 -0.005434991 -0.010869982 0.000000000
dxz 0 -0.006932668 -0.006932668 -0.013865336 0.000000000
dyz 0 -0.006927941 -0.006927941 -0.013855881 0.000000000
sum over m -0.030746601 -0.030746601 -0.061493202 0.000000000
sum over m+mul -0.030746601 -0.030746601 -0.061493202 0.000000000
258 O Up spin Down spin Sum Diff
multiple
s 0 0.893903601 0.893903601 1.787807203 0.000000000
sum over m 0.893903601 0.893903601 1.787807203 0.000000000
s 1 -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m+mul 0.890862791 0.890862791 1.781725582 0.000000000
px 0 0.787104850 0.787104850 1.574209699 0.000000000
py 0 0.786842319 0.786842319 1.573684639 0.000000000
pz 0 0.779795860 0.779795860 1.559591721 0.000000000
sum over m 2.353743029 2.353743029 4.707486059 0.000000000
px 1 -0.008748973 -0.008748973 -0.017497946 0.000000000
py 1 -0.008734159 -0.008734159 -0.017468319 0.000000000
pz 1 -0.006464610 -0.006464610 -0.012929220 0.000000000
sum over m -0.023947742 -0.023947742 -0.047895485 0.000000000
sum over m+mul 2.329795287 2.329795287 4.659590574 0.000000000
d3z^2-r^2 0 -0.006391992 -0.006391992 -0.012783985 0.000000000
dx^2-y^2 0 -0.005059009 -0.005059009 -0.010118018 0.000000000
dxy 0 -0.005434991 -0.005434991 -0.010869982 0.000000000
dxz 0 -0.006927941 -0.006927941 -0.013855881 0.000000000
dyz 0 -0.006932668 -0.006932668 -0.013865336 0.000000000
sum over m -0.030746601 -0.030746601 -0.061493202 0.000000000
sum over m+mul -0.030746601 -0.030746601 -0.061493202 0.000000000
259 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798826 1.000798826 2.001597652 0.000000000
sum over m 1.000798826 1.000798826 2.001597652 0.000000000
s 1 0.207372705 0.207372705 0.414745410 0.000000000
sum over m 0.207372705 0.207372705 0.414745410 0.000000000
s 2 0.014715939 0.014715939 0.029431878 0.000000000
sum over m 0.014715939 0.014715939 0.029431878 0.000000000
sum over m+mul 1.222887470 1.222887470 2.445774940 0.000000000
px 0 1.006402702 1.006402702 2.012805403 0.000000000
py 0 1.006402702 1.006402702 2.012805403 0.000000000
pz 0 1.006204107 1.006204107 2.012408213 0.000000000
sum over m 3.019009510 3.019009510 6.038019020 0.000000000
px 1 0.065463753 0.065463753 0.130927506 0.000000000
py 1 0.065463753 0.065463753 0.130927506 0.000000000
pz 1 0.040336970 0.040336970 0.080673939 0.000000000
sum over m 0.171264475 0.171264475 0.342528951 0.000000000
sum over m+mul 3.190273985 3.190273985 6.380547971 0.000000000
d3z^2-r^2 0 0.196315114 0.196315114 0.392630228 0.000000000
dx^2-y^2 0 0.201562348 0.201562348 0.403124696 0.000000000
dxy 0 0.250911163 0.250911163 0.501822327 0.000000000
dxz 0 0.268489436 0.268489436 0.536978872 0.000000000
dyz 0 0.268489436 0.268489436 0.536978873 0.000000000
sum over m 1.185767498 1.185767498 2.371534995 0.000000000
d3z^2-r^2 1 0.003468094 0.003468094 0.006936188 0.000000000
dx^2-y^2 1 -0.004487844 -0.004487844 -0.008975688 0.000000000
dxy 1 0.015351333 0.015351333 0.030702666 0.000000000
dxz 1 0.003487596 0.003487596 0.006975192 0.000000000
dyz 1 0.003487596 0.003487596 0.006975192 0.000000000
sum over m 0.021306775 0.021306775 0.042613550 0.000000000
sum over m+mul 1.207074272 1.207074272 2.414148545 0.000000000
260 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000789563 1.000789563 2.001579127 0.000000000
sum over m 1.000789563 1.000789563 2.001579127 0.000000000
s 1 0.207379503 0.207379503 0.414759006 0.000000000
sum over m 0.207379503 0.207379503 0.414759006 0.000000000
s 2 0.014718603 0.014718603 0.029437206 0.000000000
sum over m 0.014718603 0.014718603 0.029437206 0.000000000
sum over m+mul 1.222887670 1.222887670 2.445775339 0.000000000
px 0 1.006397619 1.006397619 2.012795238 0.000000000
py 0 1.006397619 1.006397619 2.012795238 0.000000000
pz 0 1.006209583 1.006209583 2.012419165 0.000000000
sum over m 3.019004821 3.019004821 6.038009642 0.000000000
px 1 0.065443633 0.065443633 0.130887266 0.000000000
py 1 0.065443633 0.065443633 0.130887266 0.000000000
pz 1 0.040342919 0.040342919 0.080685837 0.000000000
sum over m 0.171230185 0.171230185 0.342460369 0.000000000
sum over m+mul 3.190235006 3.190235006 6.380470011 0.000000000
d3z^2-r^2 0 0.196301291 0.196301291 0.392602583 0.000000000
dx^2-y^2 0 0.201546457 0.201546457 0.403092914 0.000000000
dxy 0 0.250915052 0.250915052 0.501830105 0.000000000
dxz 0 0.268498059 0.268498059 0.536996118 0.000000000
dyz 0 0.268498059 0.268498059 0.536996118 0.000000000
sum over m 1.185758919 1.185758919 2.371517837 0.000000000
d3z^2-r^2 1 0.003468289 0.003468289 0.006936578 0.000000000
dx^2-y^2 1 -0.004485457 -0.004485457 -0.008970914 0.000000000
dxy 1 0.015348080 0.015348080 0.030696160 0.000000000
dxz 1 0.003484377 0.003484377 0.006968753 0.000000000
dyz 1 0.003484376 0.003484376 0.006968753 0.000000000
sum over m 0.021299665 0.021299665 0.042599330 0.000000000
sum over m+mul 1.207058584 1.207058584 2.414117167 0.000000000
261 O Up spin Down spin Sum Diff
multiple
s 0 0.893887596 0.893887596 1.787775192 0.000000000
sum over m 0.893887596 0.893887596 1.787775192 0.000000000
s 1 -0.003040335 -0.003040335 -0.006080670 0.000000000
sum over m -0.003040335 -0.003040335 -0.006080670 0.000000000
sum over m+mul 0.890847261 0.890847261 1.781694521 0.000000000
px 0 0.786934586 0.786934586 1.573869171 0.000000000
py 0 0.786934586 0.786934586 1.573869171 0.000000000
pz 0 0.779842397 0.779842397 1.559684793 0.000000000
sum over m 2.353711568 2.353711568 4.707423136 0.000000000
px 1 -0.008738414 -0.008738414 -0.017476828 0.000000000
py 1 -0.008738414 -0.008738414 -0.017476828 0.000000000
pz 1 -0.006468379 -0.006468379 -0.012936758 0.000000000
sum over m -0.023945207 -0.023945207 -0.047890414 0.000000000
sum over m+mul 2.329766361 2.329766361 4.659532722 0.000000000
d3z^2-r^2 0 -0.006392302 -0.006392302 -0.012784604 0.000000000
dx^2-y^2 0 -0.005060774 -0.005060774 -0.010121547 0.000000000
dxy 0 -0.005434442 -0.005434442 -0.010868884 0.000000000
dxz 0 -0.006932725 -0.006932725 -0.013865450 0.000000000
dyz 0 -0.006932725 -0.006932725 -0.013865450 0.000000000
sum over m -0.030752967 -0.030752967 -0.061505935 0.000000000
sum over m+mul -0.030752967 -0.030752967 -0.061505935 0.000000000
262 O Up spin Down spin Sum Diff
multiple
s 0 0.893910072 0.893910072 1.787820143 0.000000000
sum over m 0.893910072 0.893910072 1.787820143 0.000000000
s 1 -0.003042497 -0.003042497 -0.006084994 0.000000000
sum over m -0.003042497 -0.003042497 -0.006084994 0.000000000
sum over m+mul 0.890867575 0.890867575 1.781735149 0.000000000
px 0 0.787042238 0.787042238 1.574084475 0.000000000
py 0 0.787042238 0.787042238 1.574084476 0.000000000
pz 0 0.779680403 0.779680403 1.559360807 0.000000000
sum over m 2.353764879 2.353764879 4.707529758 0.000000000
px 1 -0.008733007 -0.008733007 -0.017466015 0.000000000
py 1 -0.008733008 -0.008733008 -0.017466015 0.000000000
pz 1 -0.006457064 -0.006457064 -0.012914128 0.000000000
sum over m -0.023923079 -0.023923079 -0.047846158 0.000000000
sum over m+mul 2.329841800 2.329841800 4.659683600 0.000000000
d3z^2-r^2 0 -0.006390428 -0.006390428 -0.012780855 0.000000000
dx^2-y^2 0 -0.005052107 -0.005052107 -0.010104215 0.000000000
dxy 0 -0.005435063 -0.005435063 -0.010870126 0.000000000
dxz 0 -0.006924042 -0.006924042 -0.013848083 0.000000000
dyz 0 -0.006924042 -0.006924042 -0.013848083 0.000000000
sum over m -0.030725681 -0.030725681 -0.061451362 0.000000000
sum over m+mul -0.030725681 -0.030725681 -0.061451362 0.000000000
263 O Up spin Down spin Sum Diff
multiple
s 0 0.893903601 0.893903601 1.787807203 0.000000000
sum over m 0.893903601 0.893903601 1.787807203 0.000000000
s 1 -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m+mul 0.890862791 0.890862791 1.781725582 0.000000000
px 0 0.786842319 0.786842319 1.573684638 0.000000000
py 0 0.787104850 0.787104850 1.574209699 0.000000000
pz 0 0.779795861 0.779795861 1.559591721 0.000000000
sum over m 2.353743029 2.353743029 4.707486059 0.000000000
px 1 -0.008734160 -0.008734160 -0.017468319 0.000000000
py 1 -0.008748973 -0.008748973 -0.017497946 0.000000000
pz 1 -0.006464610 -0.006464610 -0.012929219 0.000000000
sum over m -0.023947742 -0.023947742 -0.047895484 0.000000000
sum over m+mul 2.329795287 2.329795287 4.659590574 0.000000000
d3z^2-r^2 0 -0.006391992 -0.006391992 -0.012783985 0.000000000
dx^2-y^2 0 -0.005059009 -0.005059009 -0.010118018 0.000000000
dxy 0 -0.005434991 -0.005434991 -0.010869982 0.000000000
dxz 0 -0.006932668 -0.006932668 -0.013865336 0.000000000
dyz 0 -0.006927941 -0.006927941 -0.013855881 0.000000000
sum over m -0.030746601 -0.030746601 -0.061493202 0.000000000
sum over m+mul -0.030746601 -0.030746601 -0.061493202 0.000000000
264 O Up spin Down spin Sum Diff
multiple
s 0 0.893903601 0.893903601 1.787807203 0.000000000
sum over m 0.893903601 0.893903601 1.787807203 0.000000000
s 1 -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m+mul 0.890862791 0.890862791 1.781725582 0.000000000
px 0 0.787104850 0.787104850 1.574209700 0.000000000
py 0 0.786842319 0.786842319 1.573684638 0.000000000
pz 0 0.779795860 0.779795860 1.559591721 0.000000000
sum over m 2.353743029 2.353743029 4.707486059 0.000000000
px 1 -0.008748973 -0.008748973 -0.017497946 0.000000000
py 1 -0.008734159 -0.008734159 -0.017468319 0.000000000
pz 1 -0.006464610 -0.006464610 -0.012929220 0.000000000
sum over m -0.023947742 -0.023947742 -0.047895484 0.000000000
sum over m+mul 2.329795287 2.329795287 4.659590574 0.000000000
d3z^2-r^2 0 -0.006391992 -0.006391992 -0.012783985 0.000000000
dx^2-y^2 0 -0.005059009 -0.005059009 -0.010118018 0.000000000
dxy 0 -0.005434991 -0.005434991 -0.010869982 0.000000000
dxz 0 -0.006927941 -0.006927941 -0.013855881 0.000000000
dyz 0 -0.006932668 -0.006932668 -0.013865336 0.000000000
sum over m -0.030746601 -0.030746601 -0.061493202 0.000000000
sum over m+mul -0.030746601 -0.030746601 -0.061493202 0.000000000
265 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798826 1.000798826 2.001597652 0.000000000
sum over m 1.000798826 1.000798826 2.001597652 0.000000000
s 1 0.207372705 0.207372705 0.414745410 0.000000000
sum over m 0.207372705 0.207372705 0.414745410 0.000000000
s 2 0.014715939 0.014715939 0.029431878 0.000000000
sum over m 0.014715939 0.014715939 0.029431878 0.000000000
sum over m+mul 1.222887470 1.222887470 2.445774940 0.000000000
px 0 1.006402702 1.006402702 2.012805403 0.000000000
py 0 1.006402702 1.006402702 2.012805403 0.000000000
pz 0 1.006204107 1.006204107 2.012408213 0.000000000
sum over m 3.019009510 3.019009510 6.038019020 0.000000000
px 1 0.065463753 0.065463753 0.130927506 0.000000000
py 1 0.065463753 0.065463753 0.130927506 0.000000000
pz 1 0.040336970 0.040336970 0.080673939 0.000000000
sum over m 0.171264475 0.171264475 0.342528951 0.000000000
sum over m+mul 3.190273985 3.190273985 6.380547970 0.000000000
d3z^2-r^2 0 0.196315114 0.196315114 0.392630228 0.000000000
dx^2-y^2 0 0.201562348 0.201562348 0.403124696 0.000000000
dxy 0 0.250911163 0.250911163 0.501822326 0.000000000
dxz 0 0.268489436 0.268489436 0.536978872 0.000000000
dyz 0 0.268489436 0.268489436 0.536978872 0.000000000
sum over m 1.185767497 1.185767497 2.371534995 0.000000000
d3z^2-r^2 1 0.003468094 0.003468094 0.006936188 0.000000000
dx^2-y^2 1 -0.004487844 -0.004487844 -0.008975688 0.000000000
dxy 1 0.015351333 0.015351333 0.030702666 0.000000000
dxz 1 0.003487596 0.003487596 0.006975192 0.000000000
dyz 1 0.003487596 0.003487596 0.006975192 0.000000000
sum over m 0.021306775 0.021306775 0.042613550 0.000000000
sum over m+mul 1.207074272 1.207074272 2.414148545 0.000000000
266 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000789563 1.000789563 2.001579126 0.000000000
sum over m 1.000789563 1.000789563 2.001579126 0.000000000
s 1 0.207379503 0.207379503 0.414759006 0.000000000
sum over m 0.207379503 0.207379503 0.414759006 0.000000000
s 2 0.014718603 0.014718603 0.029437206 0.000000000
sum over m 0.014718603 0.014718603 0.029437206 0.000000000
sum over m+mul 1.222887669 1.222887669 2.445775339 0.000000000
px 0 1.006397619 1.006397619 2.012795238 0.000000000
py 0 1.006397619 1.006397619 2.012795239 0.000000000
pz 0 1.006209583 1.006209583 2.012419165 0.000000000
sum over m 3.019004821 3.019004821 6.038009642 0.000000000
px 1 0.065443633 0.065443633 0.130887266 0.000000000
py 1 0.065443633 0.065443633 0.130887266 0.000000000
pz 1 0.040342919 0.040342919 0.080685838 0.000000000
sum over m 0.171230184 0.171230184 0.342460369 0.000000000
sum over m+mul 3.190235006 3.190235006 6.380470011 0.000000000
d3z^2-r^2 0 0.196301291 0.196301291 0.392602582 0.000000000
dx^2-y^2 0 0.201546457 0.201546457 0.403092914 0.000000000
dxy 0 0.250915053 0.250915053 0.501830105 0.000000000
dxz 0 0.268498059 0.268498059 0.536996118 0.000000000
dyz 0 0.268498059 0.268498059 0.536996118 0.000000000
sum over m 1.185758918 1.185758918 2.371517837 0.000000000
d3z^2-r^2 1 0.003468289 0.003468289 0.006936578 0.000000000
dx^2-y^2 1 -0.004485457 -0.004485457 -0.008970914 0.000000000
dxy 1 0.015348080 0.015348080 0.030696160 0.000000000
dxz 1 0.003484377 0.003484377 0.006968753 0.000000000
dyz 1 0.003484377 0.003484377 0.006968753 0.000000000
sum over m 0.021299665 0.021299665 0.042599330 0.000000000
sum over m+mul 1.207058583 1.207058583 2.414117167 0.000000000
267 O Up spin Down spin Sum Diff
multiple
s 0 0.893887596 0.893887596 1.787775192 0.000000000
sum over m 0.893887596 0.893887596 1.787775192 0.000000000
s 1 -0.003040335 -0.003040335 -0.006080670 0.000000000
sum over m -0.003040335 -0.003040335 -0.006080670 0.000000000
sum over m+mul 0.890847261 0.890847261 1.781694521 0.000000000
px 0 0.786934586 0.786934586 1.573869171 0.000000000
py 0 0.786934586 0.786934586 1.573869171 0.000000000
pz 0 0.779842397 0.779842397 1.559684794 0.000000000
sum over m 2.353711568 2.353711568 4.707423136 0.000000000
px 1 -0.008738414 -0.008738414 -0.017476828 0.000000000
py 1 -0.008738414 -0.008738414 -0.017476828 0.000000000
pz 1 -0.006468379 -0.006468379 -0.012936758 0.000000000
sum over m -0.023945207 -0.023945207 -0.047890414 0.000000000
sum over m+mul 2.329766361 2.329766361 4.659532722 0.000000000
d3z^2-r^2 0 -0.006392302 -0.006392302 -0.012784604 0.000000000
dx^2-y^2 0 -0.005060774 -0.005060774 -0.010121547 0.000000000
dxy 0 -0.005434442 -0.005434442 -0.010868884 0.000000000
dxz 0 -0.006932725 -0.006932725 -0.013865450 0.000000000
dyz 0 -0.006932725 -0.006932725 -0.013865450 0.000000000
sum over m -0.030752967 -0.030752967 -0.061505935 0.000000000
sum over m+mul -0.030752967 -0.030752967 -0.061505935 0.000000000
268 O Up spin Down spin Sum Diff
multiple
s 0 0.893910072 0.893910072 1.787820143 0.000000000
sum over m 0.893910072 0.893910072 1.787820143 0.000000000
s 1 -0.003042497 -0.003042497 -0.006084994 0.000000000
sum over m -0.003042497 -0.003042497 -0.006084994 0.000000000
sum over m+mul 0.890867575 0.890867575 1.781735149 0.000000000
px 0 0.787042238 0.787042238 1.574084475 0.000000000
py 0 0.787042238 0.787042238 1.574084476 0.000000000
pz 0 0.779680403 0.779680403 1.559360807 0.000000000
sum over m 2.353764879 2.353764879 4.707529757 0.000000000
px 1 -0.008733007 -0.008733007 -0.017466015 0.000000000
py 1 -0.008733008 -0.008733008 -0.017466015 0.000000000
pz 1 -0.006457064 -0.006457064 -0.012914128 0.000000000
sum over m -0.023923079 -0.023923079 -0.047846158 0.000000000
sum over m+mul 2.329841800 2.329841800 4.659683599 0.000000000
d3z^2-r^2 0 -0.006390428 -0.006390428 -0.012780855 0.000000000
dx^2-y^2 0 -0.005052107 -0.005052107 -0.010104215 0.000000000
dxy 0 -0.005435063 -0.005435063 -0.010870126 0.000000000
dxz 0 -0.006924042 -0.006924042 -0.013848083 0.000000000
dyz 0 -0.006924042 -0.006924042 -0.013848083 0.000000000
sum over m -0.030725681 -0.030725681 -0.061451362 0.000000000
sum over m+mul -0.030725681 -0.030725681 -0.061451362 0.000000000
269 O Up spin Down spin Sum Diff
multiple
s 0 0.893903601 0.893903601 1.787807203 0.000000000
sum over m 0.893903601 0.893903601 1.787807203 0.000000000
s 1 -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m+mul 0.890862791 0.890862791 1.781725582 0.000000000
px 0 0.786842319 0.786842319 1.573684638 0.000000000
py 0 0.787104850 0.787104850 1.574209699 0.000000000
pz 0 0.779795861 0.779795861 1.559591721 0.000000000
sum over m 2.353743029 2.353743029 4.707486059 0.000000000
px 1 -0.008734160 -0.008734160 -0.017468319 0.000000000
py 1 -0.008748973 -0.008748973 -0.017497946 0.000000000
pz 1 -0.006464610 -0.006464610 -0.012929219 0.000000000
sum over m -0.023947742 -0.023947742 -0.047895484 0.000000000
sum over m+mul 2.329795287 2.329795287 4.659590574 0.000000000
d3z^2-r^2 0 -0.006391992 -0.006391992 -0.012783985 0.000000000
dx^2-y^2 0 -0.005059009 -0.005059009 -0.010118018 0.000000000
dxy 0 -0.005434991 -0.005434991 -0.010869982 0.000000000
dxz 0 -0.006932668 -0.006932668 -0.013865336 0.000000000
dyz 0 -0.006927941 -0.006927941 -0.013855881 0.000000000
sum over m -0.030746601 -0.030746601 -0.061493202 0.000000000
sum over m+mul -0.030746601 -0.030746601 -0.061493202 0.000000000
270 O Up spin Down spin Sum Diff
multiple
s 0 0.893903601 0.893903601 1.787807203 0.000000000
sum over m 0.893903601 0.893903601 1.787807203 0.000000000
s 1 -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m+mul 0.890862791 0.890862791 1.781725582 0.000000000
px 0 0.787104850 0.787104850 1.574209700 0.000000000
py 0 0.786842319 0.786842319 1.573684638 0.000000000
pz 0 0.779795860 0.779795860 1.559591721 0.000000000
sum over m 2.353743030 2.353743030 4.707486059 0.000000000
px 1 -0.008748973 -0.008748973 -0.017497946 0.000000000
py 1 -0.008734159 -0.008734159 -0.017468319 0.000000000
pz 1 -0.006464610 -0.006464610 -0.012929220 0.000000000
sum over m -0.023947742 -0.023947742 -0.047895484 0.000000000
sum over m+mul 2.329795287 2.329795287 4.659590575 0.000000000
d3z^2-r^2 0 -0.006391992 -0.006391992 -0.012783985 0.000000000
dx^2-y^2 0 -0.005059009 -0.005059009 -0.010118018 0.000000000
dxy 0 -0.005434991 -0.005434991 -0.010869982 0.000000000
dxz 0 -0.006927941 -0.006927941 -0.013855881 0.000000000
dyz 0 -0.006932668 -0.006932668 -0.013865336 0.000000000
sum over m -0.030746601 -0.030746601 -0.061493202 0.000000000
sum over m+mul -0.030746601 -0.030746601 -0.061493202 0.000000000
271 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798826 1.000798826 2.001597652 0.000000000
sum over m 1.000798826 1.000798826 2.001597652 0.000000000
s 1 0.207372705 0.207372705 0.414745410 0.000000000
sum over m 0.207372705 0.207372705 0.414745410 0.000000000
s 2 0.014715939 0.014715939 0.029431878 0.000000000
sum over m 0.014715939 0.014715939 0.029431878 0.000000000
sum over m+mul 1.222887470 1.222887470 2.445774940 0.000000000
px 0 1.006402702 1.006402702 2.012805403 0.000000000
py 0 1.006402702 1.006402702 2.012805403 0.000000000
pz 0 1.006204107 1.006204107 2.012408213 0.000000000
sum over m 3.019009510 3.019009510 6.038019020 0.000000000
px 1 0.065463753 0.065463753 0.130927506 0.000000000
py 1 0.065463753 0.065463753 0.130927506 0.000000000
pz 1 0.040336970 0.040336970 0.080673940 0.000000000
sum over m 0.171264476 0.171264476 0.342528951 0.000000000
sum over m+mul 3.190273986 3.190273986 6.380547971 0.000000000
d3z^2-r^2 0 0.196315114 0.196315114 0.392630228 0.000000000
dx^2-y^2 0 0.201562348 0.201562348 0.403124696 0.000000000
dxy 0 0.250911163 0.250911163 0.501822326 0.000000000
dxz 0 0.268489436 0.268489436 0.536978873 0.000000000
dyz 0 0.268489436 0.268489436 0.536978873 0.000000000
sum over m 1.185767498 1.185767498 2.371534995 0.000000000
d3z^2-r^2 1 0.003468094 0.003468094 0.006936188 0.000000000
dx^2-y^2 1 -0.004487844 -0.004487844 -0.008975688 0.000000000
dxy 1 0.015351333 0.015351333 0.030702666 0.000000000
dxz 1 0.003487596 0.003487596 0.006975192 0.000000000
dyz 1 0.003487596 0.003487596 0.006975192 0.000000000
sum over m 0.021306775 0.021306775 0.042613550 0.000000000
sum over m+mul 1.207074273 1.207074273 2.414148545 0.000000000
272 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000789563 1.000789563 2.001579126 0.000000000
sum over m 1.000789563 1.000789563 2.001579126 0.000000000
s 1 0.207379503 0.207379503 0.414759006 0.000000000
sum over m 0.207379503 0.207379503 0.414759006 0.000000000
s 2 0.014718603 0.014718603 0.029437206 0.000000000
sum over m 0.014718603 0.014718603 0.029437206 0.000000000
sum over m+mul 1.222887669 1.222887669 2.445775339 0.000000000
px 0 1.006397619 1.006397619 2.012795238 0.000000000
py 0 1.006397619 1.006397619 2.012795239 0.000000000
pz 0 1.006209583 1.006209583 2.012419165 0.000000000
sum over m 3.019004821 3.019004821 6.038009642 0.000000000
px 1 0.065443633 0.065443633 0.130887266 0.000000000
py 1 0.065443633 0.065443633 0.130887266 0.000000000
pz 1 0.040342919 0.040342919 0.080685838 0.000000000
sum over m 0.171230185 0.171230185 0.342460369 0.000000000
sum over m+mul 3.190235006 3.190235006 6.380470012 0.000000000
d3z^2-r^2 0 0.196301291 0.196301291 0.392602582 0.000000000
dx^2-y^2 0 0.201546457 0.201546457 0.403092913 0.000000000
dxy 0 0.250915052 0.250915052 0.501830104 0.000000000
dxz 0 0.268498059 0.268498059 0.536996118 0.000000000
dyz 0 0.268498059 0.268498059 0.536996119 0.000000000
sum over m 1.185758918 1.185758918 2.371517836 0.000000000
d3z^2-r^2 1 0.003468289 0.003468289 0.006936578 0.000000000
dx^2-y^2 1 -0.004485457 -0.004485457 -0.008970914 0.000000000
dxy 1 0.015348080 0.015348080 0.030696160 0.000000000
dxz 1 0.003484377 0.003484377 0.006968753 0.000000000
dyz 1 0.003484377 0.003484377 0.006968753 0.000000000
sum over m 0.021299665 0.021299665 0.042599330 0.000000000
sum over m+mul 1.207058583 1.207058583 2.414117167 0.000000000
273 O Up spin Down spin Sum Diff
multiple
s 0 0.893887596 0.893887596 1.787775192 0.000000000
sum over m 0.893887596 0.893887596 1.787775192 0.000000000
s 1 -0.003040335 -0.003040335 -0.006080670 0.000000000
sum over m -0.003040335 -0.003040335 -0.006080670 0.000000000
sum over m+mul 0.890847261 0.890847261 1.781694521 0.000000000
px 0 0.786934586 0.786934586 1.573869171 0.000000000
py 0 0.786934586 0.786934586 1.573869171 0.000000000
pz 0 0.779842396 0.779842396 1.559684793 0.000000000
sum over m 2.353711568 2.353711568 4.707423135 0.000000000
px 1 -0.008738414 -0.008738414 -0.017476828 0.000000000
py 1 -0.008738414 -0.008738414 -0.017476828 0.000000000
pz 1 -0.006468379 -0.006468379 -0.012936758 0.000000000
sum over m -0.023945207 -0.023945207 -0.047890414 0.000000000
sum over m+mul 2.329766361 2.329766361 4.659532721 0.000000000
d3z^2-r^2 0 -0.006392302 -0.006392302 -0.012784604 0.000000000
dx^2-y^2 0 -0.005060774 -0.005060774 -0.010121547 0.000000000
dxy 0 -0.005434442 -0.005434442 -0.010868884 0.000000000
dxz 0 -0.006932725 -0.006932725 -0.013865450 0.000000000
dyz 0 -0.006932725 -0.006932725 -0.013865450 0.000000000
sum over m -0.030752967 -0.030752967 -0.061505935 0.000000000
sum over m+mul -0.030752967 -0.030752967 -0.061505935 0.000000000
274 O Up spin Down spin Sum Diff
multiple
s 0 0.893910072 0.893910072 1.787820143 0.000000000
sum over m 0.893910072 0.893910072 1.787820143 0.000000000
s 1 -0.003042497 -0.003042497 -0.006084994 0.000000000
sum over m -0.003042497 -0.003042497 -0.006084994 0.000000000
sum over m+mul 0.890867575 0.890867575 1.781735149 0.000000000
px 0 0.787042238 0.787042238 1.574084475 0.000000000
py 0 0.787042238 0.787042238 1.574084475 0.000000000
pz 0 0.779680403 0.779680403 1.559360807 0.000000000
sum over m 2.353764879 2.353764879 4.707529757 0.000000000
px 1 -0.008733008 -0.008733008 -0.017466015 0.000000000
py 1 -0.008733008 -0.008733008 -0.017466015 0.000000000
pz 1 -0.006457064 -0.006457064 -0.012914128 0.000000000
sum over m -0.023923079 -0.023923079 -0.047846158 0.000000000
sum over m+mul 2.329841800 2.329841800 4.659683600 0.000000000
d3z^2-r^2 0 -0.006390428 -0.006390428 -0.012780855 0.000000000
dx^2-y^2 0 -0.005052107 -0.005052107 -0.010104215 0.000000000
dxy 0 -0.005435063 -0.005435063 -0.010870126 0.000000000
dxz 0 -0.006924042 -0.006924042 -0.013848083 0.000000000
dyz 0 -0.006924042 -0.006924042 -0.013848083 0.000000000
sum over m -0.030725681 -0.030725681 -0.061451362 0.000000000
sum over m+mul -0.030725681 -0.030725681 -0.061451362 0.000000000
275 O Up spin Down spin Sum Diff
multiple
s 0 0.893903601 0.893903601 1.787807203 0.000000000
sum over m 0.893903601 0.893903601 1.787807203 0.000000000
s 1 -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m+mul 0.890862791 0.890862791 1.781725582 0.000000000
px 0 0.786842319 0.786842319 1.573684638 0.000000000
py 0 0.787104850 0.787104850 1.574209699 0.000000000
pz 0 0.779795861 0.779795861 1.559591721 0.000000000
sum over m 2.353743029 2.353743029 4.707486059 0.000000000
px 1 -0.008734160 -0.008734160 -0.017468319 0.000000000
py 1 -0.008748973 -0.008748973 -0.017497946 0.000000000
pz 1 -0.006464610 -0.006464610 -0.012929219 0.000000000
sum over m -0.023947742 -0.023947742 -0.047895484 0.000000000
sum over m+mul 2.329795287 2.329795287 4.659590574 0.000000000
d3z^2-r^2 0 -0.006391992 -0.006391992 -0.012783985 0.000000000
dx^2-y^2 0 -0.005059009 -0.005059009 -0.010118018 0.000000000
dxy 0 -0.005434991 -0.005434991 -0.010869982 0.000000000
dxz 0 -0.006932668 -0.006932668 -0.013865336 0.000000000
dyz 0 -0.006927941 -0.006927941 -0.013855881 0.000000000
sum over m -0.030746601 -0.030746601 -0.061493202 0.000000000
sum over m+mul -0.030746601 -0.030746601 -0.061493202 0.000000000
276 O Up spin Down spin Sum Diff
multiple
s 0 0.893903601 0.893903601 1.787807202 0.000000000
sum over m 0.893903601 0.893903601 1.787807202 0.000000000
s 1 -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m+mul 0.890862791 0.890862791 1.781725582 0.000000000
px 0 0.787104850 0.787104850 1.574209699 0.000000000
py 0 0.786842319 0.786842319 1.573684639 0.000000000
pz 0 0.779795860 0.779795860 1.559591721 0.000000000
sum over m 2.353743029 2.353743029 4.707486059 0.000000000
px 1 -0.008748973 -0.008748973 -0.017497946 0.000000000
py 1 -0.008734159 -0.008734159 -0.017468319 0.000000000
pz 1 -0.006464610 -0.006464610 -0.012929220 0.000000000
sum over m -0.023947742 -0.023947742 -0.047895484 0.000000000
sum over m+mul 2.329795287 2.329795287 4.659590574 0.000000000
d3z^2-r^2 0 -0.006391992 -0.006391992 -0.012783985 0.000000000
dx^2-y^2 0 -0.005059009 -0.005059009 -0.010118018 0.000000000
dxy 0 -0.005434991 -0.005434991 -0.010869982 0.000000000
dxz 0 -0.006927941 -0.006927941 -0.013855881 0.000000000
dyz 0 -0.006932668 -0.006932668 -0.013865336 0.000000000
sum over m -0.030746601 -0.030746601 -0.061493202 0.000000000
sum over m+mul -0.030746601 -0.030746601 -0.061493202 0.000000000
277 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798826 1.000798826 2.001597652 0.000000000
sum over m 1.000798826 1.000798826 2.001597652 0.000000000
s 1 0.207372705 0.207372705 0.414745410 0.000000000
sum over m 0.207372705 0.207372705 0.414745410 0.000000000
s 2 0.014715939 0.014715939 0.029431878 0.000000000
sum over m 0.014715939 0.014715939 0.029431878 0.000000000
sum over m+mul 1.222887470 1.222887470 2.445774939 0.000000000
px 0 1.006402702 1.006402702 2.012805404 0.000000000
py 0 1.006402702 1.006402702 2.012805403 0.000000000
pz 0 1.006204107 1.006204107 2.012408213 0.000000000
sum over m 3.019009510 3.019009510 6.038019020 0.000000000
px 1 0.065463753 0.065463753 0.130927506 0.000000000
py 1 0.065463753 0.065463753 0.130927505 0.000000000
pz 1 0.040336969 0.040336969 0.080673939 0.000000000
sum over m 0.171264475 0.171264475 0.342528950 0.000000000
sum over m+mul 3.190273985 3.190273985 6.380547970 0.000000000
d3z^2-r^2 0 0.196315114 0.196315114 0.392630228 0.000000000
dx^2-y^2 0 0.201562348 0.201562348 0.403124696 0.000000000
dxy 0 0.250911163 0.250911163 0.501822326 0.000000000
dxz 0 0.268489436 0.268489436 0.536978873 0.000000000
dyz 0 0.268489436 0.268489436 0.536978872 0.000000000
sum over m 1.185767498 1.185767498 2.371534995 0.000000000
d3z^2-r^2 1 0.003468094 0.003468094 0.006936188 0.000000000
dx^2-y^2 1 -0.004487844 -0.004487844 -0.008975688 0.000000000
dxy 1 0.015351333 0.015351333 0.030702666 0.000000000
dxz 1 0.003487596 0.003487596 0.006975192 0.000000000
dyz 1 0.003487596 0.003487596 0.006975192 0.000000000
sum over m 0.021306775 0.021306775 0.042613550 0.000000000
sum over m+mul 1.207074273 1.207074273 2.414148545 0.000000000
278 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000789563 1.000789563 2.001579127 0.000000000
sum over m 1.000789563 1.000789563 2.001579127 0.000000000
s 1 0.207379503 0.207379503 0.414759006 0.000000000
sum over m 0.207379503 0.207379503 0.414759006 0.000000000
s 2 0.014718603 0.014718603 0.029437206 0.000000000
sum over m 0.014718603 0.014718603 0.029437206 0.000000000
sum over m+mul 1.222887670 1.222887670 2.445775339 0.000000000
px 0 1.006397619 1.006397619 2.012795238 0.000000000
py 0 1.006397619 1.006397619 2.012795239 0.000000000
pz 0 1.006209583 1.006209583 2.012419165 0.000000000
sum over m 3.019004821 3.019004821 6.038009642 0.000000000
px 1 0.065443633 0.065443633 0.130887266 0.000000000
py 1 0.065443633 0.065443633 0.130887266 0.000000000
pz 1 0.040342919 0.040342919 0.080685837 0.000000000
sum over m 0.171230185 0.171230185 0.342460369 0.000000000
sum over m+mul 3.190235006 3.190235006 6.380470012 0.000000000
d3z^2-r^2 0 0.196301291 0.196301291 0.392602582 0.000000000
dx^2-y^2 0 0.201546457 0.201546457 0.403092914 0.000000000
dxy 0 0.250915052 0.250915052 0.501830105 0.000000000
dxz 0 0.268498059 0.268498059 0.536996119 0.000000000
dyz 0 0.268498059 0.268498059 0.536996118 0.000000000
sum over m 1.185758919 1.185758919 2.371517837 0.000000000
d3z^2-r^2 1 0.003468289 0.003468289 0.006936578 0.000000000
dx^2-y^2 1 -0.004485457 -0.004485457 -0.008970914 0.000000000
dxy 1 0.015348080 0.015348080 0.030696160 0.000000000
dxz 1 0.003484376 0.003484376 0.006968753 0.000000000
dyz 1 0.003484376 0.003484376 0.006968753 0.000000000
sum over m 0.021299665 0.021299665 0.042599330 0.000000000
sum over m+mul 1.207058584 1.207058584 2.414117167 0.000000000
279 O Up spin Down spin Sum Diff
multiple
s 0 0.893887596 0.893887596 1.787775192 0.000000000
sum over m 0.893887596 0.893887596 1.787775192 0.000000000
s 1 -0.003040335 -0.003040335 -0.006080670 0.000000000
sum over m -0.003040335 -0.003040335 -0.006080670 0.000000000
sum over m+mul 0.890847261 0.890847261 1.781694521 0.000000000
px 0 0.786934586 0.786934586 1.573869171 0.000000000
py 0 0.786934586 0.786934586 1.573869172 0.000000000
pz 0 0.779842397 0.779842397 1.559684793 0.000000000
sum over m 2.353711568 2.353711568 4.707423136 0.000000000
px 1 -0.008738414 -0.008738414 -0.017476828 0.000000000
py 1 -0.008738414 -0.008738414 -0.017476828 0.000000000
pz 1 -0.006468379 -0.006468379 -0.012936758 0.000000000
sum over m -0.023945207 -0.023945207 -0.047890414 0.000000000
sum over m+mul 2.329766361 2.329766361 4.659532722 0.000000000
d3z^2-r^2 0 -0.006392302 -0.006392302 -0.012784604 0.000000000
dx^2-y^2 0 -0.005060774 -0.005060774 -0.010121547 0.000000000
dxy 0 -0.005434442 -0.005434442 -0.010868884 0.000000000
dxz 0 -0.006932725 -0.006932725 -0.013865450 0.000000000
dyz 0 -0.006932725 -0.006932725 -0.013865450 0.000000000
sum over m -0.030752967 -0.030752967 -0.061505935 0.000000000
sum over m+mul -0.030752967 -0.030752967 -0.061505935 0.000000000
280 O Up spin Down spin Sum Diff
multiple
s 0 0.893910072 0.893910072 1.787820143 0.000000000
sum over m 0.893910072 0.893910072 1.787820143 0.000000000
s 1 -0.003042497 -0.003042497 -0.006084994 0.000000000
sum over m -0.003042497 -0.003042497 -0.006084994 0.000000000
sum over m+mul 0.890867575 0.890867575 1.781735149 0.000000000
px 0 0.787042238 0.787042238 1.574084475 0.000000000
py 0 0.787042238 0.787042238 1.574084475 0.000000000
pz 0 0.779680403 0.779680403 1.559360807 0.000000000
sum over m 2.353764879 2.353764879 4.707529757 0.000000000
px 1 -0.008733007 -0.008733007 -0.017466015 0.000000000
py 1 -0.008733007 -0.008733007 -0.017466015 0.000000000
pz 1 -0.006457064 -0.006457064 -0.012914128 0.000000000
sum over m -0.023923079 -0.023923079 -0.047846158 0.000000000
sum over m+mul 2.329841800 2.329841800 4.659683600 0.000000000
d3z^2-r^2 0 -0.006390428 -0.006390428 -0.012780855 0.000000000
dx^2-y^2 0 -0.005052107 -0.005052107 -0.010104215 0.000000000
dxy 0 -0.005435063 -0.005435063 -0.010870126 0.000000000
dxz 0 -0.006924042 -0.006924042 -0.013848083 0.000000000
dyz 0 -0.006924042 -0.006924042 -0.013848083 0.000000000
sum over m -0.030725681 -0.030725681 -0.061451362 0.000000000
sum over m+mul -0.030725681 -0.030725681 -0.061451362 0.000000000
281 O Up spin Down spin Sum Diff
multiple
s 0 0.893903601 0.893903601 1.787807202 0.000000000
sum over m 0.893903601 0.893903601 1.787807202 0.000000000
s 1 -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m+mul 0.890862791 0.890862791 1.781725582 0.000000000
px 0 0.786842319 0.786842319 1.573684638 0.000000000
py 0 0.787104850 0.787104850 1.574209699 0.000000000
pz 0 0.779795861 0.779795861 1.559591721 0.000000000
sum over m 2.353743029 2.353743029 4.707486058 0.000000000
px 1 -0.008734160 -0.008734160 -0.017468319 0.000000000
py 1 -0.008748973 -0.008748973 -0.017497946 0.000000000
pz 1 -0.006464610 -0.006464610 -0.012929219 0.000000000
sum over m -0.023947742 -0.023947742 -0.047895484 0.000000000
sum over m+mul 2.329795287 2.329795287 4.659590574 0.000000000
d3z^2-r^2 0 -0.006391992 -0.006391992 -0.012783985 0.000000000
dx^2-y^2 0 -0.005059009 -0.005059009 -0.010118018 0.000000000
dxy 0 -0.005434991 -0.005434991 -0.010869982 0.000000000
dxz 0 -0.006932668 -0.006932668 -0.013865336 0.000000000
dyz 0 -0.006927941 -0.006927941 -0.013855881 0.000000000
sum over m -0.030746601 -0.030746601 -0.061493202 0.000000000
sum over m+mul -0.030746601 -0.030746601 -0.061493202 0.000000000
282 O Up spin Down spin Sum Diff
multiple
s 0 0.893903601 0.893903601 1.787807203 0.000000000
sum over m 0.893903601 0.893903601 1.787807203 0.000000000
s 1 -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m+mul 0.890862791 0.890862791 1.781725582 0.000000000
px 0 0.787104850 0.787104850 1.574209699 0.000000000
py 0 0.786842319 0.786842319 1.573684638 0.000000000
pz 0 0.779795860 0.779795860 1.559591721 0.000000000
sum over m 2.353743029 2.353743029 4.707486058 0.000000000
px 1 -0.008748973 -0.008748973 -0.017497946 0.000000000
py 1 -0.008734159 -0.008734159 -0.017468319 0.000000000
pz 1 -0.006464610 -0.006464610 -0.012929220 0.000000000
sum over m -0.023947742 -0.023947742 -0.047895484 0.000000000
sum over m+mul 2.329795287 2.329795287 4.659590574 0.000000000
d3z^2-r^2 0 -0.006391992 -0.006391992 -0.012783985 0.000000000
dx^2-y^2 0 -0.005059009 -0.005059009 -0.010118018 0.000000000
dxy 0 -0.005434991 -0.005434991 -0.010869982 0.000000000
dxz 0 -0.006927941 -0.006927941 -0.013855881 0.000000000
dyz 0 -0.006932668 -0.006932668 -0.013865336 0.000000000
sum over m -0.030746601 -0.030746601 -0.061493202 0.000000000
sum over m+mul -0.030746601 -0.030746601 -0.061493202 0.000000000
283 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798826 1.000798826 2.001597652 0.000000000
sum over m 1.000798826 1.000798826 2.001597652 0.000000000
s 1 0.207372705 0.207372705 0.414745410 0.000000000
sum over m 0.207372705 0.207372705 0.414745410 0.000000000
s 2 0.014715939 0.014715939 0.029431878 0.000000000
sum over m 0.014715939 0.014715939 0.029431878 0.000000000
sum over m+mul 1.222887470 1.222887470 2.445774940 0.000000000
px 0 1.006402702 1.006402702 2.012805403 0.000000000
py 0 1.006402702 1.006402702 2.012805403 0.000000000
pz 0 1.006204107 1.006204107 2.012408213 0.000000000
sum over m 3.019009510 3.019009510 6.038019020 0.000000000
px 1 0.065463753 0.065463753 0.130927505 0.000000000
py 1 0.065463753 0.065463753 0.130927506 0.000000000
pz 1 0.040336970 0.040336970 0.080673939 0.000000000
sum over m 0.171264475 0.171264475 0.342528951 0.000000000
sum over m+mul 3.190273985 3.190273985 6.380547970 0.000000000
d3z^2-r^2 0 0.196315114 0.196315114 0.392630228 0.000000000
dx^2-y^2 0 0.201562348 0.201562348 0.403124696 0.000000000
dxy 0 0.250911163 0.250911163 0.501822326 0.000000000
dxz 0 0.268489436 0.268489436 0.536978872 0.000000000
dyz 0 0.268489436 0.268489436 0.536978873 0.000000000
sum over m 1.185767498 1.185767498 2.371534995 0.000000000
d3z^2-r^2 1 0.003468094 0.003468094 0.006936188 0.000000000
dx^2-y^2 1 -0.004487844 -0.004487844 -0.008975688 0.000000000
dxy 1 0.015351333 0.015351333 0.030702666 0.000000000
dxz 1 0.003487596 0.003487596 0.006975192 0.000000000
dyz 1 0.003487596 0.003487596 0.006975192 0.000000000
sum over m 0.021306775 0.021306775 0.042613550 0.000000000
sum over m+mul 1.207074272 1.207074272 2.414148545 0.000000000
284 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000789563 1.000789563 2.001579127 0.000000000
sum over m 1.000789563 1.000789563 2.001579127 0.000000000
s 1 0.207379503 0.207379503 0.414759006 0.000000000
sum over m 0.207379503 0.207379503 0.414759006 0.000000000
s 2 0.014718603 0.014718603 0.029437206 0.000000000
sum over m 0.014718603 0.014718603 0.029437206 0.000000000
sum over m+mul 1.222887670 1.222887670 2.445775339 0.000000000
px 0 1.006397619 1.006397619 2.012795239 0.000000000
py 0 1.006397619 1.006397619 2.012795238 0.000000000
pz 0 1.006209583 1.006209583 2.012419165 0.000000000
sum over m 3.019004821 3.019004821 6.038009642 0.000000000
px 1 0.065443633 0.065443633 0.130887266 0.000000000
py 1 0.065443633 0.065443633 0.130887266 0.000000000
pz 1 0.040342919 0.040342919 0.080685838 0.000000000
sum over m 0.171230185 0.171230185 0.342460370 0.000000000
sum over m+mul 3.190235006 3.190235006 6.380470012 0.000000000
d3z^2-r^2 0 0.196301291 0.196301291 0.392602582 0.000000000
dx^2-y^2 0 0.201546457 0.201546457 0.403092914 0.000000000
dxy 0 0.250915052 0.250915052 0.501830104 0.000000000
dxz 0 0.268498059 0.268498059 0.536996118 0.000000000
dyz 0 0.268498059 0.268498059 0.536996118 0.000000000
sum over m 1.185758918 1.185758918 2.371517836 0.000000000
d3z^2-r^2 1 0.003468289 0.003468289 0.006936578 0.000000000
dx^2-y^2 1 -0.004485457 -0.004485457 -0.008970914 0.000000000
dxy 1 0.015348080 0.015348080 0.030696160 0.000000000
dxz 1 0.003484376 0.003484376 0.006968753 0.000000000
dyz 1 0.003484377 0.003484377 0.006968753 0.000000000
sum over m 0.021299665 0.021299665 0.042599330 0.000000000
sum over m+mul 1.207058583 1.207058583 2.414117166 0.000000000
285 O Up spin Down spin Sum Diff
multiple
s 0 0.893887596 0.893887596 1.787775192 0.000000000
sum over m 0.893887596 0.893887596 1.787775192 0.000000000
s 1 -0.003040335 -0.003040335 -0.006080670 0.000000000
sum over m -0.003040335 -0.003040335 -0.006080670 0.000000000
sum over m+mul 0.890847261 0.890847261 1.781694521 0.000000000
px 0 0.786934586 0.786934586 1.573869172 0.000000000
py 0 0.786934585 0.786934585 1.573869171 0.000000000
pz 0 0.779842396 0.779842396 1.559684793 0.000000000
sum over m 2.353711568 2.353711568 4.707423136 0.000000000
px 1 -0.008738414 -0.008738414 -0.017476828 0.000000000
py 1 -0.008738414 -0.008738414 -0.017476828 0.000000000
pz 1 -0.006468379 -0.006468379 -0.012936758 0.000000000
sum over m -0.023945207 -0.023945207 -0.047890414 0.000000000
sum over m+mul 2.329766361 2.329766361 4.659532722 0.000000000
d3z^2-r^2 0 -0.006392302 -0.006392302 -0.012784604 0.000000000
dx^2-y^2 0 -0.005060774 -0.005060774 -0.010121547 0.000000000
dxy 0 -0.005434442 -0.005434442 -0.010868884 0.000000000
dxz 0 -0.006932725 -0.006932725 -0.013865450 0.000000000
dyz 0 -0.006932725 -0.006932725 -0.013865450 0.000000000
sum over m -0.030752967 -0.030752967 -0.061505935 0.000000000
sum over m+mul -0.030752967 -0.030752967 -0.061505935 0.000000000
286 O Up spin Down spin Sum Diff
multiple
s 0 0.893910072 0.893910072 1.787820143 0.000000000
sum over m 0.893910072 0.893910072 1.787820143 0.000000000
s 1 -0.003042497 -0.003042497 -0.006084994 0.000000000
sum over m -0.003042497 -0.003042497 -0.006084994 0.000000000
sum over m+mul 0.890867575 0.890867575 1.781735149 0.000000000
px 0 0.787042238 0.787042238 1.574084475 0.000000000
py 0 0.787042238 0.787042238 1.574084475 0.000000000
pz 0 0.779680403 0.779680403 1.559360807 0.000000000
sum over m 2.353764879 2.353764879 4.707529757 0.000000000
px 1 -0.008733007 -0.008733007 -0.017466015 0.000000000
py 1 -0.008733007 -0.008733007 -0.017466015 0.000000000
pz 1 -0.006457064 -0.006457064 -0.012914128 0.000000000
sum over m -0.023923079 -0.023923079 -0.047846158 0.000000000
sum over m+mul 2.329841800 2.329841800 4.659683600 0.000000000
d3z^2-r^2 0 -0.006390428 -0.006390428 -0.012780855 0.000000000
dx^2-y^2 0 -0.005052107 -0.005052107 -0.010104215 0.000000000
dxy 0 -0.005435063 -0.005435063 -0.010870126 0.000000000
dxz 0 -0.006924042 -0.006924042 -0.013848083 0.000000000
dyz 0 -0.006924042 -0.006924042 -0.013848083 0.000000000
sum over m -0.030725681 -0.030725681 -0.061451362 0.000000000
sum over m+mul -0.030725681 -0.030725681 -0.061451362 0.000000000
287 O Up spin Down spin Sum Diff
multiple
s 0 0.893903601 0.893903601 1.787807203 0.000000000
sum over m 0.893903601 0.893903601 1.787807203 0.000000000
s 1 -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m+mul 0.890862791 0.890862791 1.781725582 0.000000000
px 0 0.786842319 0.786842319 1.573684639 0.000000000
py 0 0.787104850 0.787104850 1.574209699 0.000000000
pz 0 0.779795861 0.779795861 1.559591721 0.000000000
sum over m 2.353743029 2.353743029 4.707486059 0.000000000
px 1 -0.008734160 -0.008734160 -0.017468319 0.000000000
py 1 -0.008748973 -0.008748973 -0.017497946 0.000000000
pz 1 -0.006464610 -0.006464610 -0.012929219 0.000000000
sum over m -0.023947742 -0.023947742 -0.047895484 0.000000000
sum over m+mul 2.329795287 2.329795287 4.659590575 0.000000000
d3z^2-r^2 0 -0.006391992 -0.006391992 -0.012783985 0.000000000
dx^2-y^2 0 -0.005059009 -0.005059009 -0.010118018 0.000000000
dxy 0 -0.005434991 -0.005434991 -0.010869982 0.000000000
dxz 0 -0.006932668 -0.006932668 -0.013865336 0.000000000
dyz 0 -0.006927941 -0.006927941 -0.013855881 0.000000000
sum over m -0.030746601 -0.030746601 -0.061493202 0.000000000
sum over m+mul -0.030746601 -0.030746601 -0.061493202 0.000000000
288 O Up spin Down spin Sum Diff
multiple
s 0 0.893903601 0.893903601 1.787807203 0.000000000
sum over m 0.893903601 0.893903601 1.787807203 0.000000000
s 1 -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m+mul 0.890862791 0.890862791 1.781725582 0.000000000
px 0 0.787104850 0.787104850 1.574209700 0.000000000
py 0 0.786842319 0.786842319 1.573684638 0.000000000
pz 0 0.779795861 0.779795861 1.559591721 0.000000000
sum over m 2.353743030 2.353743030 4.707486059 0.000000000
px 1 -0.008748973 -0.008748973 -0.017497946 0.000000000
py 1 -0.008734159 -0.008734159 -0.017468319 0.000000000
pz 1 -0.006464610 -0.006464610 -0.012929220 0.000000000
sum over m -0.023947742 -0.023947742 -0.047895484 0.000000000
sum over m+mul 2.329795287 2.329795287 4.659590575 0.000000000
d3z^2-r^2 0 -0.006391992 -0.006391992 -0.012783985 0.000000000
dx^2-y^2 0 -0.005059009 -0.005059009 -0.010118018 0.000000000
dxy 0 -0.005434991 -0.005434991 -0.010869982 0.000000000
dxz 0 -0.006927941 -0.006927941 -0.013855881 0.000000000
dyz 0 -0.006932668 -0.006932668 -0.013865336 0.000000000
sum over m -0.030746601 -0.030746601 -0.061493202 0.000000000
sum over m+mul -0.030746601 -0.030746601 -0.061493202 0.000000000
289 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000798826 1.000798826 2.001597652 0.000000000
sum over m 1.000798826 1.000798826 2.001597652 0.000000000
s 1 0.207372705 0.207372705 0.414745410 0.000000000
sum over m 0.207372705 0.207372705 0.414745410 0.000000000
s 2 0.014715939 0.014715939 0.029431878 0.000000000
sum over m 0.014715939 0.014715939 0.029431878 0.000000000
sum over m+mul 1.222887470 1.222887470 2.445774940 0.000000000
px 0 1.006402702 1.006402702 2.012805403 0.000000000
py 0 1.006402702 1.006402702 2.012805404 0.000000000
pz 0 1.006204107 1.006204107 2.012408213 0.000000000
sum over m 3.019009510 3.019009510 6.038019020 0.000000000
px 1 0.065463753 0.065463753 0.130927506 0.000000000
py 1 0.065463753 0.065463753 0.130927506 0.000000000
pz 1 0.040336970 0.040336970 0.080673940 0.000000000
sum over m 0.171264476 0.171264476 0.342528951 0.000000000
sum over m+mul 3.190273986 3.190273986 6.380547971 0.000000000
d3z^2-r^2 0 0.196315114 0.196315114 0.392630228 0.000000000
dx^2-y^2 0 0.201562348 0.201562348 0.403124696 0.000000000
dxy 0 0.250911163 0.250911163 0.501822326 0.000000000
dxz 0 0.268489436 0.268489436 0.536978872 0.000000000
dyz 0 0.268489436 0.268489436 0.536978872 0.000000000
sum over m 1.185767497 1.185767497 2.371534994 0.000000000
d3z^2-r^2 1 0.003468094 0.003468094 0.006936188 0.000000000
dx^2-y^2 1 -0.004487844 -0.004487844 -0.008975688 0.000000000
dxy 1 0.015351333 0.015351333 0.030702666 0.000000000
dxz 1 0.003487596 0.003487596 0.006975192 0.000000000
dyz 1 0.003487596 0.003487596 0.006975192 0.000000000
sum over m 0.021306775 0.021306775 0.042613550 0.000000000
sum over m+mul 1.207074272 1.207074272 2.414148544 0.000000000
290 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000789563 1.000789563 2.001579127 0.000000000
sum over m 1.000789563 1.000789563 2.001579127 0.000000000
s 1 0.207379503 0.207379503 0.414759006 0.000000000
sum over m 0.207379503 0.207379503 0.414759006 0.000000000
s 2 0.014718603 0.014718603 0.029437206 0.000000000
sum over m 0.014718603 0.014718603 0.029437206 0.000000000
sum over m+mul 1.222887669 1.222887669 2.445775339 0.000000000
px 0 1.006397619 1.006397619 2.012795238 0.000000000
py 0 1.006397619 1.006397619 2.012795238 0.000000000
pz 0 1.006209583 1.006209583 2.012419165 0.000000000
sum over m 3.019004821 3.019004821 6.038009642 0.000000000
px 1 0.065443633 0.065443633 0.130887266 0.000000000
py 1 0.065443633 0.065443633 0.130887266 0.000000000
pz 1 0.040342919 0.040342919 0.080685837 0.000000000
sum over m 0.171230185 0.171230185 0.342460369 0.000000000
sum over m+mul 3.190235006 3.190235006 6.380470012 0.000000000
d3z^2-r^2 0 0.196301291 0.196301291 0.392602582 0.000000000
dx^2-y^2 0 0.201546457 0.201546457 0.403092914 0.000000000
dxy 0 0.250915052 0.250915052 0.501830104 0.000000000
dxz 0 0.268498059 0.268498059 0.536996118 0.000000000
dyz 0 0.268498059 0.268498059 0.536996118 0.000000000
sum over m 1.185758918 1.185758918 2.371517837 0.000000000
d3z^2-r^2 1 0.003468289 0.003468289 0.006936578 0.000000000
dx^2-y^2 1 -0.004485457 -0.004485457 -0.008970914 0.000000000
dxy 1 0.015348080 0.015348080 0.030696160 0.000000000
dxz 1 0.003484376 0.003484376 0.006968753 0.000000000
dyz 1 0.003484377 0.003484377 0.006968753 0.000000000
sum over m 0.021299665 0.021299665 0.042599330 0.000000000
sum over m+mul 1.207058583 1.207058583 2.414117167 0.000000000
291 O Up spin Down spin Sum Diff
multiple
s 0 0.893887596 0.893887596 1.787775192 0.000000000
sum over m 0.893887596 0.893887596 1.787775192 0.000000000
s 1 -0.003040335 -0.003040335 -0.006080670 0.000000000
sum over m -0.003040335 -0.003040335 -0.006080670 0.000000000
sum over m+mul 0.890847261 0.890847261 1.781694521 0.000000000
px 0 0.786934585 0.786934585 1.573869171 0.000000000
py 0 0.786934586 0.786934586 1.573869171 0.000000000
pz 0 0.779842397 0.779842397 1.559684793 0.000000000
sum over m 2.353711568 2.353711568 4.707423136 0.000000000
px 1 -0.008738414 -0.008738414 -0.017476828 0.000000000
py 1 -0.008738414 -0.008738414 -0.017476828 0.000000000
pz 1 -0.006468379 -0.006468379 -0.012936758 0.000000000
sum over m -0.023945207 -0.023945207 -0.047890414 0.000000000
sum over m+mul 2.329766361 2.329766361 4.659532722 0.000000000
d3z^2-r^2 0 -0.006392302 -0.006392302 -0.012784604 0.000000000
dx^2-y^2 0 -0.005060774 -0.005060774 -0.010121547 0.000000000
dxy 0 -0.005434442 -0.005434442 -0.010868884 0.000000000
dxz 0 -0.006932725 -0.006932725 -0.013865450 0.000000000
dyz 0 -0.006932725 -0.006932725 -0.013865450 0.000000000
sum over m -0.030752967 -0.030752967 -0.061505935 0.000000000
sum over m+mul -0.030752967 -0.030752967 -0.061505935 0.000000000
292 O Up spin Down spin Sum Diff
multiple
s 0 0.893910072 0.893910072 1.787820143 0.000000000
sum over m 0.893910072 0.893910072 1.787820143 0.000000000
s 1 -0.003042497 -0.003042497 -0.006084994 0.000000000
sum over m -0.003042497 -0.003042497 -0.006084994 0.000000000
sum over m+mul 0.890867575 0.890867575 1.781735149 0.000000000
px 0 0.787042238 0.787042238 1.574084476 0.000000000
py 0 0.787042238 0.787042238 1.574084475 0.000000000
pz 0 0.779680403 0.779680403 1.559360807 0.000000000
sum over m 2.353764879 2.353764879 4.707529758 0.000000000
px 1 -0.008733008 -0.008733008 -0.017466015 0.000000000
py 1 -0.008733008 -0.008733008 -0.017466015 0.000000000
pz 1 -0.006457064 -0.006457064 -0.012914128 0.000000000
sum over m -0.023923079 -0.023923079 -0.047846158 0.000000000
sum over m+mul 2.329841800 2.329841800 4.659683600 0.000000000
d3z^2-r^2 0 -0.006390428 -0.006390428 -0.012780855 0.000000000
dx^2-y^2 0 -0.005052107 -0.005052107 -0.010104215 0.000000000
dxy 0 -0.005435063 -0.005435063 -0.010870126 0.000000000
dxz 0 -0.006924042 -0.006924042 -0.013848083 0.000000000
dyz 0 -0.006924042 -0.006924042 -0.013848083 0.000000000
sum over m -0.030725681 -0.030725681 -0.061451362 0.000000000
sum over m+mul -0.030725681 -0.030725681 -0.061451362 0.000000000
293 O Up spin Down spin Sum Diff
multiple
s 0 0.893903601 0.893903601 1.787807203 0.000000000
sum over m 0.893903601 0.893903601 1.787807203 0.000000000
s 1 -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m+mul 0.890862791 0.890862791 1.781725582 0.000000000
px 0 0.786842319 0.786842319 1.573684639 0.000000000
py 0 0.787104850 0.787104850 1.574209700 0.000000000
pz 0 0.779795861 0.779795861 1.559591721 0.000000000
sum over m 2.353743030 2.353743030 4.707486060 0.000000000
px 1 -0.008734160 -0.008734160 -0.017468319 0.000000000
py 1 -0.008748973 -0.008748973 -0.017497946 0.000000000
pz 1 -0.006464610 -0.006464610 -0.012929219 0.000000000
sum over m -0.023947742 -0.023947742 -0.047895484 0.000000000
sum over m+mul 2.329795288 2.329795288 4.659590576 0.000000000
d3z^2-r^2 0 -0.006391992 -0.006391992 -0.012783985 0.000000000
dx^2-y^2 0 -0.005059009 -0.005059009 -0.010118018 0.000000000
dxy 0 -0.005434991 -0.005434991 -0.010869982 0.000000000
dxz 0 -0.006932668 -0.006932668 -0.013865336 0.000000000
dyz 0 -0.006927941 -0.006927941 -0.013855881 0.000000000
sum over m -0.030746601 -0.030746601 -0.061493202 0.000000000
sum over m+mul -0.030746601 -0.030746601 -0.061493202 0.000000000
294 O Up spin Down spin Sum Diff
multiple
s 0 0.893903601 0.893903601 1.787807203 0.000000000
sum over m 0.893903601 0.893903601 1.787807203 0.000000000
s 1 -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m -0.003040810 -0.003040810 -0.006081621 0.000000000
sum over m+mul 0.890862791 0.890862791 1.781725582 0.000000000
px 0 0.787104850 0.787104850 1.574209700 0.000000000
py 0 0.786842319 0.786842319 1.573684638 0.000000000
pz 0 0.779795860 0.779795860 1.559591720 0.000000000
sum over m 2.353743029 2.353743029 4.707486058 0.000000000
px 1 -0.008748973 -0.008748973 -0.017497946 0.000000000
py 1 -0.008734159 -0.008734159 -0.017468319 0.000000000
pz 1 -0.006464610 -0.006464610 -0.012929220 0.000000000
sum over m -0.023947742 -0.023947742 -0.047895485 0.000000000
sum over m+mul 2.329795287 2.329795287 4.659590574 0.000000000
d3z^2-r^2 0 -0.006391992 -0.006391992 -0.012783985 0.000000000
dx^2-y^2 0 -0.005059009 -0.005059009 -0.010118018 0.000000000
dxy 0 -0.005434991 -0.005434991 -0.010869982 0.000000000
dxz 0 -0.006927941 -0.006927941 -0.013855881 0.000000000
dyz 0 -0.006932668 -0.006932668 -0.013865336 0.000000000
sum over m -0.030746601 -0.030746601 -0.061493202 0.000000000
sum over m+mul -0.030746601 -0.030746601 -0.061493202 0.000000000
295 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000794346 1.000794346 2.001588692 0.000000000
sum over m 1.000794346 1.000794346 2.001588692 0.000000000
s 1 0.207399176 0.207399176 0.414798352 0.000000000
sum over m 0.207399176 0.207399176 0.414798352 0.000000000
s 2 0.014720923 0.014720923 0.029441845 0.000000000
sum over m 0.014720923 0.014720923 0.029441845 0.000000000
sum over m+mul 1.222914445 1.222914445 2.445828889 0.000000000
px 0 1.006381344 1.006381344 2.012762688 0.000000000
py 0 1.006370005 1.006370005 2.012740010 0.000000000
pz 0 1.006214474 1.006214474 2.012428949 0.000000000
sum over m 3.018965824 3.018965824 6.037931648 0.000000000
px 1 0.065434731 0.065434731 0.130869461 0.000000000
py 1 0.065452017 0.065452017 0.130904035 0.000000000
pz 1 0.040359775 0.040359775 0.080719550 0.000000000
sum over m 0.171246523 0.171246523 0.342493046 0.000000000
sum over m+mul 3.190212347 3.190212347 6.380424693 0.000000000
d3z^2-r^2 0 0.196317000 0.196317000 0.392634000 0.000000000
dx^2-y^2 0 0.201535060 0.201535060 0.403070120 0.000000000
dxy 0 0.250932486 0.250932486 0.501864973 0.000000000
dxz 0 0.268481712 0.268481712 0.536963424 0.000000000
dyz 0 0.268493958 0.268493958 0.536987916 0.000000000
sum over m 1.185760217 1.185760217 2.371520434 0.000000000
d3z^2-r^2 1 0.003471608 0.003471608 0.006943216 0.000000000
dx^2-y^2 1 -0.004483514 -0.004483514 -0.008967027 0.000000000
dxy 1 0.015345845 0.015345845 0.030691691 0.000000000
dxz 1 0.003488639 0.003488639 0.006977279 0.000000000
dyz 1 0.003490453 0.003490453 0.006980907 0.000000000
sum over m 0.021313033 0.021313033 0.042626066 0.000000000
sum over m+mul 1.207073250 1.207073250 2.414146499 0.000000000
296 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000774711 1.000774711 2.001549422 0.000000000
sum over m 1.000774711 1.000774711 2.001549422 0.000000000
s 1 0.207407309 0.207407309 0.414814618 0.000000000
sum over m 0.207407309 0.207407309 0.414814618 0.000000000
s 2 0.014723324 0.014723324 0.029446649 0.000000000
sum over m 0.014723324 0.014723324 0.029446649 0.000000000
sum over m+mul 1.222905344 1.222905344 2.445810689 0.000000000
px 0 1.006382809 1.006382809 2.012765618 0.000000000
py 0 1.006372285 1.006372285 2.012744570 0.000000000
pz 0 1.006198612 1.006198612 2.012397224 0.000000000
sum over m 3.018953706 3.018953706 6.037907412 0.000000000
px 1 0.065431480 0.065431480 0.130862960 0.000000000
py 1 0.065429039 0.065429039 0.130858078 0.000000000
pz 1 0.040374926 0.040374926 0.080749852 0.000000000
sum over m 0.171235445 0.171235445 0.342470890 0.000000000
sum over m+mul 3.190189151 3.190189151 6.380378302 0.000000000
d3z^2-r^2 0 0.196296472 0.196296472 0.392592943 0.000000000
dx^2-y^2 0 0.201520043 0.201520043 0.403040086 0.000000000
dxy 0 0.250928325 0.250928325 0.501856650 0.000000000
dxz 0 0.268492796 0.268492796 0.536985593 0.000000000
dyz 0 0.268513479 0.268513479 0.537026958 0.000000000
sum over m 1.185751115 1.185751115 2.371502230 0.000000000
d3z^2-r^2 1 0.003473219 0.003473219 0.006946439 0.000000000
dx^2-y^2 1 -0.004478692 -0.004478692 -0.008957384 0.000000000
dxy 1 0.015341024 0.015341024 0.030682047 0.000000000
dxz 1 0.003485600 0.003485600 0.006971200 0.000000000
dyz 1 0.003487435 0.003487435 0.006974871 0.000000000
sum over m 0.021308586 0.021308586 0.042617172 0.000000000
sum over m+mul 1.207059701 1.207059701 2.414119402 0.000000000
297 O Up spin Down spin Sum Diff
multiple
s 0 0.893859098 0.893859098 1.787718196 0.000000000
sum over m 0.893859098 0.893859098 1.787718196 0.000000000
s 1 -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m+mul 0.890817569 0.890817569 1.781635137 0.000000000
px 0 0.786939498 0.786939498 1.573878996 0.000000000
py 0 0.786877142 0.786877142 1.573754284 0.000000000
pz 0 0.779871227 0.779871227 1.559742455 0.000000000
sum over m 2.353687868 2.353687868 4.707375735 0.000000000
px 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
py 1 -0.008725153 -0.008725153 -0.017450305 0.000000000
pz 1 -0.006467431 -0.006467431 -0.012934861 0.000000000
sum over m -0.023928314 -0.023928314 -0.047856628 0.000000000
sum over m+mul 2.329759554 2.329759554 4.659519108 0.000000000
d3z^2-r^2 0 -0.006389921 -0.006389921 -0.012779843 0.000000000
dx^2-y^2 0 -0.005060831 -0.005060831 -0.010121663 0.000000000
dxy 0 -0.005433558 -0.005433558 -0.010867116 0.000000000
dxz 0 -0.006932408 -0.006932408 -0.013864816 0.000000000
dyz 0 -0.006934055 -0.006934055 -0.013868111 0.000000000
sum over m -0.030750774 -0.030750774 -0.061501548 0.000000000
sum over m+mul -0.030750774 -0.030750774 -0.061501548 0.000000000
298 O Up spin Down spin Sum Diff
multiple
s 0 0.893906943 0.893906943 1.787813886 0.000000000
sum over m 0.893906943 0.893906943 1.787813886 0.000000000
s 1 -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m+mul 0.890864367 0.890864367 1.781728733 0.000000000
px 0 0.787068705 0.787068705 1.574137411 0.000000000
py 0 0.787020216 0.787020216 1.574040431 0.000000000
pz 0 0.779696226 0.779696226 1.559392453 0.000000000
sum over m 2.353785147 2.353785147 4.707570295 0.000000000
px 1 -0.008736847 -0.008736847 -0.017473695 0.000000000
py 1 -0.008731428 -0.008731428 -0.017462857 0.000000000
pz 1 -0.006454271 -0.006454271 -0.012908542 0.000000000
sum over m -0.023922547 -0.023922547 -0.047845094 0.000000000
sum over m+mul 2.329862600 2.329862600 4.659725201 0.000000000
d3z^2-r^2 0 -0.006390048 -0.006390048 -0.012780096 0.000000000
dx^2-y^2 0 -0.005053782 -0.005053782 -0.010107564 0.000000000
dxy 0 -0.005435831 -0.005435831 -0.010871662 0.000000000
dxz 0 -0.006923376 -0.006923376 -0.013846752 0.000000000
dyz 0 -0.006926865 -0.006926865 -0.013853730 0.000000000
sum over m -0.030729902 -0.030729902 -0.061459804 0.000000000
sum over m+mul -0.030729902 -0.030729902 -0.061459804 0.000000000
299 O Up spin Down spin Sum Diff
multiple
s 0 0.893902753 0.893902753 1.787805505 0.000000000
sum over m 0.893902753 0.893902753 1.787805505 0.000000000
s 1 -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m+mul 0.890860725 0.890860725 1.781721450 0.000000000
px 0 0.786819648 0.786819648 1.573639297 0.000000000
py 0 0.787139398 0.787139398 1.574278796 0.000000000
pz 0 0.779778741 0.779778741 1.559557482 0.000000000
sum over m 2.353737787 2.353737787 4.707475575 0.000000000
px 1 -0.008735731 -0.008735731 -0.017471462 0.000000000
py 1 -0.008745736 -0.008745736 -0.017491472 0.000000000
pz 1 -0.006462867 -0.006462867 -0.012925733 0.000000000
sum over m -0.023944334 -0.023944334 -0.047888667 0.000000000
sum over m+mul 2.329793454 2.329793454 4.659586907 0.000000000
d3z^2-r^2 0 -0.006391160 -0.006391160 -0.012782321 0.000000000
dx^2-y^2 0 -0.005058206 -0.005058206 -0.010116413 0.000000000
dxy 0 -0.005434582 -0.005434582 -0.010869165 0.000000000
dxz 0 -0.006932318 -0.006932318 -0.013864636 0.000000000
dyz 0 -0.006927117 -0.006927117 -0.013854234 0.000000000
sum over m -0.030743384 -0.030743384 -0.061486768 0.000000000
sum over m+mul -0.030743384 -0.030743384 -0.061486768 0.000000000
300 O Up spin Down spin Sum Diff
multiple
s 0 0.893893710 0.893893710 1.787787419 0.000000000
sum over m 0.893893710 0.893893710 1.787787419 0.000000000
s 1 -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m+mul 0.890851876 0.890851876 1.781703752 0.000000000
px 0 0.787091794 0.787091794 1.574183588 0.000000000
py 0 0.786895588 0.786895588 1.573791175 0.000000000
pz 0 0.779775435 0.779775435 1.559550869 0.000000000
sum over m 2.353762816 2.353762816 4.707525633 0.000000000
px 1 -0.008743439 -0.008743439 -0.017486877 0.000000000
py 1 -0.008729916 -0.008729916 -0.017459831 0.000000000
pz 1 -0.006461929 -0.006461929 -0.012923859 0.000000000
sum over m -0.023935283 -0.023935283 -0.047870567 0.000000000
sum over m+mul 2.329827533 2.329827533 4.659655066 0.000000000
d3z^2-r^2 0 -0.006390598 -0.006390598 -0.012781196 0.000000000
dx^2-y^2 0 -0.005058057 -0.005058057 -0.010116115 0.000000000
dxy 0 -0.005434854 -0.005434854 -0.010869707 0.000000000
dxz 0 -0.006926194 -0.006926194 -0.013852388 0.000000000
dyz 0 -0.006932221 -0.006932221 -0.013864442 0.000000000
sum over m -0.030741924 -0.030741924 -0.061483848 0.000000000
sum over m+mul -0.030741924 -0.030741924 -0.061483848 0.000000000
301 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000794346 1.000794346 2.001588692 0.000000000
sum over m 1.000794346 1.000794346 2.001588692 0.000000000
s 1 0.207399176 0.207399176 0.414798352 0.000000000
sum over m 0.207399176 0.207399176 0.414798352 0.000000000
s 2 0.014720923 0.014720923 0.029441845 0.000000000
sum over m 0.014720923 0.014720923 0.029441845 0.000000000
sum over m+mul 1.222914444 1.222914444 2.445828889 0.000000000
px 0 1.006381344 1.006381344 2.012762688 0.000000000
py 0 1.006370005 1.006370005 2.012740010 0.000000000
pz 0 1.006214475 1.006214475 2.012428949 0.000000000
sum over m 3.018965824 3.018965824 6.037931648 0.000000000
px 1 0.065434731 0.065434731 0.130869461 0.000000000
py 1 0.065452018 0.065452018 0.130904036 0.000000000
pz 1 0.040359774 0.040359774 0.080719549 0.000000000
sum over m 0.171246523 0.171246523 0.342493046 0.000000000
sum over m+mul 3.190212347 3.190212347 6.380424694 0.000000000
d3z^2-r^2 0 0.196317000 0.196317000 0.392634000 0.000000000
dx^2-y^2 0 0.201535060 0.201535060 0.403070119 0.000000000
dxy 0 0.250932486 0.250932486 0.501864972 0.000000000
dxz 0 0.268481712 0.268481712 0.536963424 0.000000000
dyz 0 0.268493958 0.268493958 0.536987917 0.000000000
sum over m 1.185760216 1.185760216 2.371520433 0.000000000
d3z^2-r^2 1 0.003471608 0.003471608 0.006943216 0.000000000
dx^2-y^2 1 -0.004483514 -0.004483514 -0.008967027 0.000000000
dxy 1 0.015345845 0.015345845 0.030691691 0.000000000
dxz 1 0.003488639 0.003488639 0.006977279 0.000000000
dyz 1 0.003490453 0.003490453 0.006980907 0.000000000
sum over m 0.021313033 0.021313033 0.042626065 0.000000000
sum over m+mul 1.207073249 1.207073249 2.414146498 0.000000000
302 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000774711 1.000774711 2.001549422 0.000000000
sum over m 1.000774711 1.000774711 2.001549422 0.000000000
s 1 0.207407309 0.207407309 0.414814618 0.000000000
sum over m 0.207407309 0.207407309 0.414814618 0.000000000
s 2 0.014723324 0.014723324 0.029446649 0.000000000
sum over m 0.014723324 0.014723324 0.029446649 0.000000000
sum over m+mul 1.222905344 1.222905344 2.445810689 0.000000000
px 0 1.006382809 1.006382809 2.012765618 0.000000000
py 0 1.006372285 1.006372285 2.012744570 0.000000000
pz 0 1.006198612 1.006198612 2.012397224 0.000000000
sum over m 3.018953706 3.018953706 6.037907412 0.000000000
px 1 0.065431480 0.065431480 0.130862960 0.000000000
py 1 0.065429039 0.065429039 0.130858078 0.000000000
pz 1 0.040374926 0.040374926 0.080749851 0.000000000
sum over m 0.171235445 0.171235445 0.342470890 0.000000000
sum over m+mul 3.190189151 3.190189151 6.380378302 0.000000000
d3z^2-r^2 0 0.196296471 0.196296471 0.392592943 0.000000000
dx^2-y^2 0 0.201520043 0.201520043 0.403040086 0.000000000
dxy 0 0.250928325 0.250928325 0.501856650 0.000000000
dxz 0 0.268492796 0.268492796 0.536985593 0.000000000
dyz 0 0.268513479 0.268513479 0.537026958 0.000000000
sum over m 1.185751115 1.185751115 2.371502230 0.000000000
d3z^2-r^2 1 0.003473219 0.003473219 0.006946439 0.000000000
dx^2-y^2 1 -0.004478692 -0.004478692 -0.008957384 0.000000000
dxy 1 0.015341024 0.015341024 0.030682047 0.000000000
dxz 1 0.003485600 0.003485600 0.006971200 0.000000000
dyz 1 0.003487435 0.003487435 0.006974871 0.000000000
sum over m 0.021308586 0.021308586 0.042617172 0.000000000
sum over m+mul 1.207059701 1.207059701 2.414119402 0.000000000
303 O Up spin Down spin Sum Diff
multiple
s 0 0.893859098 0.893859098 1.787718196 0.000000000
sum over m 0.893859098 0.893859098 1.787718196 0.000000000
s 1 -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m+mul 0.890817568 0.890817568 1.781635137 0.000000000
px 0 0.786939499 0.786939499 1.573878997 0.000000000
py 0 0.786877142 0.786877142 1.573754285 0.000000000
pz 0 0.779871227 0.779871227 1.559742455 0.000000000
sum over m 2.353687868 2.353687868 4.707375737 0.000000000
px 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
py 1 -0.008725153 -0.008725153 -0.017450305 0.000000000
pz 1 -0.006467431 -0.006467431 -0.012934861 0.000000000
sum over m -0.023928314 -0.023928314 -0.047856628 0.000000000
sum over m+mul 2.329759554 2.329759554 4.659519109 0.000000000
d3z^2-r^2 0 -0.006389921 -0.006389921 -0.012779843 0.000000000
dx^2-y^2 0 -0.005060831 -0.005060831 -0.010121663 0.000000000
dxy 0 -0.005433558 -0.005433558 -0.010867116 0.000000000
dxz 0 -0.006932408 -0.006932408 -0.013864816 0.000000000
dyz 0 -0.006934055 -0.006934055 -0.013868111 0.000000000
sum over m -0.030750774 -0.030750774 -0.061501548 0.000000000
sum over m+mul -0.030750774 -0.030750774 -0.061501548 0.000000000
304 O Up spin Down spin Sum Diff
multiple
s 0 0.893906943 0.893906943 1.787813886 0.000000000
sum over m 0.893906943 0.893906943 1.787813886 0.000000000
s 1 -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m+mul 0.890864367 0.890864367 1.781728733 0.000000000
px 0 0.787068705 0.787068705 1.574137410 0.000000000
py 0 0.787020216 0.787020216 1.574040431 0.000000000
pz 0 0.779696226 0.779696226 1.559392453 0.000000000
sum over m 2.353785147 2.353785147 4.707570294 0.000000000
px 1 -0.008736847 -0.008736847 -0.017473695 0.000000000
py 1 -0.008731428 -0.008731428 -0.017462857 0.000000000
pz 1 -0.006454271 -0.006454271 -0.012908542 0.000000000
sum over m -0.023922547 -0.023922547 -0.047845094 0.000000000
sum over m+mul 2.329862600 2.329862600 4.659725200 0.000000000
d3z^2-r^2 0 -0.006390048 -0.006390048 -0.012780096 0.000000000
dx^2-y^2 0 -0.005053782 -0.005053782 -0.010107564 0.000000000
dxy 0 -0.005435831 -0.005435831 -0.010871662 0.000000000
dxz 0 -0.006923376 -0.006923376 -0.013846752 0.000000000
dyz 0 -0.006926865 -0.006926865 -0.013853730 0.000000000
sum over m -0.030729902 -0.030729902 -0.061459804 0.000000000
sum over m+mul -0.030729902 -0.030729902 -0.061459804 0.000000000
305 O Up spin Down spin Sum Diff
multiple
s 0 0.893902753 0.893902753 1.787805505 0.000000000
sum over m 0.893902753 0.893902753 1.787805505 0.000000000
s 1 -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m+mul 0.890860725 0.890860725 1.781721450 0.000000000
px 0 0.786819648 0.786819648 1.573639296 0.000000000
py 0 0.787139398 0.787139398 1.574278796 0.000000000
pz 0 0.779778741 0.779778741 1.559557482 0.000000000
sum over m 2.353737788 2.353737788 4.707475575 0.000000000
px 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
py 1 -0.008745736 -0.008745736 -0.017491473 0.000000000
pz 1 -0.006462867 -0.006462867 -0.012925734 0.000000000
sum over m -0.023944334 -0.023944334 -0.047888668 0.000000000
sum over m+mul 2.329793454 2.329793454 4.659586908 0.000000000
d3z^2-r^2 0 -0.006391160 -0.006391160 -0.012782321 0.000000000
dx^2-y^2 0 -0.005058206 -0.005058206 -0.010116413 0.000000000
dxy 0 -0.005434582 -0.005434582 -0.010869165 0.000000000
dxz 0 -0.006932318 -0.006932318 -0.013864636 0.000000000
dyz 0 -0.006927117 -0.006927117 -0.013854234 0.000000000
sum over m -0.030743384 -0.030743384 -0.061486768 0.000000000
sum over m+mul -0.030743384 -0.030743384 -0.061486768 0.000000000
306 O Up spin Down spin Sum Diff
multiple
s 0 0.893893710 0.893893710 1.787787419 0.000000000
sum over m 0.893893710 0.893893710 1.787787419 0.000000000
s 1 -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m+mul 0.890851876 0.890851876 1.781703752 0.000000000
px 0 0.787091794 0.787091794 1.574183589 0.000000000
py 0 0.786895587 0.786895587 1.573791175 0.000000000
pz 0 0.779775435 0.779775435 1.559550869 0.000000000
sum over m 2.353762816 2.353762816 4.707525633 0.000000000
px 1 -0.008743439 -0.008743439 -0.017486877 0.000000000
py 1 -0.008729916 -0.008729916 -0.017459831 0.000000000
pz 1 -0.006461929 -0.006461929 -0.012923859 0.000000000
sum over m -0.023935283 -0.023935283 -0.047870567 0.000000000
sum over m+mul 2.329827533 2.329827533 4.659655066 0.000000000
d3z^2-r^2 0 -0.006390598 -0.006390598 -0.012781196 0.000000000
dx^2-y^2 0 -0.005058057 -0.005058057 -0.010116115 0.000000000
dxy 0 -0.005434854 -0.005434854 -0.010869707 0.000000000
dxz 0 -0.006926194 -0.006926194 -0.013852388 0.000000000
dyz 0 -0.006932221 -0.006932221 -0.013864442 0.000000000
sum over m -0.030741924 -0.030741924 -0.061483848 0.000000000
sum over m+mul -0.030741924 -0.030741924 -0.061483848 0.000000000
307 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000794346 1.000794346 2.001588691 0.000000000
sum over m 1.000794346 1.000794346 2.001588691 0.000000000
s 1 0.207399176 0.207399176 0.414798352 0.000000000
sum over m 0.207399176 0.207399176 0.414798352 0.000000000
s 2 0.014720923 0.014720923 0.029441846 0.000000000
sum over m 0.014720923 0.014720923 0.029441846 0.000000000
sum over m+mul 1.222914444 1.222914444 2.445828889 0.000000000
px 0 1.006381344 1.006381344 2.012762688 0.000000000
py 0 1.006370005 1.006370005 2.012740010 0.000000000
pz 0 1.006214474 1.006214474 2.012428949 0.000000000
sum over m 3.018965824 3.018965824 6.037931648 0.000000000
px 1 0.065434730 0.065434730 0.130869461 0.000000000
py 1 0.065452017 0.065452017 0.130904035 0.000000000
pz 1 0.040359774 0.040359774 0.080719549 0.000000000
sum over m 0.171246522 0.171246522 0.342493045 0.000000000
sum over m+mul 3.190212346 3.190212346 6.380424692 0.000000000
d3z^2-r^2 0 0.196317000 0.196317000 0.392634000 0.000000000
dx^2-y^2 0 0.201535060 0.201535060 0.403070119 0.000000000
dxy 0 0.250932486 0.250932486 0.501864973 0.000000000
dxz 0 0.268481712 0.268481712 0.536963424 0.000000000
dyz 0 0.268493958 0.268493958 0.536987916 0.000000000
sum over m 1.185760216 1.185760216 2.371520432 0.000000000
d3z^2-r^2 1 0.003471608 0.003471608 0.006943216 0.000000000
dx^2-y^2 1 -0.004483514 -0.004483514 -0.008967027 0.000000000
dxy 1 0.015345845 0.015345845 0.030691691 0.000000000
dxz 1 0.003488639 0.003488639 0.006977279 0.000000000
dyz 1 0.003490453 0.003490453 0.006980907 0.000000000
sum over m 0.021313033 0.021313033 0.042626066 0.000000000
sum over m+mul 1.207073249 1.207073249 2.414146498 0.000000000
308 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000774711 1.000774711 2.001549422 0.000000000
sum over m 1.000774711 1.000774711 2.001549422 0.000000000
s 1 0.207407309 0.207407309 0.414814618 0.000000000
sum over m 0.207407309 0.207407309 0.414814618 0.000000000
s 2 0.014723324 0.014723324 0.029446649 0.000000000
sum over m 0.014723324 0.014723324 0.029446649 0.000000000
sum over m+mul 1.222905344 1.222905344 2.445810689 0.000000000
px 0 1.006382809 1.006382809 2.012765618 0.000000000
py 0 1.006372285 1.006372285 2.012744570 0.000000000
pz 0 1.006198612 1.006198612 2.012397224 0.000000000
sum over m 3.018953706 3.018953706 6.037907412 0.000000000
px 1 0.065431480 0.065431480 0.130862960 0.000000000
py 1 0.065429039 0.065429039 0.130858078 0.000000000
pz 1 0.040374926 0.040374926 0.080749851 0.000000000
sum over m 0.171235445 0.171235445 0.342470890 0.000000000
sum over m+mul 3.190189151 3.190189151 6.380378301 0.000000000
d3z^2-r^2 0 0.196296472 0.196296472 0.392592943 0.000000000
dx^2-y^2 0 0.201520043 0.201520043 0.403040087 0.000000000
dxy 0 0.250928325 0.250928325 0.501856650 0.000000000
dxz 0 0.268492796 0.268492796 0.536985593 0.000000000
dyz 0 0.268513479 0.268513479 0.537026958 0.000000000
sum over m 1.185751115 1.185751115 2.371502231 0.000000000
d3z^2-r^2 1 0.003473219 0.003473219 0.006946439 0.000000000
dx^2-y^2 1 -0.004478692 -0.004478692 -0.008957385 0.000000000
dxy 1 0.015341024 0.015341024 0.030682047 0.000000000
dxz 1 0.003485600 0.003485600 0.006971200 0.000000000
dyz 1 0.003487435 0.003487435 0.006974871 0.000000000
sum over m 0.021308586 0.021308586 0.042617172 0.000000000
sum over m+mul 1.207059701 1.207059701 2.414119403 0.000000000
309 O Up spin Down spin Sum Diff
multiple
s 0 0.893859098 0.893859098 1.787718196 0.000000000
sum over m 0.893859098 0.893859098 1.787718196 0.000000000
s 1 -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m+mul 0.890817568 0.890817568 1.781635137 0.000000000
px 0 0.786939498 0.786939498 1.573878997 0.000000000
py 0 0.786877142 0.786877142 1.573754285 0.000000000
pz 0 0.779871227 0.779871227 1.559742455 0.000000000
sum over m 2.353687868 2.353687868 4.707375736 0.000000000
px 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
py 1 -0.008725153 -0.008725153 -0.017450305 0.000000000
pz 1 -0.006467431 -0.006467431 -0.012934861 0.000000000
sum over m -0.023928314 -0.023928314 -0.047856627 0.000000000
sum over m+mul 2.329759554 2.329759554 4.659519109 0.000000000
d3z^2-r^2 0 -0.006389921 -0.006389921 -0.012779843 0.000000000
dx^2-y^2 0 -0.005060831 -0.005060831 -0.010121663 0.000000000
dxy 0 -0.005433558 -0.005433558 -0.010867116 0.000000000
dxz 0 -0.006932408 -0.006932408 -0.013864816 0.000000000
dyz 0 -0.006934055 -0.006934055 -0.013868111 0.000000000
sum over m -0.030750774 -0.030750774 -0.061501548 0.000000000
sum over m+mul -0.030750774 -0.030750774 -0.061501548 0.000000000
310 O Up spin Down spin Sum Diff
multiple
s 0 0.893906943 0.893906943 1.787813886 0.000000000
sum over m 0.893906943 0.893906943 1.787813886 0.000000000
s 1 -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m+mul 0.890864367 0.890864367 1.781728733 0.000000000
px 0 0.787068705 0.787068705 1.574137410 0.000000000
py 0 0.787020216 0.787020216 1.574040431 0.000000000
pz 0 0.779696226 0.779696226 1.559392452 0.000000000
sum over m 2.353785147 2.353785147 4.707570293 0.000000000
px 1 -0.008736847 -0.008736847 -0.017473695 0.000000000
py 1 -0.008731428 -0.008731428 -0.017462857 0.000000000
pz 1 -0.006454271 -0.006454271 -0.012908542 0.000000000
sum over m -0.023922547 -0.023922547 -0.047845094 0.000000000
sum over m+mul 2.329862600 2.329862600 4.659725200 0.000000000
d3z^2-r^2 0 -0.006390048 -0.006390048 -0.012780096 0.000000000
dx^2-y^2 0 -0.005053782 -0.005053782 -0.010107564 0.000000000
dxy 0 -0.005435831 -0.005435831 -0.010871662 0.000000000
dxz 0 -0.006923376 -0.006923376 -0.013846752 0.000000000
dyz 0 -0.006926865 -0.006926865 -0.013853730 0.000000000
sum over m -0.030729902 -0.030729902 -0.061459804 0.000000000
sum over m+mul -0.030729902 -0.030729902 -0.061459804 0.000000000
311 O Up spin Down spin Sum Diff
multiple
s 0 0.893902753 0.893902753 1.787805505 0.000000000
sum over m 0.893902753 0.893902753 1.787805505 0.000000000
s 1 -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m+mul 0.890860725 0.890860725 1.781721450 0.000000000
px 0 0.786819648 0.786819648 1.573639296 0.000000000
py 0 0.787139398 0.787139398 1.574278796 0.000000000
pz 0 0.779778741 0.779778741 1.559557482 0.000000000
sum over m 2.353737787 2.353737787 4.707475575 0.000000000
px 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
py 1 -0.008745736 -0.008745736 -0.017491472 0.000000000
pz 1 -0.006462867 -0.006462867 -0.012925734 0.000000000
sum over m -0.023944334 -0.023944334 -0.047888667 0.000000000
sum over m+mul 2.329793454 2.329793454 4.659586907 0.000000000
d3z^2-r^2 0 -0.006391160 -0.006391160 -0.012782321 0.000000000
dx^2-y^2 0 -0.005058206 -0.005058206 -0.010116413 0.000000000
dxy 0 -0.005434582 -0.005434582 -0.010869165 0.000000000
dxz 0 -0.006932318 -0.006932318 -0.013864636 0.000000000
dyz 0 -0.006927117 -0.006927117 -0.013854234 0.000000000
sum over m -0.030743384 -0.030743384 -0.061486768 0.000000000
sum over m+mul -0.030743384 -0.030743384 -0.061486768 0.000000000
312 O Up spin Down spin Sum Diff
multiple
s 0 0.893893710 0.893893710 1.787787419 0.000000000
sum over m 0.893893710 0.893893710 1.787787419 0.000000000
s 1 -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m+mul 0.890851876 0.890851876 1.781703751 0.000000000
px 0 0.787091794 0.787091794 1.574183589 0.000000000
py 0 0.786895587 0.786895587 1.573791175 0.000000000
pz 0 0.779775435 0.779775435 1.559550869 0.000000000
sum over m 2.353762816 2.353762816 4.707525633 0.000000000
px 1 -0.008743439 -0.008743439 -0.017486877 0.000000000
py 1 -0.008729916 -0.008729916 -0.017459831 0.000000000
pz 1 -0.006461929 -0.006461929 -0.012923859 0.000000000
sum over m -0.023935283 -0.023935283 -0.047870567 0.000000000
sum over m+mul 2.329827533 2.329827533 4.659655066 0.000000000
d3z^2-r^2 0 -0.006390598 -0.006390598 -0.012781196 0.000000000
dx^2-y^2 0 -0.005058057 -0.005058057 -0.010116115 0.000000000
dxy 0 -0.005434854 -0.005434854 -0.010869707 0.000000000
dxz 0 -0.006926194 -0.006926194 -0.013852388 0.000000000
dyz 0 -0.006932221 -0.006932221 -0.013864442 0.000000000
sum over m -0.030741924 -0.030741924 -0.061483848 0.000000000
sum over m+mul -0.030741924 -0.030741924 -0.061483848 0.000000000
313 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000794346 1.000794346 2.001588691 0.000000000
sum over m 1.000794346 1.000794346 2.001588691 0.000000000
s 1 0.207399176 0.207399176 0.414798352 0.000000000
sum over m 0.207399176 0.207399176 0.414798352 0.000000000
s 2 0.014720923 0.014720923 0.029441846 0.000000000
sum over m 0.014720923 0.014720923 0.029441846 0.000000000
sum over m+mul 1.222914444 1.222914444 2.445828889 0.000000000
px 0 1.006381344 1.006381344 2.012762688 0.000000000
py 0 1.006370005 1.006370005 2.012740010 0.000000000
pz 0 1.006214474 1.006214474 2.012428949 0.000000000
sum over m 3.018965824 3.018965824 6.037931647 0.000000000
px 1 0.065434731 0.065434731 0.130869461 0.000000000
py 1 0.065452017 0.065452017 0.130904035 0.000000000
pz 1 0.040359775 0.040359775 0.080719549 0.000000000
sum over m 0.171246523 0.171246523 0.342493045 0.000000000
sum over m+mul 3.190212346 3.190212346 6.380424693 0.000000000
d3z^2-r^2 0 0.196317000 0.196317000 0.392634000 0.000000000
dx^2-y^2 0 0.201535059 0.201535059 0.403070118 0.000000000
dxy 0 0.250932486 0.250932486 0.501864973 0.000000000
dxz 0 0.268481712 0.268481712 0.536963424 0.000000000
dyz 0 0.268493958 0.268493958 0.536987917 0.000000000
sum over m 1.185760216 1.185760216 2.371520432 0.000000000
d3z^2-r^2 1 0.003471608 0.003471608 0.006943216 0.000000000
dx^2-y^2 1 -0.004483514 -0.004483514 -0.008967027 0.000000000
dxy 1 0.015345845 0.015345845 0.030691691 0.000000000
dxz 1 0.003488639 0.003488639 0.006977279 0.000000000
dyz 1 0.003490453 0.003490453 0.006980907 0.000000000
sum over m 0.021313033 0.021313033 0.042626066 0.000000000
sum over m+mul 1.207073249 1.207073249 2.414146498 0.000000000
314 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000774711 1.000774711 2.001549422 0.000000000
sum over m 1.000774711 1.000774711 2.001549422 0.000000000
s 1 0.207407309 0.207407309 0.414814618 0.000000000
sum over m 0.207407309 0.207407309 0.414814618 0.000000000
s 2 0.014723324 0.014723324 0.029446649 0.000000000
sum over m 0.014723324 0.014723324 0.029446649 0.000000000
sum over m+mul 1.222905344 1.222905344 2.445810689 0.000000000
px 0 1.006382809 1.006382809 2.012765618 0.000000000
py 0 1.006372285 1.006372285 2.012744570 0.000000000
pz 0 1.006198612 1.006198612 2.012397224 0.000000000
sum over m 3.018953706 3.018953706 6.037907412 0.000000000
px 1 0.065431480 0.065431480 0.130862960 0.000000000
py 1 0.065429039 0.065429039 0.130858078 0.000000000
pz 1 0.040374926 0.040374926 0.080749852 0.000000000
sum over m 0.171235445 0.171235445 0.342470890 0.000000000
sum over m+mul 3.190189151 3.190189151 6.380378302 0.000000000
d3z^2-r^2 0 0.196296472 0.196296472 0.392592943 0.000000000
dx^2-y^2 0 0.201520043 0.201520043 0.403040086 0.000000000
dxy 0 0.250928325 0.250928325 0.501856650 0.000000000
dxz 0 0.268492796 0.268492796 0.536985593 0.000000000
dyz 0 0.268513479 0.268513479 0.537026958 0.000000000
sum over m 1.185751115 1.185751115 2.371502230 0.000000000
d3z^2-r^2 1 0.003473219 0.003473219 0.006946439 0.000000000
dx^2-y^2 1 -0.004478692 -0.004478692 -0.008957385 0.000000000
dxy 1 0.015341024 0.015341024 0.030682047 0.000000000
dxz 1 0.003485600 0.003485600 0.006971200 0.000000000
dyz 1 0.003487435 0.003487435 0.006974871 0.000000000
sum over m 0.021308586 0.021308586 0.042617172 0.000000000
sum over m+mul 1.207059701 1.207059701 2.414119402 0.000000000
315 O Up spin Down spin Sum Diff
multiple
s 0 0.893859098 0.893859098 1.787718196 0.000000000
sum over m 0.893859098 0.893859098 1.787718196 0.000000000
s 1 -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m+mul 0.890817569 0.890817569 1.781635137 0.000000000
px 0 0.786939498 0.786939498 1.573878997 0.000000000
py 0 0.786877143 0.786877143 1.573754285 0.000000000
pz 0 0.779871227 0.779871227 1.559742455 0.000000000
sum over m 2.353687868 2.353687868 4.707375737 0.000000000
px 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
py 1 -0.008725152 -0.008725152 -0.017450305 0.000000000
pz 1 -0.006467431 -0.006467431 -0.012934861 0.000000000
sum over m -0.023928314 -0.023928314 -0.047856627 0.000000000
sum over m+mul 2.329759555 2.329759555 4.659519109 0.000000000
d3z^2-r^2 0 -0.006389921 -0.006389921 -0.012779843 0.000000000
dx^2-y^2 0 -0.005060831 -0.005060831 -0.010121663 0.000000000
dxy 0 -0.005433558 -0.005433558 -0.010867116 0.000000000
dxz 0 -0.006932408 -0.006932408 -0.013864816 0.000000000
dyz 0 -0.006934055 -0.006934055 -0.013868111 0.000000000
sum over m -0.030750774 -0.030750774 -0.061501548 0.000000000
sum over m+mul -0.030750774 -0.030750774 -0.061501548 0.000000000
316 O Up spin Down spin Sum Diff
multiple
s 0 0.893906943 0.893906943 1.787813886 0.000000000
sum over m 0.893906943 0.893906943 1.787813886 0.000000000
s 1 -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m+mul 0.890864367 0.890864367 1.781728733 0.000000000
px 0 0.787068705 0.787068705 1.574137411 0.000000000
py 0 0.787020216 0.787020216 1.574040432 0.000000000
pz 0 0.779696226 0.779696226 1.559392452 0.000000000
sum over m 2.353785147 2.353785147 4.707570295 0.000000000
px 1 -0.008736847 -0.008736847 -0.017473695 0.000000000
py 1 -0.008731428 -0.008731428 -0.017462857 0.000000000
pz 1 -0.006454271 -0.006454271 -0.012908542 0.000000000
sum over m -0.023922547 -0.023922547 -0.047845094 0.000000000
sum over m+mul 2.329862601 2.329862601 4.659725201 0.000000000
d3z^2-r^2 0 -0.006390048 -0.006390048 -0.012780096 0.000000000
dx^2-y^2 0 -0.005053782 -0.005053782 -0.010107564 0.000000000
dxy 0 -0.005435831 -0.005435831 -0.010871662 0.000000000
dxz 0 -0.006923376 -0.006923376 -0.013846752 0.000000000
dyz 0 -0.006926865 -0.006926865 -0.013853730 0.000000000
sum over m -0.030729902 -0.030729902 -0.061459804 0.000000000
sum over m+mul -0.030729902 -0.030729902 -0.061459804 0.000000000
317 O Up spin Down spin Sum Diff
multiple
s 0 0.893902753 0.893902753 1.787805505 0.000000000
sum over m 0.893902753 0.893902753 1.787805505 0.000000000
s 1 -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m+mul 0.890860725 0.890860725 1.781721450 0.000000000
px 0 0.786819648 0.786819648 1.573639296 0.000000000
py 0 0.787139398 0.787139398 1.574278796 0.000000000
pz 0 0.779778741 0.779778741 1.559557482 0.000000000
sum over m 2.353737787 2.353737787 4.707475574 0.000000000
px 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
py 1 -0.008745736 -0.008745736 -0.017491472 0.000000000
pz 1 -0.006462867 -0.006462867 -0.012925733 0.000000000
sum over m -0.023944334 -0.023944334 -0.047888667 0.000000000
sum over m+mul 2.329793453 2.329793453 4.659586907 0.000000000
d3z^2-r^2 0 -0.006391160 -0.006391160 -0.012782321 0.000000000
dx^2-y^2 0 -0.005058206 -0.005058206 -0.010116413 0.000000000
dxy 0 -0.005434582 -0.005434582 -0.010869165 0.000000000
dxz 0 -0.006932318 -0.006932318 -0.013864636 0.000000000
dyz 0 -0.006927117 -0.006927117 -0.013854234 0.000000000
sum over m -0.030743384 -0.030743384 -0.061486768 0.000000000
sum over m+mul -0.030743384 -0.030743384 -0.061486768 0.000000000
318 O Up spin Down spin Sum Diff
multiple
s 0 0.893893710 0.893893710 1.787787419 0.000000000
sum over m 0.893893710 0.893893710 1.787787419 0.000000000
s 1 -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m+mul 0.890851876 0.890851876 1.781703752 0.000000000
px 0 0.787091794 0.787091794 1.574183589 0.000000000
py 0 0.786895587 0.786895587 1.573791175 0.000000000
pz 0 0.779775435 0.779775435 1.559550869 0.000000000
sum over m 2.353762816 2.353762816 4.707525633 0.000000000
px 1 -0.008743439 -0.008743439 -0.017486877 0.000000000
py 1 -0.008729916 -0.008729916 -0.017459831 0.000000000
pz 1 -0.006461929 -0.006461929 -0.012923859 0.000000000
sum over m -0.023935283 -0.023935283 -0.047870567 0.000000000
sum over m+mul 2.329827533 2.329827533 4.659655066 0.000000000
d3z^2-r^2 0 -0.006390598 -0.006390598 -0.012781196 0.000000000
dx^2-y^2 0 -0.005058057 -0.005058057 -0.010116115 0.000000000
dxy 0 -0.005434854 -0.005434854 -0.010869707 0.000000000
dxz 0 -0.006926194 -0.006926194 -0.013852388 0.000000000
dyz 0 -0.006932221 -0.006932221 -0.013864442 0.000000000
sum over m -0.030741924 -0.030741924 -0.061483848 0.000000000
sum over m+mul -0.030741924 -0.030741924 -0.061483848 0.000000000
319 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000794346 1.000794346 2.001588692 0.000000000
sum over m 1.000794346 1.000794346 2.001588692 0.000000000
s 1 0.207399176 0.207399176 0.414798352 0.000000000
sum over m 0.207399176 0.207399176 0.414798352 0.000000000
s 2 0.014720923 0.014720923 0.029441845 0.000000000
sum over m 0.014720923 0.014720923 0.029441845 0.000000000
sum over m+mul 1.222914445 1.222914445 2.445828889 0.000000000
px 0 1.006381344 1.006381344 2.012762688 0.000000000
py 0 1.006370005 1.006370005 2.012740010 0.000000000
pz 0 1.006214474 1.006214474 2.012428949 0.000000000
sum over m 3.018965824 3.018965824 6.037931648 0.000000000
px 1 0.065434730 0.065434730 0.130869461 0.000000000
py 1 0.065452018 0.065452018 0.130904035 0.000000000
pz 1 0.040359775 0.040359775 0.080719549 0.000000000
sum over m 0.171246523 0.171246523 0.342493045 0.000000000
sum over m+mul 3.190212347 3.190212347 6.380424693 0.000000000
d3z^2-r^2 0 0.196317000 0.196317000 0.392634000 0.000000000
dx^2-y^2 0 0.201535059 0.201535059 0.403070119 0.000000000
dxy 0 0.250932486 0.250932486 0.501864972 0.000000000
dxz 0 0.268481712 0.268481712 0.536963424 0.000000000
dyz 0 0.268493958 0.268493958 0.536987917 0.000000000
sum over m 1.185760216 1.185760216 2.371520432 0.000000000
d3z^2-r^2 1 0.003471608 0.003471608 0.006943216 0.000000000
dx^2-y^2 1 -0.004483514 -0.004483514 -0.008967027 0.000000000
dxy 1 0.015345845 0.015345845 0.030691691 0.000000000
dxz 1 0.003488639 0.003488639 0.006977279 0.000000000
dyz 1 0.003490453 0.003490453 0.006980907 0.000000000
sum over m 0.021313033 0.021313033 0.042626065 0.000000000
sum over m+mul 1.207073249 1.207073249 2.414146498 0.000000000
320 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000774711 1.000774711 2.001549422 0.000000000
sum over m 1.000774711 1.000774711 2.001549422 0.000000000
s 1 0.207407309 0.207407309 0.414814618 0.000000000
sum over m 0.207407309 0.207407309 0.414814618 0.000000000
s 2 0.014723324 0.014723324 0.029446649 0.000000000
sum over m 0.014723324 0.014723324 0.029446649 0.000000000
sum over m+mul 1.222905344 1.222905344 2.445810689 0.000000000
px 0 1.006382809 1.006382809 2.012765618 0.000000000
py 0 1.006372285 1.006372285 2.012744570 0.000000000
pz 0 1.006198612 1.006198612 2.012397224 0.000000000
sum over m 3.018953706 3.018953706 6.037907412 0.000000000
px 1 0.065431480 0.065431480 0.130862960 0.000000000
py 1 0.065429039 0.065429039 0.130858078 0.000000000
pz 1 0.040374926 0.040374926 0.080749852 0.000000000
sum over m 0.171235445 0.171235445 0.342470890 0.000000000
sum over m+mul 3.190189151 3.190189151 6.380378302 0.000000000
d3z^2-r^2 0 0.196296472 0.196296472 0.392592943 0.000000000
dx^2-y^2 0 0.201520043 0.201520043 0.403040086 0.000000000
dxy 0 0.250928325 0.250928325 0.501856650 0.000000000
dxz 0 0.268492796 0.268492796 0.536985593 0.000000000
dyz 0 0.268513479 0.268513479 0.537026958 0.000000000
sum over m 1.185751115 1.185751115 2.371502229 0.000000000
d3z^2-r^2 1 0.003473219 0.003473219 0.006946439 0.000000000
dx^2-y^2 1 -0.004478692 -0.004478692 -0.008957385 0.000000000
dxy 1 0.015341024 0.015341024 0.030682047 0.000000000
dxz 1 0.003485600 0.003485600 0.006971200 0.000000000
dyz 1 0.003487435 0.003487435 0.006974871 0.000000000
sum over m 0.021308586 0.021308586 0.042617172 0.000000000
sum over m+mul 1.207059701 1.207059701 2.414119401 0.000000000
321 O Up spin Down spin Sum Diff
multiple
s 0 0.893859098 0.893859098 1.787718196 0.000000000
sum over m 0.893859098 0.893859098 1.787718196 0.000000000
s 1 -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m+mul 0.890817568 0.890817568 1.781635137 0.000000000
px 0 0.786939498 0.786939498 1.573878997 0.000000000
py 0 0.786877142 0.786877142 1.573754284 0.000000000
pz 0 0.779871227 0.779871227 1.559742454 0.000000000
sum over m 2.353687868 2.353687868 4.707375736 0.000000000
px 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
py 1 -0.008725152 -0.008725152 -0.017450305 0.000000000
pz 1 -0.006467431 -0.006467431 -0.012934861 0.000000000
sum over m -0.023928314 -0.023928314 -0.047856627 0.000000000
sum over m+mul 2.329759554 2.329759554 4.659519108 0.000000000
d3z^2-r^2 0 -0.006389921 -0.006389921 -0.012779843 0.000000000
dx^2-y^2 0 -0.005060831 -0.005060831 -0.010121663 0.000000000
dxy 0 -0.005433558 -0.005433558 -0.010867116 0.000000000
dxz 0 -0.006932408 -0.006932408 -0.013864816 0.000000000
dyz 0 -0.006934055 -0.006934055 -0.013868111 0.000000000
sum over m -0.030750774 -0.030750774 -0.061501548 0.000000000
sum over m+mul -0.030750774 -0.030750774 -0.061501548 0.000000000
322 O Up spin Down spin Sum Diff
multiple
s 0 0.893906943 0.893906943 1.787813886 0.000000000
sum over m 0.893906943 0.893906943 1.787813886 0.000000000
s 1 -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m+mul 0.890864367 0.890864367 1.781728733 0.000000000
px 0 0.787068705 0.787068705 1.574137411 0.000000000
py 0 0.787020216 0.787020216 1.574040431 0.000000000
pz 0 0.779696226 0.779696226 1.559392452 0.000000000
sum over m 2.353785147 2.353785147 4.707570294 0.000000000
px 1 -0.008736847 -0.008736847 -0.017473695 0.000000000
py 1 -0.008731428 -0.008731428 -0.017462857 0.000000000
pz 1 -0.006454271 -0.006454271 -0.012908542 0.000000000
sum over m -0.023922547 -0.023922547 -0.047845094 0.000000000
sum over m+mul 2.329862600 2.329862600 4.659725200 0.000000000
d3z^2-r^2 0 -0.006390048 -0.006390048 -0.012780096 0.000000000
dx^2-y^2 0 -0.005053782 -0.005053782 -0.010107564 0.000000000
dxy 0 -0.005435831 -0.005435831 -0.010871662 0.000000000
dxz 0 -0.006923376 -0.006923376 -0.013846752 0.000000000
dyz 0 -0.006926865 -0.006926865 -0.013853730 0.000000000
sum over m -0.030729902 -0.030729902 -0.061459804 0.000000000
sum over m+mul -0.030729902 -0.030729902 -0.061459804 0.000000000
323 O Up spin Down spin Sum Diff
multiple
s 0 0.893902753 0.893902753 1.787805505 0.000000000
sum over m 0.893902753 0.893902753 1.787805505 0.000000000
s 1 -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m+mul 0.890860725 0.890860725 1.781721450 0.000000000
px 0 0.786819648 0.786819648 1.573639297 0.000000000
py 0 0.787139398 0.787139398 1.574278797 0.000000000
pz 0 0.779778741 0.779778741 1.559557482 0.000000000
sum over m 2.353737788 2.353737788 4.707475575 0.000000000
px 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
py 1 -0.008745736 -0.008745736 -0.017491473 0.000000000
pz 1 -0.006462867 -0.006462867 -0.012925733 0.000000000
sum over m -0.023944334 -0.023944334 -0.047888667 0.000000000
sum over m+mul 2.329793454 2.329793454 4.659586908 0.000000000
d3z^2-r^2 0 -0.006391160 -0.006391160 -0.012782321 0.000000000
dx^2-y^2 0 -0.005058206 -0.005058206 -0.010116413 0.000000000
dxy 0 -0.005434582 -0.005434582 -0.010869165 0.000000000
dxz 0 -0.006932318 -0.006932318 -0.013864636 0.000000000
dyz 0 -0.006927117 -0.006927117 -0.013854234 0.000000000
sum over m -0.030743384 -0.030743384 -0.061486768 0.000000000
sum over m+mul -0.030743384 -0.030743384 -0.061486768 0.000000000
324 O Up spin Down spin Sum Diff
multiple
s 0 0.893893710 0.893893710 1.787787419 0.000000000
sum over m 0.893893710 0.893893710 1.787787419 0.000000000
s 1 -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m+mul 0.890851876 0.890851876 1.781703752 0.000000000
px 0 0.787091794 0.787091794 1.574183589 0.000000000
py 0 0.786895588 0.786895588 1.573791175 0.000000000
pz 0 0.779775435 0.779775435 1.559550869 0.000000000
sum over m 2.353762817 2.353762817 4.707525634 0.000000000
px 1 -0.008743439 -0.008743439 -0.017486877 0.000000000
py 1 -0.008729916 -0.008729916 -0.017459831 0.000000000
pz 1 -0.006461929 -0.006461929 -0.012923859 0.000000000
sum over m -0.023935283 -0.023935283 -0.047870567 0.000000000
sum over m+mul 2.329827533 2.329827533 4.659655067 0.000000000
d3z^2-r^2 0 -0.006390598 -0.006390598 -0.012781196 0.000000000
dx^2-y^2 0 -0.005058057 -0.005058057 -0.010116115 0.000000000
dxy 0 -0.005434854 -0.005434854 -0.010869707 0.000000000
dxz 0 -0.006926194 -0.006926194 -0.013852388 0.000000000
dyz 0 -0.006932221 -0.006932221 -0.013864442 0.000000000
sum over m -0.030741924 -0.030741924 -0.061483848 0.000000000
sum over m+mul -0.030741924 -0.030741924 -0.061483848 0.000000000
325 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000794346 1.000794346 2.001588691 0.000000000
sum over m 1.000794346 1.000794346 2.001588691 0.000000000
s 1 0.207399176 0.207399176 0.414798352 0.000000000
sum over m 0.207399176 0.207399176 0.414798352 0.000000000
s 2 0.014720923 0.014720923 0.029441845 0.000000000
sum over m 0.014720923 0.014720923 0.029441845 0.000000000
sum over m+mul 1.222914444 1.222914444 2.445828888 0.000000000
px 0 1.006381344 1.006381344 2.012762689 0.000000000
py 0 1.006370005 1.006370005 2.012740010 0.000000000
pz 0 1.006214475 1.006214475 2.012428949 0.000000000
sum over m 3.018965824 3.018965824 6.037931648 0.000000000
px 1 0.065434730 0.065434730 0.130869460 0.000000000
py 1 0.065452018 0.065452018 0.130904036 0.000000000
pz 1 0.040359774 0.040359774 0.080719549 0.000000000
sum over m 0.171246522 0.171246522 0.342493045 0.000000000
sum over m+mul 3.190212346 3.190212346 6.380424693 0.000000000
d3z^2-r^2 0 0.196317000 0.196317000 0.392634000 0.000000000
dx^2-y^2 0 0.201535060 0.201535060 0.403070119 0.000000000
dxy 0 0.250932486 0.250932486 0.501864973 0.000000000
dxz 0 0.268481712 0.268481712 0.536963424 0.000000000
dyz 0 0.268493958 0.268493958 0.536987917 0.000000000
sum over m 1.185760216 1.185760216 2.371520433 0.000000000
d3z^2-r^2 1 0.003471608 0.003471608 0.006943216 0.000000000
dx^2-y^2 1 -0.004483514 -0.004483514 -0.008967027 0.000000000
dxy 1 0.015345845 0.015345845 0.030691691 0.000000000
dxz 1 0.003488639 0.003488639 0.006977279 0.000000000
dyz 1 0.003490453 0.003490453 0.006980907 0.000000000
sum over m 0.021313033 0.021313033 0.042626066 0.000000000
sum over m+mul 1.207073249 1.207073249 2.414146498 0.000000000
326 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000774711 1.000774711 2.001549422 0.000000000
sum over m 1.000774711 1.000774711 2.001549422 0.000000000
s 1 0.207407309 0.207407309 0.414814618 0.000000000
sum over m 0.207407309 0.207407309 0.414814618 0.000000000
s 2 0.014723324 0.014723324 0.029446649 0.000000000
sum over m 0.014723324 0.014723324 0.029446649 0.000000000
sum over m+mul 1.222905345 1.222905345 2.445810689 0.000000000
px 0 1.006382809 1.006382809 2.012765618 0.000000000
py 0 1.006372285 1.006372285 2.012744570 0.000000000
pz 0 1.006198612 1.006198612 2.012397224 0.000000000
sum over m 3.018953706 3.018953706 6.037907412 0.000000000
px 1 0.065431480 0.065431480 0.130862960 0.000000000
py 1 0.065429039 0.065429039 0.130858078 0.000000000
pz 1 0.040374926 0.040374926 0.080749852 0.000000000
sum over m 0.171235445 0.171235445 0.342470890 0.000000000
sum over m+mul 3.190189151 3.190189151 6.380378302 0.000000000
d3z^2-r^2 0 0.196296472 0.196296472 0.392592943 0.000000000
dx^2-y^2 0 0.201520043 0.201520043 0.403040086 0.000000000
dxy 0 0.250928325 0.250928325 0.501856650 0.000000000
dxz 0 0.268492797 0.268492797 0.536985593 0.000000000
dyz 0 0.268513479 0.268513479 0.537026958 0.000000000
sum over m 1.185751115 1.185751115 2.371502230 0.000000000
d3z^2-r^2 1 0.003473219 0.003473219 0.006946439 0.000000000
dx^2-y^2 1 -0.004478692 -0.004478692 -0.008957385 0.000000000
dxy 1 0.015341024 0.015341024 0.030682047 0.000000000
dxz 1 0.003485600 0.003485600 0.006971200 0.000000000
dyz 1 0.003487435 0.003487435 0.006974871 0.000000000
sum over m 0.021308586 0.021308586 0.042617172 0.000000000
sum over m+mul 1.207059701 1.207059701 2.414119402 0.000000000
327 O Up spin Down spin Sum Diff
multiple
s 0 0.893859098 0.893859098 1.787718196 0.000000000
sum over m 0.893859098 0.893859098 1.787718196 0.000000000
s 1 -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m+mul 0.890817568 0.890817568 1.781635137 0.000000000
px 0 0.786939498 0.786939498 1.573878997 0.000000000
py 0 0.786877142 0.786877142 1.573754285 0.000000000
pz 0 0.779871227 0.779871227 1.559742455 0.000000000
sum over m 2.353687868 2.353687868 4.707375736 0.000000000
px 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
py 1 -0.008725152 -0.008725152 -0.017450305 0.000000000
pz 1 -0.006467431 -0.006467431 -0.012934861 0.000000000
sum over m -0.023928314 -0.023928314 -0.047856628 0.000000000
sum over m+mul 2.329759554 2.329759554 4.659519109 0.000000000
d3z^2-r^2 0 -0.006389921 -0.006389921 -0.012779843 0.000000000
dx^2-y^2 0 -0.005060831 -0.005060831 -0.010121663 0.000000000
dxy 0 -0.005433558 -0.005433558 -0.010867116 0.000000000
dxz 0 -0.006932408 -0.006932408 -0.013864816 0.000000000
dyz 0 -0.006934055 -0.006934055 -0.013868111 0.000000000
sum over m -0.030750774 -0.030750774 -0.061501548 0.000000000
sum over m+mul -0.030750774 -0.030750774 -0.061501548 0.000000000
328 O Up spin Down spin Sum Diff
multiple
s 0 0.893906943 0.893906943 1.787813886 0.000000000
sum over m 0.893906943 0.893906943 1.787813886 0.000000000
s 1 -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m+mul 0.890864367 0.890864367 1.781728733 0.000000000
px 0 0.787068705 0.787068705 1.574137411 0.000000000
py 0 0.787020216 0.787020216 1.574040431 0.000000000
pz 0 0.779696226 0.779696226 1.559392452 0.000000000
sum over m 2.353785147 2.353785147 4.707570294 0.000000000
px 1 -0.008736847 -0.008736847 -0.017473695 0.000000000
py 1 -0.008731428 -0.008731428 -0.017462857 0.000000000
pz 1 -0.006454271 -0.006454271 -0.012908542 0.000000000
sum over m -0.023922547 -0.023922547 -0.047845094 0.000000000
sum over m+mul 2.329862600 2.329862600 4.659725200 0.000000000
d3z^2-r^2 0 -0.006390048 -0.006390048 -0.012780096 0.000000000
dx^2-y^2 0 -0.005053782 -0.005053782 -0.010107564 0.000000000
dxy 0 -0.005435831 -0.005435831 -0.010871662 0.000000000
dxz 0 -0.006923376 -0.006923376 -0.013846752 0.000000000
dyz 0 -0.006926865 -0.006926865 -0.013853730 0.000000000
sum over m -0.030729902 -0.030729902 -0.061459804 0.000000000
sum over m+mul -0.030729902 -0.030729902 -0.061459804 0.000000000
329 O Up spin Down spin Sum Diff
multiple
s 0 0.893902753 0.893902753 1.787805505 0.000000000
sum over m 0.893902753 0.893902753 1.787805505 0.000000000
s 1 -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m+mul 0.890860725 0.890860725 1.781721450 0.000000000
px 0 0.786819649 0.786819649 1.573639297 0.000000000
py 0 0.787139398 0.787139398 1.574278796 0.000000000
pz 0 0.779778741 0.779778741 1.559557482 0.000000000
sum over m 2.353737788 2.353737788 4.707475575 0.000000000
px 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
py 1 -0.008745736 -0.008745736 -0.017491473 0.000000000
pz 1 -0.006462867 -0.006462867 -0.012925734 0.000000000
sum over m -0.023944334 -0.023944334 -0.047888668 0.000000000
sum over m+mul 2.329793454 2.329793454 4.659586907 0.000000000
d3z^2-r^2 0 -0.006391160 -0.006391160 -0.012782321 0.000000000
dx^2-y^2 0 -0.005058206 -0.005058206 -0.010116413 0.000000000
dxy 0 -0.005434582 -0.005434582 -0.010869165 0.000000000
dxz 0 -0.006932318 -0.006932318 -0.013864636 0.000000000
dyz 0 -0.006927117 -0.006927117 -0.013854234 0.000000000
sum over m -0.030743384 -0.030743384 -0.061486768 0.000000000
sum over m+mul -0.030743384 -0.030743384 -0.061486768 0.000000000
330 O Up spin Down spin Sum Diff
multiple
s 0 0.893893710 0.893893710 1.787787420 0.000000000
sum over m 0.893893710 0.893893710 1.787787420 0.000000000
s 1 -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m+mul 0.890851876 0.890851876 1.781703752 0.000000000
px 0 0.787091794 0.787091794 1.574183589 0.000000000
py 0 0.786895587 0.786895587 1.573791175 0.000000000
pz 0 0.779775435 0.779775435 1.559550869 0.000000000
sum over m 2.353762816 2.353762816 4.707525633 0.000000000
px 1 -0.008743439 -0.008743439 -0.017486877 0.000000000
py 1 -0.008729916 -0.008729916 -0.017459831 0.000000000
pz 1 -0.006461929 -0.006461929 -0.012923859 0.000000000
sum over m -0.023935283 -0.023935283 -0.047870567 0.000000000
sum over m+mul 2.329827533 2.329827533 4.659655066 0.000000000
d3z^2-r^2 0 -0.006390598 -0.006390598 -0.012781196 0.000000000
dx^2-y^2 0 -0.005058057 -0.005058057 -0.010116115 0.000000000
dxy 0 -0.005434854 -0.005434854 -0.010869707 0.000000000
dxz 0 -0.006926194 -0.006926194 -0.013852388 0.000000000
dyz 0 -0.006932221 -0.006932221 -0.013864442 0.000000000
sum over m -0.030741924 -0.030741924 -0.061483848 0.000000000
sum over m+mul -0.030741924 -0.030741924 -0.061483848 0.000000000
331 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000794346 1.000794346 2.001588692 0.000000000
sum over m 1.000794346 1.000794346 2.001588692 0.000000000
s 1 0.207399176 0.207399176 0.414798352 0.000000000
sum over m 0.207399176 0.207399176 0.414798352 0.000000000
s 2 0.014720923 0.014720923 0.029441845 0.000000000
sum over m 0.014720923 0.014720923 0.029441845 0.000000000
sum over m+mul 1.222914444 1.222914444 2.445828889 0.000000000
px 0 1.006381344 1.006381344 2.012762688 0.000000000
py 0 1.006370005 1.006370005 2.012740010 0.000000000
pz 0 1.006214474 1.006214474 2.012428949 0.000000000
sum over m 3.018965824 3.018965824 6.037931648 0.000000000
px 1 0.065434730 0.065434730 0.130869461 0.000000000
py 1 0.065452018 0.065452018 0.130904035 0.000000000
pz 1 0.040359775 0.040359775 0.080719549 0.000000000
sum over m 0.171246523 0.171246523 0.342493045 0.000000000
sum over m+mul 3.190212347 3.190212347 6.380424693 0.000000000
d3z^2-r^2 0 0.196317000 0.196317000 0.392634000 0.000000000
dx^2-y^2 0 0.201535060 0.201535060 0.403070119 0.000000000
dxy 0 0.250932486 0.250932486 0.501864972 0.000000000
dxz 0 0.268481712 0.268481712 0.536963424 0.000000000
dyz 0 0.268493958 0.268493958 0.536987917 0.000000000
sum over m 1.185760216 1.185760216 2.371520432 0.000000000
d3z^2-r^2 1 0.003471608 0.003471608 0.006943216 0.000000000
dx^2-y^2 1 -0.004483514 -0.004483514 -0.008967027 0.000000000
dxy 1 0.015345845 0.015345845 0.030691691 0.000000000
dxz 1 0.003488639 0.003488639 0.006977279 0.000000000
dyz 1 0.003490453 0.003490453 0.006980907 0.000000000
sum over m 0.021313033 0.021313033 0.042626066 0.000000000
sum over m+mul 1.207073249 1.207073249 2.414146498 0.000000000
332 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000774711 1.000774711 2.001549422 0.000000000
sum over m 1.000774711 1.000774711 2.001549422 0.000000000
s 1 0.207407309 0.207407309 0.414814618 0.000000000
sum over m 0.207407309 0.207407309 0.414814618 0.000000000
s 2 0.014723324 0.014723324 0.029446649 0.000000000
sum over m 0.014723324 0.014723324 0.029446649 0.000000000
sum over m+mul 1.222905345 1.222905345 2.445810689 0.000000000
px 0 1.006382809 1.006382809 2.012765618 0.000000000
py 0 1.006372285 1.006372285 2.012744570 0.000000000
pz 0 1.006198612 1.006198612 2.012397224 0.000000000
sum over m 3.018953706 3.018953706 6.037907412 0.000000000
px 1 0.065431480 0.065431480 0.130862960 0.000000000
py 1 0.065429039 0.065429039 0.130858078 0.000000000
pz 1 0.040374926 0.040374926 0.080749852 0.000000000
sum over m 0.171235445 0.171235445 0.342470891 0.000000000
sum over m+mul 3.190189151 3.190189151 6.380378302 0.000000000
d3z^2-r^2 0 0.196296472 0.196296472 0.392592943 0.000000000
dx^2-y^2 0 0.201520043 0.201520043 0.403040087 0.000000000
dxy 0 0.250928325 0.250928325 0.501856650 0.000000000
dxz 0 0.268492796 0.268492796 0.536985593 0.000000000
dyz 0 0.268513479 0.268513479 0.537026958 0.000000000
sum over m 1.185751115 1.185751115 2.371502231 0.000000000
d3z^2-r^2 1 0.003473219 0.003473219 0.006946439 0.000000000
dx^2-y^2 1 -0.004478692 -0.004478692 -0.008957385 0.000000000
dxy 1 0.015341024 0.015341024 0.030682047 0.000000000
dxz 1 0.003485600 0.003485600 0.006971200 0.000000000
dyz 1 0.003487435 0.003487435 0.006974871 0.000000000
sum over m 0.021308586 0.021308586 0.042617172 0.000000000
sum over m+mul 1.207059701 1.207059701 2.414119403 0.000000000
333 O Up spin Down spin Sum Diff
multiple
s 0 0.893859098 0.893859098 1.787718196 0.000000000
sum over m 0.893859098 0.893859098 1.787718196 0.000000000
s 1 -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m+mul 0.890817568 0.890817568 1.781635137 0.000000000
px 0 0.786939499 0.786939499 1.573878997 0.000000000
py 0 0.786877142 0.786877142 1.573754285 0.000000000
pz 0 0.779871227 0.779871227 1.559742455 0.000000000
sum over m 2.353687868 2.353687868 4.707375737 0.000000000
px 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
py 1 -0.008725152 -0.008725152 -0.017450305 0.000000000
pz 1 -0.006467431 -0.006467431 -0.012934861 0.000000000
sum over m -0.023928314 -0.023928314 -0.047856627 0.000000000
sum over m+mul 2.329759555 2.329759555 4.659519109 0.000000000
d3z^2-r^2 0 -0.006389921 -0.006389921 -0.012779843 0.000000000
dx^2-y^2 0 -0.005060831 -0.005060831 -0.010121663 0.000000000
dxy 0 -0.005433558 -0.005433558 -0.010867116 0.000000000
dxz 0 -0.006932408 -0.006932408 -0.013864816 0.000000000
dyz 0 -0.006934055 -0.006934055 -0.013868111 0.000000000
sum over m -0.030750774 -0.030750774 -0.061501548 0.000000000
sum over m+mul -0.030750774 -0.030750774 -0.061501548 0.000000000
334 O Up spin Down spin Sum Diff
multiple
s 0 0.893906943 0.893906943 1.787813886 0.000000000
sum over m 0.893906943 0.893906943 1.787813886 0.000000000
s 1 -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m+mul 0.890864367 0.890864367 1.781728733 0.000000000
px 0 0.787068705 0.787068705 1.574137410 0.000000000
py 0 0.787020215 0.787020215 1.574040431 0.000000000
pz 0 0.779696226 0.779696226 1.559392453 0.000000000
sum over m 2.353785147 2.353785147 4.707570293 0.000000000
px 1 -0.008736847 -0.008736847 -0.017473695 0.000000000
py 1 -0.008731428 -0.008731428 -0.017462857 0.000000000
pz 1 -0.006454271 -0.006454271 -0.012908542 0.000000000
sum over m -0.023922547 -0.023922547 -0.047845094 0.000000000
sum over m+mul 2.329862600 2.329862600 4.659725200 0.000000000
d3z^2-r^2 0 -0.006390048 -0.006390048 -0.012780096 0.000000000
dx^2-y^2 0 -0.005053782 -0.005053782 -0.010107564 0.000000000
dxy 0 -0.005435831 -0.005435831 -0.010871662 0.000000000
dxz 0 -0.006923376 -0.006923376 -0.013846752 0.000000000
dyz 0 -0.006926865 -0.006926865 -0.013853730 0.000000000
sum over m -0.030729902 -0.030729902 -0.061459804 0.000000000
sum over m+mul -0.030729902 -0.030729902 -0.061459804 0.000000000
335 O Up spin Down spin Sum Diff
multiple
s 0 0.893902753 0.893902753 1.787805505 0.000000000
sum over m 0.893902753 0.893902753 1.787805505 0.000000000
s 1 -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m+mul 0.890860725 0.890860725 1.781721450 0.000000000
px 0 0.786819648 0.786819648 1.573639296 0.000000000
py 0 0.787139398 0.787139398 1.574278796 0.000000000
pz 0 0.779778741 0.779778741 1.559557482 0.000000000
sum over m 2.353737787 2.353737787 4.707475574 0.000000000
px 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
py 1 -0.008745736 -0.008745736 -0.017491473 0.000000000
pz 1 -0.006462867 -0.006462867 -0.012925733 0.000000000
sum over m -0.023944334 -0.023944334 -0.047888667 0.000000000
sum over m+mul 2.329793453 2.329793453 4.659586907 0.000000000
d3z^2-r^2 0 -0.006391160 -0.006391160 -0.012782321 0.000000000
dx^2-y^2 0 -0.005058206 -0.005058206 -0.010116413 0.000000000
dxy 0 -0.005434582 -0.005434582 -0.010869165 0.000000000
dxz 0 -0.006932318 -0.006932318 -0.013864636 0.000000000
dyz 0 -0.006927117 -0.006927117 -0.013854234 0.000000000
sum over m -0.030743384 -0.030743384 -0.061486768 0.000000000
sum over m+mul -0.030743384 -0.030743384 -0.061486768 0.000000000
336 O Up spin Down spin Sum Diff
multiple
s 0 0.893893710 0.893893710 1.787787419 0.000000000
sum over m 0.893893710 0.893893710 1.787787419 0.000000000
s 1 -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m+mul 0.890851876 0.890851876 1.781703752 0.000000000
px 0 0.787091794 0.787091794 1.574183588 0.000000000
py 0 0.786895587 0.786895587 1.573791175 0.000000000
pz 0 0.779775435 0.779775435 1.559550869 0.000000000
sum over m 2.353762816 2.353762816 4.707525632 0.000000000
px 1 -0.008743439 -0.008743439 -0.017486877 0.000000000
py 1 -0.008729916 -0.008729916 -0.017459831 0.000000000
pz 1 -0.006461929 -0.006461929 -0.012923859 0.000000000
sum over m -0.023935283 -0.023935283 -0.047870567 0.000000000
sum over m+mul 2.329827533 2.329827533 4.659655065 0.000000000
d3z^2-r^2 0 -0.006390598 -0.006390598 -0.012781196 0.000000000
dx^2-y^2 0 -0.005058057 -0.005058057 -0.010116115 0.000000000
dxy 0 -0.005434854 -0.005434854 -0.010869707 0.000000000
dxz 0 -0.006926194 -0.006926194 -0.013852388 0.000000000
dyz 0 -0.006932221 -0.006932221 -0.013864442 0.000000000
sum over m -0.030741924 -0.030741924 -0.061483848 0.000000000
sum over m+mul -0.030741924 -0.030741924 -0.061483848 0.000000000
337 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779577 1.000779577 2.001559154 0.000000000
sum over m 1.000779577 1.000779577 2.001559154 0.000000000
s 1 0.207425039 0.207425039 0.414850079 0.000000000
sum over m 0.207425039 0.207425039 0.414850079 0.000000000
s 2 0.014724726 0.014724726 0.029449451 0.000000000
sum over m 0.014724726 0.014724726 0.029449451 0.000000000
sum over m+mul 1.222929342 1.222929342 2.445858684 0.000000000
px 0 1.006375717 1.006375717 2.012751433 0.000000000
py 0 1.006359477 1.006359477 2.012718954 0.000000000
pz 0 1.006191803 1.006191803 2.012383606 0.000000000
sum over m 3.018926997 3.018926997 6.037853994 0.000000000
px 1 0.065430210 0.065430210 0.130860420 0.000000000
py 1 0.065452492 0.065452492 0.130904985 0.000000000
pz 1 0.040372940 0.040372940 0.080745879 0.000000000
sum over m 0.171255642 0.171255642 0.342511284 0.000000000
sum over m+mul 3.190182639 3.190182639 6.380365278 0.000000000
d3z^2-r^2 0 0.196309784 0.196309784 0.392619568 0.000000000
dx^2-y^2 0 0.201500798 0.201500798 0.403001596 0.000000000
dxy 0 0.250952188 0.250952188 0.501904376 0.000000000
dxz 0 0.268478659 0.268478659 0.536957318 0.000000000
dyz 0 0.268509958 0.268509958 0.537019915 0.000000000
sum over m 1.185751386 1.185751386 2.371502773 0.000000000
d3z^2-r^2 1 0.003473749 0.003473749 0.006947498 0.000000000
dx^2-y^2 1 -0.004477316 -0.004477316 -0.008954633 0.000000000
dxy 1 0.015338915 0.015338915 0.030677830 0.000000000
dxz 1 0.003489870 0.003489870 0.006979740 0.000000000
dyz 1 0.003492566 0.003492566 0.006985132 0.000000000
sum over m 0.021317783 0.021317783 0.042635567 0.000000000
sum over m+mul 1.207069170 1.207069170 2.414138340 0.000000000
338 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000772532 1.000772532 2.001545063 0.000000000
sum over m 1.000772532 1.000772532 2.001545063 0.000000000
s 1 0.207415904 0.207415904 0.414831807 0.000000000
sum over m 0.207415904 0.207415904 0.414831807 0.000000000
s 2 0.014725570 0.014725570 0.029451141 0.000000000
sum over m 0.014725570 0.014725570 0.029451141 0.000000000
sum over m+mul 1.222914006 1.222914006 2.445828012 0.000000000
px 0 1.006375748 1.006375748 2.012751496 0.000000000
py 0 1.006362969 1.006362969 2.012725938 0.000000000
pz 0 1.006206692 1.006206692 2.012413384 0.000000000
sum over m 3.018945409 3.018945409 6.037890818 0.000000000
px 1 0.065437315 0.065437315 0.130874631 0.000000000
py 1 0.065445106 0.065445106 0.130890212 0.000000000
pz 1 0.040372054 0.040372054 0.080744108 0.000000000
sum over m 0.171254476 0.171254476 0.342508951 0.000000000
sum over m+mul 3.190199884 3.190199884 6.380399769 0.000000000
d3z^2-r^2 0 0.196309061 0.196309061 0.392618122 0.000000000
dx^2-y^2 0 0.201508894 0.201508894 0.403017788 0.000000000
dxy 0 0.250944584 0.250944584 0.501889168 0.000000000
dxz 0 0.268487266 0.268487266 0.536974531 0.000000000
dyz 0 0.268511824 0.268511824 0.537023648 0.000000000
sum over m 1.185761629 1.185761629 2.371523257 0.000000000
d3z^2-r^2 1 0.003476755 0.003476755 0.006953511 0.000000000
dx^2-y^2 1 -0.004475955 -0.004475955 -0.008951910 0.000000000
dxy 1 0.015341110 0.015341110 0.030682220 0.000000000
dxz 1 0.003491944 0.003491944 0.006983887 0.000000000
dyz 1 0.003494011 0.003494011 0.006988021 0.000000000
sum over m 0.021327865 0.021327865 0.042655730 0.000000000
sum over m+mul 1.207089493 1.207089493 2.414178987 0.000000000
339 O Up spin Down spin Sum Diff
multiple
s 0 0.893870943 0.893870943 1.787741885 0.000000000
sum over m 0.893870943 0.893870943 1.787741885 0.000000000
s 1 -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m+mul 0.890828329 0.890828329 1.781656659 0.000000000
px 0 0.786897584 0.786897584 1.573795169 0.000000000
py 0 0.786994694 0.786994694 1.573989387 0.000000000
pz 0 0.779811673 0.779811673 1.559623345 0.000000000
sum over m 2.353703951 2.353703951 4.707407901 0.000000000
px 1 -0.008737807 -0.008737807 -0.017475614 0.000000000
py 1 -0.008732950 -0.008732950 -0.017465899 0.000000000
pz 1 -0.006463991 -0.006463991 -0.012927982 0.000000000
sum over m -0.023934748 -0.023934748 -0.047869495 0.000000000
sum over m+mul 2.329769203 2.329769203 4.659538406 0.000000000
d3z^2-r^2 0 -0.006389251 -0.006389251 -0.012778503 0.000000000
dx^2-y^2 0 -0.005059228 -0.005059228 -0.010118457 0.000000000
dxy 0 -0.005432622 -0.005432622 -0.010865243 0.000000000
dxz 0 -0.006931230 -0.006931230 -0.013862459 0.000000000
dyz 0 -0.006930964 -0.006930964 -0.013861928 0.000000000
sum over m -0.030743295 -0.030743295 -0.061486591 0.000000000
sum over m+mul -0.030743295 -0.030743295 -0.061486591 0.000000000
340 O Up spin Down spin Sum Diff
multiple
s 0 0.893906891 0.893906891 1.787813783 0.000000000
sum over m 0.893906891 0.893906891 1.787813783 0.000000000
s 1 -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m+mul 0.890864516 0.890864516 1.781729032 0.000000000
px 0 0.787136278 0.787136278 1.574272556 0.000000000
py 0 0.786887385 0.786887385 1.573774769 0.000000000
pz 0 0.779756985 0.779756985 1.559513970 0.000000000
sum over m 2.353780648 2.353780648 4.707561296 0.000000000
px 1 -0.008746839 -0.008746839 -0.017493677 0.000000000
py 1 -0.008733754 -0.008733754 -0.017467508 0.000000000
pz 1 -0.006460947 -0.006460947 -0.012921894 0.000000000
sum over m -0.023941540 -0.023941540 -0.047883080 0.000000000
sum over m+mul 2.329839108 2.329839108 4.659678216 0.000000000
d3z^2-r^2 0 -0.006390928 -0.006390928 -0.012781856 0.000000000
dx^2-y^2 0 -0.005057555 -0.005057555 -0.010115110 0.000000000
dxy 0 -0.005435139 -0.005435139 -0.010870279 0.000000000
dxz 0 -0.006925167 -0.006925167 -0.013850334 0.000000000
dyz 0 -0.006932324 -0.006932324 -0.013864649 0.000000000
sum over m -0.030741114 -0.030741114 -0.061482228 0.000000000
sum over m+mul -0.030741114 -0.030741114 -0.061482228 0.000000000
341 O Up spin Down spin Sum Diff
multiple
s 0 0.893867015 0.893867015 1.787734031 0.000000000
sum over m 0.893867015 0.893867015 1.787734031 0.000000000
s 1 -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m+mul 0.890824536 0.890824536 1.781649071 0.000000000
px 0 0.786842943 0.786842943 1.573685885 0.000000000
py 0 0.787005555 0.787005555 1.574011111 0.000000000
pz 0 0.779835771 0.779835771 1.559671543 0.000000000
sum over m 2.353684269 2.353684269 4.707368539 0.000000000
px 1 -0.008738661 -0.008738661 -0.017477321 0.000000000
py 1 -0.008736010 -0.008736010 -0.017472019 0.000000000
pz 1 -0.006464666 -0.006464666 -0.012929332 0.000000000
sum over m -0.023939336 -0.023939336 -0.047878672 0.000000000
sum over m+mul 2.329744933 2.329744933 4.659489866 0.000000000
d3z^2-r^2 0 -0.006389283 -0.006389283 -0.012778566 0.000000000
dx^2-y^2 0 -0.005060255 -0.005060255 -0.010120509 0.000000000
dxy 0 -0.005432451 -0.005432451 -0.010864901 0.000000000
dxz 0 -0.006933671 -0.006933671 -0.013867342 0.000000000
dyz 0 -0.006931778 -0.006931778 -0.013863555 0.000000000
sum over m -0.030747437 -0.030747437 -0.061494874 0.000000000
sum over m+mul -0.030747437 -0.030747437 -0.061494874 0.000000000
342 O Up spin Down spin Sum Diff
multiple
s 0 0.893899160 0.893899160 1.787798320 0.000000000
sum over m 0.893899160 0.893899160 1.787798320 0.000000000
s 1 -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m+mul 0.890856653 0.890856653 1.781713306 0.000000000
px 0 0.787022915 0.787022915 1.574045830 0.000000000
py 0 0.787024779 0.787024779 1.574049559 0.000000000
pz 0 0.779715302 0.779715302 1.559430604 0.000000000
sum over m 2.353762997 2.353762997 4.707525993 0.000000000
px 1 -0.008735679 -0.008735679 -0.017471358 0.000000000
py 1 -0.008731049 -0.008731049 -0.017462099 0.000000000
pz 1 -0.006456234 -0.006456234 -0.012912467 0.000000000
sum over m -0.023922962 -0.023922962 -0.047845924 0.000000000
sum over m+mul 2.329840034 2.329840034 4.659680069 0.000000000
d3z^2-r^2 0 -0.006389845 -0.006389845 -0.012779690 0.000000000
dx^2-y^2 0 -0.005054724 -0.005054724 -0.010109447 0.000000000
dxy 0 -0.005435254 -0.005435254 -0.010870509 0.000000000
dxz 0 -0.006924412 -0.006924412 -0.013848825 0.000000000
dyz 0 -0.006927007 -0.006927007 -0.013854014 0.000000000
sum over m -0.030731242 -0.030731242 -0.061462485 0.000000000
sum over m+mul -0.030731242 -0.030731242 -0.061462485 0.000000000
343 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779577 1.000779577 2.001559154 0.000000000
sum over m 1.000779577 1.000779577 2.001559154 0.000000000
s 1 0.207425039 0.207425039 0.414850078 0.000000000
sum over m 0.207425039 0.207425039 0.414850078 0.000000000
s 2 0.014724726 0.014724726 0.029449451 0.000000000
sum over m 0.014724726 0.014724726 0.029449451 0.000000000
sum over m+mul 1.222929342 1.222929342 2.445858684 0.000000000
px 0 1.006375717 1.006375717 2.012751433 0.000000000
py 0 1.006359477 1.006359477 2.012718954 0.000000000
pz 0 1.006191803 1.006191803 2.012383607 0.000000000
sum over m 3.018926997 3.018926997 6.037853994 0.000000000
px 1 0.065430210 0.065430210 0.130860420 0.000000000
py 1 0.065452492 0.065452492 0.130904985 0.000000000
pz 1 0.040372939 0.040372939 0.080745879 0.000000000
sum over m 0.171255642 0.171255642 0.342511283 0.000000000
sum over m+mul 3.190182639 3.190182639 6.380365277 0.000000000
d3z^2-r^2 0 0.196309784 0.196309784 0.392619567 0.000000000
dx^2-y^2 0 0.201500798 0.201500798 0.403001596 0.000000000
dxy 0 0.250952188 0.250952188 0.501904376 0.000000000
dxz 0 0.268478659 0.268478659 0.536957319 0.000000000
dyz 0 0.268509957 0.268509957 0.537019915 0.000000000
sum over m 1.185751386 1.185751386 2.371502773 0.000000000
d3z^2-r^2 1 0.003473749 0.003473749 0.006947498 0.000000000
dx^2-y^2 1 -0.004477316 -0.004477316 -0.008954633 0.000000000
dxy 1 0.015338915 0.015338915 0.030677830 0.000000000
dxz 1 0.003489870 0.003489870 0.006979740 0.000000000
dyz 1 0.003492566 0.003492566 0.006985132 0.000000000
sum over m 0.021317783 0.021317783 0.042635567 0.000000000
sum over m+mul 1.207069170 1.207069170 2.414138340 0.000000000
344 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000772532 1.000772532 2.001545063 0.000000000
sum over m 1.000772532 1.000772532 2.001545063 0.000000000
s 1 0.207415904 0.207415904 0.414831807 0.000000000
sum over m 0.207415904 0.207415904 0.414831807 0.000000000
s 2 0.014725570 0.014725570 0.029451141 0.000000000
sum over m 0.014725570 0.014725570 0.029451141 0.000000000
sum over m+mul 1.222914006 1.222914006 2.445828011 0.000000000
px 0 1.006375748 1.006375748 2.012751496 0.000000000
py 0 1.006362969 1.006362969 2.012725937 0.000000000
pz 0 1.006206692 1.006206692 2.012413384 0.000000000
sum over m 3.018945409 3.018945409 6.037890818 0.000000000
px 1 0.065437315 0.065437315 0.130874631 0.000000000
py 1 0.065445106 0.065445106 0.130890213 0.000000000
pz 1 0.040372054 0.040372054 0.080744108 0.000000000
sum over m 0.171254476 0.171254476 0.342508951 0.000000000
sum over m+mul 3.190199885 3.190199885 6.380399769 0.000000000
d3z^2-r^2 0 0.196309061 0.196309061 0.392618122 0.000000000
dx^2-y^2 0 0.201508894 0.201508894 0.403017789 0.000000000
dxy 0 0.250944584 0.250944584 0.501889169 0.000000000
dxz 0 0.268487265 0.268487265 0.536974531 0.000000000
dyz 0 0.268511824 0.268511824 0.537023648 0.000000000
sum over m 1.185761629 1.185761629 2.371523258 0.000000000
d3z^2-r^2 1 0.003476755 0.003476755 0.006953511 0.000000000
dx^2-y^2 1 -0.004475955 -0.004475955 -0.008951910 0.000000000
dxy 1 0.015341110 0.015341110 0.030682220 0.000000000
dxz 1 0.003491944 0.003491944 0.006983887 0.000000000
dyz 1 0.003494011 0.003494011 0.006988021 0.000000000
sum over m 0.021327865 0.021327865 0.042655729 0.000000000
sum over m+mul 1.207089494 1.207089494 2.414178988 0.000000000
345 O Up spin Down spin Sum Diff
multiple
s 0 0.893870943 0.893870943 1.787741885 0.000000000
sum over m 0.893870943 0.893870943 1.787741885 0.000000000
s 1 -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m+mul 0.890828329 0.890828329 1.781656659 0.000000000
px 0 0.786897585 0.786897585 1.573795169 0.000000000
py 0 0.786994693 0.786994693 1.573989387 0.000000000
pz 0 0.779811673 0.779811673 1.559623345 0.000000000
sum over m 2.353703950 2.353703950 4.707407901 0.000000000
px 1 -0.008737807 -0.008737807 -0.017475614 0.000000000
py 1 -0.008732949 -0.008732949 -0.017465899 0.000000000
pz 1 -0.006463991 -0.006463991 -0.012927982 0.000000000
sum over m -0.023934748 -0.023934748 -0.047869495 0.000000000
sum over m+mul 2.329769203 2.329769203 4.659538406 0.000000000
d3z^2-r^2 0 -0.006389251 -0.006389251 -0.012778503 0.000000000
dx^2-y^2 0 -0.005059228 -0.005059228 -0.010118457 0.000000000
dxy 0 -0.005432622 -0.005432622 -0.010865243 0.000000000
dxz 0 -0.006931230 -0.006931230 -0.013862459 0.000000000
dyz 0 -0.006930964 -0.006930964 -0.013861928 0.000000000
sum over m -0.030743295 -0.030743295 -0.061486591 0.000000000
sum over m+mul -0.030743295 -0.030743295 -0.061486591 0.000000000
346 O Up spin Down spin Sum Diff
multiple
s 0 0.893906891 0.893906891 1.787813783 0.000000000
sum over m 0.893906891 0.893906891 1.787813783 0.000000000
s 1 -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m+mul 0.890864516 0.890864516 1.781729032 0.000000000
px 0 0.787136278 0.787136278 1.574272556 0.000000000
py 0 0.786887384 0.786887384 1.573774769 0.000000000
pz 0 0.779756985 0.779756985 1.559513971 0.000000000
sum over m 2.353780648 2.353780648 4.707561296 0.000000000
px 1 -0.008746839 -0.008746839 -0.017493677 0.000000000
py 1 -0.008733754 -0.008733754 -0.017467508 0.000000000
pz 1 -0.006460947 -0.006460947 -0.012921894 0.000000000
sum over m -0.023941540 -0.023941540 -0.047883080 0.000000000
sum over m+mul 2.329839108 2.329839108 4.659678216 0.000000000
d3z^2-r^2 0 -0.006390928 -0.006390928 -0.012781856 0.000000000
dx^2-y^2 0 -0.005057555 -0.005057555 -0.010115110 0.000000000
dxy 0 -0.005435139 -0.005435139 -0.010870279 0.000000000
dxz 0 -0.006925167 -0.006925167 -0.013850334 0.000000000
dyz 0 -0.006932324 -0.006932324 -0.013864649 0.000000000
sum over m -0.030741114 -0.030741114 -0.061482228 0.000000000
sum over m+mul -0.030741114 -0.030741114 -0.061482228 0.000000000
347 O Up spin Down spin Sum Diff
multiple
s 0 0.893867015 0.893867015 1.787734031 0.000000000
sum over m 0.893867015 0.893867015 1.787734031 0.000000000
s 1 -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m+mul 0.890824536 0.890824536 1.781649071 0.000000000
px 0 0.786842942 0.786842942 1.573685885 0.000000000
py 0 0.787005555 0.787005555 1.574011110 0.000000000
pz 0 0.779835771 0.779835771 1.559671543 0.000000000
sum over m 2.353684269 2.353684269 4.707368538 0.000000000
px 1 -0.008738661 -0.008738661 -0.017477321 0.000000000
py 1 -0.008736010 -0.008736010 -0.017472019 0.000000000
pz 1 -0.006464666 -0.006464666 -0.012929332 0.000000000
sum over m -0.023939336 -0.023939336 -0.047878672 0.000000000
sum over m+mul 2.329744933 2.329744933 4.659489866 0.000000000
d3z^2-r^2 0 -0.006389283 -0.006389283 -0.012778566 0.000000000
dx^2-y^2 0 -0.005060255 -0.005060255 -0.010120510 0.000000000
dxy 0 -0.005432451 -0.005432451 -0.010864901 0.000000000
dxz 0 -0.006933671 -0.006933671 -0.013867342 0.000000000
dyz 0 -0.006931778 -0.006931778 -0.013863555 0.000000000
sum over m -0.030747437 -0.030747437 -0.061494875 0.000000000
sum over m+mul -0.030747437 -0.030747437 -0.061494875 0.000000000
348 O Up spin Down spin Sum Diff
multiple
s 0 0.893899160 0.893899160 1.787798320 0.000000000
sum over m 0.893899160 0.893899160 1.787798320 0.000000000
s 1 -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m+mul 0.890856653 0.890856653 1.781713306 0.000000000
px 0 0.787022915 0.787022915 1.574045829 0.000000000
py 0 0.787024779 0.787024779 1.574049559 0.000000000
pz 0 0.779715302 0.779715302 1.559430604 0.000000000
sum over m 2.353762996 2.353762996 4.707525992 0.000000000
px 1 -0.008735679 -0.008735679 -0.017471358 0.000000000
py 1 -0.008731049 -0.008731049 -0.017462099 0.000000000
pz 1 -0.006456234 -0.006456234 -0.012912467 0.000000000
sum over m -0.023922962 -0.023922962 -0.047845924 0.000000000
sum over m+mul 2.329840034 2.329840034 4.659680068 0.000000000
d3z^2-r^2 0 -0.006389845 -0.006389845 -0.012779690 0.000000000
dx^2-y^2 0 -0.005054723 -0.005054723 -0.010109447 0.000000000
dxy 0 -0.005435254 -0.005435254 -0.010870509 0.000000000
dxz 0 -0.006924412 -0.006924412 -0.013848825 0.000000000
dyz 0 -0.006927007 -0.006927007 -0.013854014 0.000000000
sum over m -0.030731242 -0.030731242 -0.061462485 0.000000000
sum over m+mul -0.030731242 -0.030731242 -0.061462485 0.000000000
349 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779577 1.000779577 2.001559154 0.000000000
sum over m 1.000779577 1.000779577 2.001559154 0.000000000
s 1 0.207425039 0.207425039 0.414850079 0.000000000
sum over m 0.207425039 0.207425039 0.414850079 0.000000000
s 2 0.014724726 0.014724726 0.029449451 0.000000000
sum over m 0.014724726 0.014724726 0.029449451 0.000000000
sum over m+mul 1.222929342 1.222929342 2.445858684 0.000000000
px 0 1.006375717 1.006375717 2.012751433 0.000000000
py 0 1.006359477 1.006359477 2.012718954 0.000000000
pz 0 1.006191803 1.006191803 2.012383606 0.000000000
sum over m 3.018926997 3.018926997 6.037853994 0.000000000
px 1 0.065430210 0.065430210 0.130860420 0.000000000
py 1 0.065452492 0.065452492 0.130904985 0.000000000
pz 1 0.040372940 0.040372940 0.080745879 0.000000000
sum over m 0.171255642 0.171255642 0.342511284 0.000000000
sum over m+mul 3.190182639 3.190182639 6.380365277 0.000000000
d3z^2-r^2 0 0.196309784 0.196309784 0.392619567 0.000000000
dx^2-y^2 0 0.201500798 0.201500798 0.403001595 0.000000000
dxy 0 0.250952188 0.250952188 0.501904376 0.000000000
dxz 0 0.268478659 0.268478659 0.536957318 0.000000000
dyz 0 0.268509958 0.268509958 0.537019915 0.000000000
sum over m 1.185751386 1.185751386 2.371502772 0.000000000
d3z^2-r^2 1 0.003473749 0.003473749 0.006947498 0.000000000
dx^2-y^2 1 -0.004477316 -0.004477316 -0.008954633 0.000000000
dxy 1 0.015338915 0.015338915 0.030677830 0.000000000
dxz 1 0.003489870 0.003489870 0.006979740 0.000000000
dyz 1 0.003492566 0.003492566 0.006985132 0.000000000
sum over m 0.021317783 0.021317783 0.042635567 0.000000000
sum over m+mul 1.207069169 1.207069169 2.414138339 0.000000000
350 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000772532 1.000772532 2.001545063 0.000000000
sum over m 1.000772532 1.000772532 2.001545063 0.000000000
s 1 0.207415904 0.207415904 0.414831807 0.000000000
sum over m 0.207415904 0.207415904 0.414831807 0.000000000
s 2 0.014725570 0.014725570 0.029451141 0.000000000
sum over m 0.014725570 0.014725570 0.029451141 0.000000000
sum over m+mul 1.222914006 1.222914006 2.445828011 0.000000000
px 0 1.006375748 1.006375748 2.012751496 0.000000000
py 0 1.006362969 1.006362969 2.012725937 0.000000000
pz 0 1.006206692 1.006206692 2.012413384 0.000000000
sum over m 3.018945409 3.018945409 6.037890817 0.000000000
px 1 0.065437315 0.065437315 0.130874631 0.000000000
py 1 0.065445106 0.065445106 0.130890212 0.000000000
pz 1 0.040372054 0.040372054 0.080744108 0.000000000
sum over m 0.171254476 0.171254476 0.342508951 0.000000000
sum over m+mul 3.190199884 3.190199884 6.380399769 0.000000000
d3z^2-r^2 0 0.196309061 0.196309061 0.392618122 0.000000000
dx^2-y^2 0 0.201508894 0.201508894 0.403017789 0.000000000
dxy 0 0.250944584 0.250944584 0.501889169 0.000000000
dxz 0 0.268487265 0.268487265 0.536974530 0.000000000
dyz 0 0.268511824 0.268511824 0.537023649 0.000000000
sum over m 1.185761629 1.185761629 2.371523258 0.000000000
d3z^2-r^2 1 0.003476755 0.003476755 0.006953511 0.000000000
dx^2-y^2 1 -0.004475955 -0.004475955 -0.008951910 0.000000000
dxy 1 0.015341110 0.015341110 0.030682220 0.000000000
dxz 1 0.003491944 0.003491944 0.006983887 0.000000000
dyz 1 0.003494011 0.003494011 0.006988021 0.000000000
sum over m 0.021327865 0.021327865 0.042655730 0.000000000
sum over m+mul 1.207089494 1.207089494 2.414178988 0.000000000
351 O Up spin Down spin Sum Diff
multiple
s 0 0.893870943 0.893870943 1.787741885 0.000000000
sum over m 0.893870943 0.893870943 1.787741885 0.000000000
s 1 -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m+mul 0.890828329 0.890828329 1.781656659 0.000000000
px 0 0.786897584 0.786897584 1.573795169 0.000000000
py 0 0.786994694 0.786994694 1.573989387 0.000000000
pz 0 0.779811673 0.779811673 1.559623345 0.000000000
sum over m 2.353703951 2.353703951 4.707407901 0.000000000
px 1 -0.008737807 -0.008737807 -0.017475614 0.000000000
py 1 -0.008732950 -0.008732950 -0.017465899 0.000000000
pz 1 -0.006463991 -0.006463991 -0.012927982 0.000000000
sum over m -0.023934748 -0.023934748 -0.047869495 0.000000000
sum over m+mul 2.329769203 2.329769203 4.659538406 0.000000000
d3z^2-r^2 0 -0.006389251 -0.006389251 -0.012778503 0.000000000
dx^2-y^2 0 -0.005059228 -0.005059228 -0.010118457 0.000000000
dxy 0 -0.005432622 -0.005432622 -0.010865243 0.000000000
dxz 0 -0.006931230 -0.006931230 -0.013862459 0.000000000
dyz 0 -0.006930964 -0.006930964 -0.013861928 0.000000000
sum over m -0.030743295 -0.030743295 -0.061486591 0.000000000
sum over m+mul -0.030743295 -0.030743295 -0.061486591 0.000000000
352 O Up spin Down spin Sum Diff
multiple
s 0 0.893906891 0.893906891 1.787813782 0.000000000
sum over m 0.893906891 0.893906891 1.787813782 0.000000000
s 1 -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m+mul 0.890864516 0.890864516 1.781729032 0.000000000
px 0 0.787136278 0.787136278 1.574272556 0.000000000
py 0 0.786887385 0.786887385 1.573774770 0.000000000
pz 0 0.779756985 0.779756985 1.559513970 0.000000000
sum over m 2.353780648 2.353780648 4.707561295 0.000000000
px 1 -0.008746839 -0.008746839 -0.017493677 0.000000000
py 1 -0.008733754 -0.008733754 -0.017467508 0.000000000
pz 1 -0.006460947 -0.006460947 -0.012921894 0.000000000
sum over m -0.023941540 -0.023941540 -0.047883080 0.000000000
sum over m+mul 2.329839108 2.329839108 4.659678215 0.000000000
d3z^2-r^2 0 -0.006390928 -0.006390928 -0.012781856 0.000000000
dx^2-y^2 0 -0.005057555 -0.005057555 -0.010115110 0.000000000
dxy 0 -0.005435139 -0.005435139 -0.010870279 0.000000000
dxz 0 -0.006925167 -0.006925167 -0.013850334 0.000000000
dyz 0 -0.006932324 -0.006932324 -0.013864649 0.000000000
sum over m -0.030741114 -0.030741114 -0.061482228 0.000000000
sum over m+mul -0.030741114 -0.030741114 -0.061482228 0.000000000
353 O Up spin Down spin Sum Diff
multiple
s 0 0.893867015 0.893867015 1.787734031 0.000000000
sum over m 0.893867015 0.893867015 1.787734031 0.000000000
s 1 -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m+mul 0.890824536 0.890824536 1.781649071 0.000000000
px 0 0.786842942 0.786842942 1.573685885 0.000000000
py 0 0.787005555 0.787005555 1.574011110 0.000000000
pz 0 0.779835772 0.779835772 1.559671543 0.000000000
sum over m 2.353684269 2.353684269 4.707368539 0.000000000
px 1 -0.008738661 -0.008738661 -0.017477321 0.000000000
py 1 -0.008736010 -0.008736010 -0.017472019 0.000000000
pz 1 -0.006464666 -0.006464666 -0.012929332 0.000000000
sum over m -0.023939336 -0.023939336 -0.047878672 0.000000000
sum over m+mul 2.329744933 2.329744933 4.659489866 0.000000000
d3z^2-r^2 0 -0.006389283 -0.006389283 -0.012778566 0.000000000
dx^2-y^2 0 -0.005060255 -0.005060255 -0.010120510 0.000000000
dxy 0 -0.005432451 -0.005432451 -0.010864901 0.000000000
dxz 0 -0.006933671 -0.006933671 -0.013867342 0.000000000
dyz 0 -0.006931778 -0.006931778 -0.013863555 0.000000000
sum over m -0.030747437 -0.030747437 -0.061494874 0.000000000
sum over m+mul -0.030747437 -0.030747437 -0.061494874 0.000000000
354 O Up spin Down spin Sum Diff
multiple
s 0 0.893899160 0.893899160 1.787798320 0.000000000
sum over m 0.893899160 0.893899160 1.787798320 0.000000000
s 1 -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m+mul 0.890856653 0.890856653 1.781713306 0.000000000
px 0 0.787022915 0.787022915 1.574045829 0.000000000
py 0 0.787024780 0.787024780 1.574049559 0.000000000
pz 0 0.779715302 0.779715302 1.559430604 0.000000000
sum over m 2.353762996 2.353762996 4.707525993 0.000000000
px 1 -0.008735679 -0.008735679 -0.017471358 0.000000000
py 1 -0.008731049 -0.008731049 -0.017462099 0.000000000
pz 1 -0.006456234 -0.006456234 -0.012912467 0.000000000
sum over m -0.023922962 -0.023922962 -0.047845924 0.000000000
sum over m+mul 2.329840034 2.329840034 4.659680068 0.000000000
d3z^2-r^2 0 -0.006389845 -0.006389845 -0.012779690 0.000000000
dx^2-y^2 0 -0.005054723 -0.005054723 -0.010109447 0.000000000
dxy 0 -0.005435254 -0.005435254 -0.010870509 0.000000000
dxz 0 -0.006924412 -0.006924412 -0.013848825 0.000000000
dyz 0 -0.006927007 -0.006927007 -0.013854014 0.000000000
sum over m -0.030731242 -0.030731242 -0.061462485 0.000000000
sum over m+mul -0.030731242 -0.030731242 -0.061462485 0.000000000
355 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779577 1.000779577 2.001559154 0.000000000
sum over m 1.000779577 1.000779577 2.001559154 0.000000000
s 1 0.207425039 0.207425039 0.414850079 0.000000000
sum over m 0.207425039 0.207425039 0.414850079 0.000000000
s 2 0.014724726 0.014724726 0.029449451 0.000000000
sum over m 0.014724726 0.014724726 0.029449451 0.000000000
sum over m+mul 1.222929342 1.222929342 2.445858684 0.000000000
px 0 1.006375717 1.006375717 2.012751433 0.000000000
py 0 1.006359477 1.006359477 2.012718954 0.000000000
pz 0 1.006191803 1.006191803 2.012383606 0.000000000
sum over m 3.018926997 3.018926997 6.037853994 0.000000000
px 1 0.065430210 0.065430210 0.130860420 0.000000000
py 1 0.065452492 0.065452492 0.130904985 0.000000000
pz 1 0.040372940 0.040372940 0.080745879 0.000000000
sum over m 0.171255642 0.171255642 0.342511284 0.000000000
sum over m+mul 3.190182639 3.190182639 6.380365278 0.000000000
d3z^2-r^2 0 0.196309784 0.196309784 0.392619567 0.000000000
dx^2-y^2 0 0.201500798 0.201500798 0.403001596 0.000000000
dxy 0 0.250952188 0.250952188 0.501904376 0.000000000
dxz 0 0.268478659 0.268478659 0.536957319 0.000000000
dyz 0 0.268509958 0.268509958 0.537019916 0.000000000
sum over m 1.185751387 1.185751387 2.371502773 0.000000000
d3z^2-r^2 1 0.003473749 0.003473749 0.006947498 0.000000000
dx^2-y^2 1 -0.004477316 -0.004477316 -0.008954633 0.000000000
dxy 1 0.015338915 0.015338915 0.030677830 0.000000000
dxz 1 0.003489870 0.003489870 0.006979740 0.000000000
dyz 1 0.003492566 0.003492566 0.006985132 0.000000000
sum over m 0.021317783 0.021317783 0.042635567 0.000000000
sum over m+mul 1.207069170 1.207069170 2.414138340 0.000000000
356 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000772532 1.000772532 2.001545063 0.000000000
sum over m 1.000772532 1.000772532 2.001545063 0.000000000
s 1 0.207415904 0.207415904 0.414831807 0.000000000
sum over m 0.207415904 0.207415904 0.414831807 0.000000000
s 2 0.014725570 0.014725570 0.029451141 0.000000000
sum over m 0.014725570 0.014725570 0.029451141 0.000000000
sum over m+mul 1.222914006 1.222914006 2.445828011 0.000000000
px 0 1.006375748 1.006375748 2.012751496 0.000000000
py 0 1.006362969 1.006362969 2.012725937 0.000000000
pz 0 1.006206692 1.006206692 2.012413384 0.000000000
sum over m 3.018945409 3.018945409 6.037890817 0.000000000
px 1 0.065437315 0.065437315 0.130874630 0.000000000
py 1 0.065445106 0.065445106 0.130890213 0.000000000
pz 1 0.040372054 0.040372054 0.080744108 0.000000000
sum over m 0.171254475 0.171254475 0.342508951 0.000000000
sum over m+mul 3.190199884 3.190199884 6.380399768 0.000000000
d3z^2-r^2 0 0.196309061 0.196309061 0.392618122 0.000000000
dx^2-y^2 0 0.201508894 0.201508894 0.403017788 0.000000000
dxy 0 0.250944584 0.250944584 0.501889169 0.000000000
dxz 0 0.268487265 0.268487265 0.536974531 0.000000000
dyz 0 0.268511824 0.268511824 0.537023649 0.000000000
sum over m 1.185761629 1.185761629 2.371523258 0.000000000
d3z^2-r^2 1 0.003476755 0.003476755 0.006953511 0.000000000
dx^2-y^2 1 -0.004475955 -0.004475955 -0.008951910 0.000000000
dxy 1 0.015341110 0.015341110 0.030682220 0.000000000
dxz 1 0.003491944 0.003491944 0.006983887 0.000000000
dyz 1 0.003494011 0.003494011 0.006988021 0.000000000
sum over m 0.021327865 0.021327865 0.042655730 0.000000000
sum over m+mul 1.207089494 1.207089494 2.414178988 0.000000000
357 O Up spin Down spin Sum Diff
multiple
s 0 0.893870942 0.893870942 1.787741885 0.000000000
sum over m 0.893870942 0.893870942 1.787741885 0.000000000
s 1 -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m+mul 0.890828329 0.890828329 1.781656659 0.000000000
px 0 0.786897585 0.786897585 1.573795169 0.000000000
py 0 0.786994693 0.786994693 1.573989387 0.000000000
pz 0 0.779811673 0.779811673 1.559623345 0.000000000
sum over m 2.353703950 2.353703950 4.707407901 0.000000000
px 1 -0.008737807 -0.008737807 -0.017475614 0.000000000
py 1 -0.008732950 -0.008732950 -0.017465899 0.000000000
pz 1 -0.006463991 -0.006463991 -0.012927982 0.000000000
sum over m -0.023934748 -0.023934748 -0.047869495 0.000000000
sum over m+mul 2.329769203 2.329769203 4.659538406 0.000000000
d3z^2-r^2 0 -0.006389251 -0.006389251 -0.012778503 0.000000000
dx^2-y^2 0 -0.005059228 -0.005059228 -0.010118457 0.000000000
dxy 0 -0.005432622 -0.005432622 -0.010865243 0.000000000
dxz 0 -0.006931230 -0.006931230 -0.013862459 0.000000000
dyz 0 -0.006930964 -0.006930964 -0.013861928 0.000000000
sum over m -0.030743295 -0.030743295 -0.061486591 0.000000000
sum over m+mul -0.030743295 -0.030743295 -0.061486591 0.000000000
358 O Up spin Down spin Sum Diff
multiple
s 0 0.893906891 0.893906891 1.787813783 0.000000000
sum over m 0.893906891 0.893906891 1.787813783 0.000000000
s 1 -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m+mul 0.890864516 0.890864516 1.781729032 0.000000000
px 0 0.787136278 0.787136278 1.574272556 0.000000000
py 0 0.786887384 0.786887384 1.573774769 0.000000000
pz 0 0.779756985 0.779756985 1.559513970 0.000000000
sum over m 2.353780648 2.353780648 4.707561296 0.000000000
px 1 -0.008746839 -0.008746839 -0.017493677 0.000000000
py 1 -0.008733754 -0.008733754 -0.017467508 0.000000000
pz 1 -0.006460947 -0.006460947 -0.012921894 0.000000000
sum over m -0.023941540 -0.023941540 -0.047883080 0.000000000
sum over m+mul 2.329839108 2.329839108 4.659678216 0.000000000
d3z^2-r^2 0 -0.006390928 -0.006390928 -0.012781856 0.000000000
dx^2-y^2 0 -0.005057555 -0.005057555 -0.010115110 0.000000000
dxy 0 -0.005435139 -0.005435139 -0.010870279 0.000000000
dxz 0 -0.006925167 -0.006925167 -0.013850334 0.000000000
dyz 0 -0.006932324 -0.006932324 -0.013864649 0.000000000
sum over m -0.030741114 -0.030741114 -0.061482227 0.000000000
sum over m+mul -0.030741114 -0.030741114 -0.061482227 0.000000000
359 O Up spin Down spin Sum Diff
multiple
s 0 0.893867015 0.893867015 1.787734031 0.000000000
sum over m 0.893867015 0.893867015 1.787734031 0.000000000
s 1 -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m+mul 0.890824536 0.890824536 1.781649071 0.000000000
px 0 0.786842942 0.786842942 1.573685885 0.000000000
py 0 0.787005555 0.787005555 1.574011110 0.000000000
pz 0 0.779835771 0.779835771 1.559671543 0.000000000
sum over m 2.353684269 2.353684269 4.707368538 0.000000000
px 1 -0.008738661 -0.008738661 -0.017477321 0.000000000
py 1 -0.008736010 -0.008736010 -0.017472019 0.000000000
pz 1 -0.006464666 -0.006464666 -0.012929332 0.000000000
sum over m -0.023939336 -0.023939336 -0.047878672 0.000000000
sum over m+mul 2.329744933 2.329744933 4.659489865 0.000000000
d3z^2-r^2 0 -0.006389283 -0.006389283 -0.012778566 0.000000000
dx^2-y^2 0 -0.005060255 -0.005060255 -0.010120509 0.000000000
dxy 0 -0.005432451 -0.005432451 -0.010864901 0.000000000
dxz 0 -0.006933671 -0.006933671 -0.013867342 0.000000000
dyz 0 -0.006931778 -0.006931778 -0.013863555 0.000000000
sum over m -0.030747437 -0.030747437 -0.061494874 0.000000000
sum over m+mul -0.030747437 -0.030747437 -0.061494874 0.000000000
360 O Up spin Down spin Sum Diff
multiple
s 0 0.893899160 0.893899160 1.787798320 0.000000000
sum over m 0.893899160 0.893899160 1.787798320 0.000000000
s 1 -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m+mul 0.890856653 0.890856653 1.781713306 0.000000000
px 0 0.787022915 0.787022915 1.574045829 0.000000000
py 0 0.787024779 0.787024779 1.574049558 0.000000000
pz 0 0.779715302 0.779715302 1.559430605 0.000000000
sum over m 2.353762996 2.353762996 4.707525992 0.000000000
px 1 -0.008735679 -0.008735679 -0.017471358 0.000000000
py 1 -0.008731049 -0.008731049 -0.017462099 0.000000000
pz 1 -0.006456234 -0.006456234 -0.012912467 0.000000000
sum over m -0.023922962 -0.023922962 -0.047845924 0.000000000
sum over m+mul 2.329840034 2.329840034 4.659680068 0.000000000
d3z^2-r^2 0 -0.006389845 -0.006389845 -0.012779690 0.000000000
dx^2-y^2 0 -0.005054723 -0.005054723 -0.010109447 0.000000000
dxy 0 -0.005435254 -0.005435254 -0.010870509 0.000000000
dxz 0 -0.006924412 -0.006924412 -0.013848825 0.000000000
dyz 0 -0.006927007 -0.006927007 -0.013854014 0.000000000
sum over m -0.030731242 -0.030731242 -0.061462485 0.000000000
sum over m+mul -0.030731242 -0.030731242 -0.061462485 0.000000000
361 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779577 1.000779577 2.001559154 0.000000000
sum over m 1.000779577 1.000779577 2.001559154 0.000000000
s 1 0.207425039 0.207425039 0.414850078 0.000000000
sum over m 0.207425039 0.207425039 0.414850078 0.000000000
s 2 0.014724726 0.014724726 0.029449451 0.000000000
sum over m 0.014724726 0.014724726 0.029449451 0.000000000
sum over m+mul 1.222929342 1.222929342 2.445858684 0.000000000
px 0 1.006375717 1.006375717 2.012751433 0.000000000
py 0 1.006359477 1.006359477 2.012718954 0.000000000
pz 0 1.006191803 1.006191803 2.012383606 0.000000000
sum over m 3.018926997 3.018926997 6.037853994 0.000000000
px 1 0.065430210 0.065430210 0.130860420 0.000000000
py 1 0.065452492 0.065452492 0.130904985 0.000000000
pz 1 0.040372939 0.040372939 0.080745879 0.000000000
sum over m 0.171255642 0.171255642 0.342511283 0.000000000
sum over m+mul 3.190182638 3.190182638 6.380365277 0.000000000
d3z^2-r^2 0 0.196309784 0.196309784 0.392619567 0.000000000
dx^2-y^2 0 0.201500798 0.201500798 0.403001597 0.000000000
dxy 0 0.250952188 0.250952188 0.501904375 0.000000000
dxz 0 0.268478659 0.268478659 0.536957318 0.000000000
dyz 0 0.268509958 0.268509958 0.537019915 0.000000000
sum over m 1.185751386 1.185751386 2.371502773 0.000000000
d3z^2-r^2 1 0.003473749 0.003473749 0.006947498 0.000000000
dx^2-y^2 1 -0.004477316 -0.004477316 -0.008954633 0.000000000
dxy 1 0.015338915 0.015338915 0.030677830 0.000000000
dxz 1 0.003489870 0.003489870 0.006979740 0.000000000
dyz 1 0.003492566 0.003492566 0.006985131 0.000000000
sum over m 0.021317783 0.021317783 0.042635567 0.000000000
sum over m+mul 1.207069170 1.207069170 2.414138339 0.000000000
362 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000772532 1.000772532 2.001545063 0.000000000
sum over m 1.000772532 1.000772532 2.001545063 0.000000000
s 1 0.207415904 0.207415904 0.414831807 0.000000000
sum over m 0.207415904 0.207415904 0.414831807 0.000000000
s 2 0.014725570 0.014725570 0.029451141 0.000000000
sum over m 0.014725570 0.014725570 0.029451141 0.000000000
sum over m+mul 1.222914006 1.222914006 2.445828011 0.000000000
px 0 1.006375748 1.006375748 2.012751496 0.000000000
py 0 1.006362969 1.006362969 2.012725938 0.000000000
pz 0 1.006206692 1.006206692 2.012413384 0.000000000
sum over m 3.018945409 3.018945409 6.037890818 0.000000000
px 1 0.065437315 0.065437315 0.130874631 0.000000000
py 1 0.065445106 0.065445106 0.130890213 0.000000000
pz 1 0.040372054 0.040372054 0.080744108 0.000000000
sum over m 0.171254476 0.171254476 0.342508951 0.000000000
sum over m+mul 3.190199884 3.190199884 6.380399769 0.000000000
d3z^2-r^2 0 0.196309061 0.196309061 0.392618121 0.000000000
dx^2-y^2 0 0.201508894 0.201508894 0.403017789 0.000000000
dxy 0 0.250944584 0.250944584 0.501889168 0.000000000
dxz 0 0.268487266 0.268487266 0.536974531 0.000000000
dyz 0 0.268511824 0.268511824 0.537023649 0.000000000
sum over m 1.185761629 1.185761629 2.371523258 0.000000000
d3z^2-r^2 1 0.003476755 0.003476755 0.006953511 0.000000000
dx^2-y^2 1 -0.004475955 -0.004475955 -0.008951910 0.000000000
dxy 1 0.015341110 0.015341110 0.030682220 0.000000000
dxz 1 0.003491944 0.003491944 0.006983887 0.000000000
dyz 1 0.003494011 0.003494011 0.006988021 0.000000000
sum over m 0.021327865 0.021327865 0.042655730 0.000000000
sum over m+mul 1.207089494 1.207089494 2.414178988 0.000000000
363 O Up spin Down spin Sum Diff
multiple
s 0 0.893870943 0.893870943 1.787741885 0.000000000
sum over m 0.893870943 0.893870943 1.787741885 0.000000000
s 1 -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m+mul 0.890828330 0.890828330 1.781656659 0.000000000
px 0 0.786897584 0.786897584 1.573795169 0.000000000
py 0 0.786994693 0.786994693 1.573989387 0.000000000
pz 0 0.779811672 0.779811672 1.559623345 0.000000000
sum over m 2.353703950 2.353703950 4.707407900 0.000000000
px 1 -0.008737807 -0.008737807 -0.017475614 0.000000000
py 1 -0.008732950 -0.008732950 -0.017465899 0.000000000
pz 1 -0.006463991 -0.006463991 -0.012927982 0.000000000
sum over m -0.023934748 -0.023934748 -0.047869495 0.000000000
sum over m+mul 2.329769203 2.329769203 4.659538405 0.000000000
d3z^2-r^2 0 -0.006389251 -0.006389251 -0.012778503 0.000000000
dx^2-y^2 0 -0.005059228 -0.005059228 -0.010118457 0.000000000
dxy 0 -0.005432622 -0.005432622 -0.010865243 0.000000000
dxz 0 -0.006931230 -0.006931230 -0.013862459 0.000000000
dyz 0 -0.006930964 -0.006930964 -0.013861928 0.000000000
sum over m -0.030743295 -0.030743295 -0.061486591 0.000000000
sum over m+mul -0.030743295 -0.030743295 -0.061486591 0.000000000
364 O Up spin Down spin Sum Diff
multiple
s 0 0.893906891 0.893906891 1.787813783 0.000000000
sum over m 0.893906891 0.893906891 1.787813783 0.000000000
s 1 -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m+mul 0.890864516 0.890864516 1.781729032 0.000000000
px 0 0.787136278 0.787136278 1.574272556 0.000000000
py 0 0.786887385 0.786887385 1.573774769 0.000000000
pz 0 0.779756985 0.779756985 1.559513971 0.000000000
sum over m 2.353780648 2.353780648 4.707561296 0.000000000
px 1 -0.008746839 -0.008746839 -0.017493677 0.000000000
py 1 -0.008733754 -0.008733754 -0.017467508 0.000000000
pz 1 -0.006460947 -0.006460947 -0.012921894 0.000000000
sum over m -0.023941540 -0.023941540 -0.047883080 0.000000000
sum over m+mul 2.329839108 2.329839108 4.659678216 0.000000000
d3z^2-r^2 0 -0.006390928 -0.006390928 -0.012781856 0.000000000
dx^2-y^2 0 -0.005057555 -0.005057555 -0.010115110 0.000000000
dxy 0 -0.005435139 -0.005435139 -0.010870279 0.000000000
dxz 0 -0.006925167 -0.006925167 -0.013850334 0.000000000
dyz 0 -0.006932324 -0.006932324 -0.013864649 0.000000000
sum over m -0.030741114 -0.030741114 -0.061482228 0.000000000
sum over m+mul -0.030741114 -0.030741114 -0.061482228 0.000000000
365 O Up spin Down spin Sum Diff
multiple
s 0 0.893867015 0.893867015 1.787734031 0.000000000
sum over m 0.893867015 0.893867015 1.787734031 0.000000000
s 1 -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m+mul 0.890824536 0.890824536 1.781649071 0.000000000
px 0 0.786842943 0.786842943 1.573685885 0.000000000
py 0 0.787005555 0.787005555 1.574011110 0.000000000
pz 0 0.779835771 0.779835771 1.559671543 0.000000000
sum over m 2.353684269 2.353684269 4.707368538 0.000000000
px 1 -0.008738661 -0.008738661 -0.017477321 0.000000000
py 1 -0.008736010 -0.008736010 -0.017472019 0.000000000
pz 1 -0.006464666 -0.006464666 -0.012929332 0.000000000
sum over m -0.023939336 -0.023939336 -0.047878672 0.000000000
sum over m+mul 2.329744933 2.329744933 4.659489866 0.000000000
d3z^2-r^2 0 -0.006389283 -0.006389283 -0.012778566 0.000000000
dx^2-y^2 0 -0.005060255 -0.005060255 -0.010120510 0.000000000
dxy 0 -0.005432451 -0.005432451 -0.010864901 0.000000000
dxz 0 -0.006933671 -0.006933671 -0.013867342 0.000000000
dyz 0 -0.006931778 -0.006931778 -0.013863555 0.000000000
sum over m -0.030747437 -0.030747437 -0.061494875 0.000000000
sum over m+mul -0.030747437 -0.030747437 -0.061494875 0.000000000
366 O Up spin Down spin Sum Diff
multiple
s 0 0.893899160 0.893899160 1.787798320 0.000000000
sum over m 0.893899160 0.893899160 1.787798320 0.000000000
s 1 -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m+mul 0.890856653 0.890856653 1.781713306 0.000000000
px 0 0.787022915 0.787022915 1.574045830 0.000000000
py 0 0.787024780 0.787024780 1.574049559 0.000000000
pz 0 0.779715302 0.779715302 1.559430604 0.000000000
sum over m 2.353762997 2.353762997 4.707525993 0.000000000
px 1 -0.008735679 -0.008735679 -0.017471358 0.000000000
py 1 -0.008731049 -0.008731049 -0.017462099 0.000000000
pz 1 -0.006456234 -0.006456234 -0.012912467 0.000000000
sum over m -0.023922962 -0.023922962 -0.047845924 0.000000000
sum over m+mul 2.329840034 2.329840034 4.659680069 0.000000000
d3z^2-r^2 0 -0.006389845 -0.006389845 -0.012779690 0.000000000
dx^2-y^2 0 -0.005054723 -0.005054723 -0.010109447 0.000000000
dxy 0 -0.005435254 -0.005435254 -0.010870509 0.000000000
dxz 0 -0.006924412 -0.006924412 -0.013848825 0.000000000
dyz 0 -0.006927007 -0.006927007 -0.013854014 0.000000000
sum over m -0.030731242 -0.030731242 -0.061462485 0.000000000
sum over m+mul -0.030731242 -0.030731242 -0.061462485 0.000000000
367 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779577 1.000779577 2.001559154 0.000000000
sum over m 1.000779577 1.000779577 2.001559154 0.000000000
s 1 0.207425039 0.207425039 0.414850079 0.000000000
sum over m 0.207425039 0.207425039 0.414850079 0.000000000
s 2 0.014724726 0.014724726 0.029449451 0.000000000
sum over m 0.014724726 0.014724726 0.029449451 0.000000000
sum over m+mul 1.222929342 1.222929342 2.445858684 0.000000000
px 0 1.006375717 1.006375717 2.012751433 0.000000000
py 0 1.006359477 1.006359477 2.012718954 0.000000000
pz 0 1.006191803 1.006191803 2.012383606 0.000000000
sum over m 3.018926997 3.018926997 6.037853994 0.000000000
px 1 0.065430210 0.065430210 0.130860420 0.000000000
py 1 0.065452492 0.065452492 0.130904985 0.000000000
pz 1 0.040372939 0.040372939 0.080745879 0.000000000
sum over m 0.171255642 0.171255642 0.342511284 0.000000000
sum over m+mul 3.190182639 3.190182639 6.380365278 0.000000000
d3z^2-r^2 0 0.196309784 0.196309784 0.392619567 0.000000000
dx^2-y^2 0 0.201500798 0.201500798 0.403001596 0.000000000
dxy 0 0.250952188 0.250952188 0.501904376 0.000000000
dxz 0 0.268478659 0.268478659 0.536957319 0.000000000
dyz 0 0.268509958 0.268509958 0.537019916 0.000000000
sum over m 1.185751387 1.185751387 2.371502774 0.000000000
d3z^2-r^2 1 0.003473749 0.003473749 0.006947498 0.000000000
dx^2-y^2 1 -0.004477316 -0.004477316 -0.008954633 0.000000000
dxy 1 0.015338915 0.015338915 0.030677830 0.000000000
dxz 1 0.003489870 0.003489870 0.006979740 0.000000000
dyz 1 0.003492566 0.003492566 0.006985132 0.000000000
sum over m 0.021317783 0.021317783 0.042635567 0.000000000
sum over m+mul 1.207069170 1.207069170 2.414138341 0.000000000
368 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000772532 1.000772532 2.001545063 0.000000000
sum over m 1.000772532 1.000772532 2.001545063 0.000000000
s 1 0.207415904 0.207415904 0.414831807 0.000000000
sum over m 0.207415904 0.207415904 0.414831807 0.000000000
s 2 0.014725570 0.014725570 0.029451141 0.000000000
sum over m 0.014725570 0.014725570 0.029451141 0.000000000
sum over m+mul 1.222914006 1.222914006 2.445828011 0.000000000
px 0 1.006375748 1.006375748 2.012751496 0.000000000
py 0 1.006362969 1.006362969 2.012725937 0.000000000
pz 0 1.006206692 1.006206692 2.012413384 0.000000000
sum over m 3.018945409 3.018945409 6.037890817 0.000000000
px 1 0.065437316 0.065437316 0.130874631 0.000000000
py 1 0.065445106 0.065445106 0.130890212 0.000000000
pz 1 0.040372054 0.040372054 0.080744108 0.000000000
sum over m 0.171254476 0.171254476 0.342508951 0.000000000
sum over m+mul 3.190199884 3.190199884 6.380399769 0.000000000
d3z^2-r^2 0 0.196309061 0.196309061 0.392618122 0.000000000
dx^2-y^2 0 0.201508894 0.201508894 0.403017788 0.000000000
dxy 0 0.250944584 0.250944584 0.501889169 0.000000000
dxz 0 0.268487265 0.268487265 0.536974531 0.000000000
dyz 0 0.268511824 0.268511824 0.537023648 0.000000000
sum over m 1.185761629 1.185761629 2.371523258 0.000000000
d3z^2-r^2 1 0.003476755 0.003476755 0.006953511 0.000000000
dx^2-y^2 1 -0.004475955 -0.004475955 -0.008951910 0.000000000
dxy 1 0.015341110 0.015341110 0.030682220 0.000000000
dxz 1 0.003491944 0.003491944 0.006983887 0.000000000
dyz 1 0.003494011 0.003494011 0.006988021 0.000000000
sum over m 0.021327865 0.021327865 0.042655730 0.000000000
sum over m+mul 1.207089494 1.207089494 2.414178988 0.000000000
369 O Up spin Down spin Sum Diff
multiple
s 0 0.893870942 0.893870942 1.787741885 0.000000000
sum over m 0.893870942 0.893870942 1.787741885 0.000000000
s 1 -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m+mul 0.890828329 0.890828329 1.781656659 0.000000000
px 0 0.786897585 0.786897585 1.573795169 0.000000000
py 0 0.786994693 0.786994693 1.573989387 0.000000000
pz 0 0.779811673 0.779811673 1.559623345 0.000000000
sum over m 2.353703951 2.353703951 4.707407901 0.000000000
px 1 -0.008737807 -0.008737807 -0.017475614 0.000000000
py 1 -0.008732950 -0.008732950 -0.017465899 0.000000000
pz 1 -0.006463991 -0.006463991 -0.012927982 0.000000000
sum over m -0.023934748 -0.023934748 -0.047869495 0.000000000
sum over m+mul 2.329769203 2.329769203 4.659538406 0.000000000
d3z^2-r^2 0 -0.006389251 -0.006389251 -0.012778503 0.000000000
dx^2-y^2 0 -0.005059228 -0.005059228 -0.010118457 0.000000000
dxy 0 -0.005432622 -0.005432622 -0.010865243 0.000000000
dxz 0 -0.006931230 -0.006931230 -0.013862459 0.000000000
dyz 0 -0.006930964 -0.006930964 -0.013861928 0.000000000
sum over m -0.030743295 -0.030743295 -0.061486591 0.000000000
sum over m+mul -0.030743295 -0.030743295 -0.061486591 0.000000000
370 O Up spin Down spin Sum Diff
multiple
s 0 0.893906891 0.893906891 1.787813783 0.000000000
sum over m 0.893906891 0.893906891 1.787813783 0.000000000
s 1 -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m+mul 0.890864516 0.890864516 1.781729032 0.000000000
px 0 0.787136278 0.787136278 1.574272556 0.000000000
py 0 0.786887384 0.786887384 1.573774769 0.000000000
pz 0 0.779756985 0.779756985 1.559513971 0.000000000
sum over m 2.353780648 2.353780648 4.707561295 0.000000000
px 1 -0.008746839 -0.008746839 -0.017493677 0.000000000
py 1 -0.008733754 -0.008733754 -0.017467508 0.000000000
pz 1 -0.006460947 -0.006460947 -0.012921894 0.000000000
sum over m -0.023941540 -0.023941540 -0.047883080 0.000000000
sum over m+mul 2.329839108 2.329839108 4.659678215 0.000000000
d3z^2-r^2 0 -0.006390928 -0.006390928 -0.012781856 0.000000000
dx^2-y^2 0 -0.005057555 -0.005057555 -0.010115110 0.000000000
dxy 0 -0.005435139 -0.005435139 -0.010870279 0.000000000
dxz 0 -0.006925167 -0.006925167 -0.013850334 0.000000000
dyz 0 -0.006932324 -0.006932324 -0.013864649 0.000000000
sum over m -0.030741114 -0.030741114 -0.061482227 0.000000000
sum over m+mul -0.030741114 -0.030741114 -0.061482227 0.000000000
371 O Up spin Down spin Sum Diff
multiple
s 0 0.893867015 0.893867015 1.787734031 0.000000000
sum over m 0.893867015 0.893867015 1.787734031 0.000000000
s 1 -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m+mul 0.890824536 0.890824536 1.781649071 0.000000000
px 0 0.786842943 0.786842943 1.573685885 0.000000000
py 0 0.787005555 0.787005555 1.574011110 0.000000000
pz 0 0.779835771 0.779835771 1.559671543 0.000000000
sum over m 2.353684269 2.353684269 4.707368539 0.000000000
px 1 -0.008738661 -0.008738661 -0.017477321 0.000000000
py 1 -0.008736010 -0.008736010 -0.017472019 0.000000000
pz 1 -0.006464666 -0.006464666 -0.012929332 0.000000000
sum over m -0.023939336 -0.023939336 -0.047878672 0.000000000
sum over m+mul 2.329744933 2.329744933 4.659489866 0.000000000
d3z^2-r^2 0 -0.006389283 -0.006389283 -0.012778566 0.000000000
dx^2-y^2 0 -0.005060255 -0.005060255 -0.010120510 0.000000000
dxy 0 -0.005432451 -0.005432451 -0.010864901 0.000000000
dxz 0 -0.006933671 -0.006933671 -0.013867342 0.000000000
dyz 0 -0.006931778 -0.006931778 -0.013863555 0.000000000
sum over m -0.030747437 -0.030747437 -0.061494875 0.000000000
sum over m+mul -0.030747437 -0.030747437 -0.061494875 0.000000000
372 O Up spin Down spin Sum Diff
multiple
s 0 0.893899160 0.893899160 1.787798320 0.000000000
sum over m 0.893899160 0.893899160 1.787798320 0.000000000
s 1 -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m+mul 0.890856653 0.890856653 1.781713306 0.000000000
px 0 0.787022915 0.787022915 1.574045830 0.000000000
py 0 0.787024780 0.787024780 1.574049559 0.000000000
pz 0 0.779715302 0.779715302 1.559430604 0.000000000
sum over m 2.353762996 2.353762996 4.707525993 0.000000000
px 1 -0.008735679 -0.008735679 -0.017471358 0.000000000
py 1 -0.008731049 -0.008731049 -0.017462099 0.000000000
pz 1 -0.006456234 -0.006456234 -0.012912467 0.000000000
sum over m -0.023922962 -0.023922962 -0.047845924 0.000000000
sum over m+mul 2.329840034 2.329840034 4.659680068 0.000000000
d3z^2-r^2 0 -0.006389845 -0.006389845 -0.012779690 0.000000000
dx^2-y^2 0 -0.005054723 -0.005054723 -0.010109447 0.000000000
dxy 0 -0.005435254 -0.005435254 -0.010870509 0.000000000
dxz 0 -0.006924412 -0.006924412 -0.013848825 0.000000000
dyz 0 -0.006927007 -0.006927007 -0.013854014 0.000000000
sum over m -0.030731242 -0.030731242 -0.061462485 0.000000000
sum over m+mul -0.030731242 -0.030731242 -0.061462485 0.000000000
373 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779577 1.000779577 2.001559154 0.000000000
sum over m 1.000779577 1.000779577 2.001559154 0.000000000
s 1 0.207425039 0.207425039 0.414850079 0.000000000
sum over m 0.207425039 0.207425039 0.414850079 0.000000000
s 2 0.014724726 0.014724726 0.029449451 0.000000000
sum over m 0.014724726 0.014724726 0.029449451 0.000000000
sum over m+mul 1.222929342 1.222929342 2.445858684 0.000000000
px 0 1.006375717 1.006375717 2.012751433 0.000000000
py 0 1.006359477 1.006359477 2.012718954 0.000000000
pz 0 1.006191803 1.006191803 2.012383606 0.000000000
sum over m 3.018926997 3.018926997 6.037853994 0.000000000
px 1 0.065430210 0.065430210 0.130860420 0.000000000
py 1 0.065452493 0.065452493 0.130904985 0.000000000
pz 1 0.040372940 0.040372940 0.080745879 0.000000000
sum over m 0.171255642 0.171255642 0.342511284 0.000000000
sum over m+mul 3.190182639 3.190182639 6.380365278 0.000000000
d3z^2-r^2 0 0.196309784 0.196309784 0.392619568 0.000000000
dx^2-y^2 0 0.201500798 0.201500798 0.403001596 0.000000000
dxy 0 0.250952188 0.250952188 0.501904376 0.000000000
dxz 0 0.268478659 0.268478659 0.536957319 0.000000000
dyz 0 0.268509958 0.268509958 0.537019916 0.000000000
sum over m 1.185751387 1.185751387 2.371502774 0.000000000
d3z^2-r^2 1 0.003473749 0.003473749 0.006947498 0.000000000
dx^2-y^2 1 -0.004477316 -0.004477316 -0.008954633 0.000000000
dxy 1 0.015338915 0.015338915 0.030677830 0.000000000
dxz 1 0.003489870 0.003489870 0.006979740 0.000000000
dyz 1 0.003492566 0.003492566 0.006985132 0.000000000
sum over m 0.021317783 0.021317783 0.042635567 0.000000000
sum over m+mul 1.207069170 1.207069170 2.414138341 0.000000000
374 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000772532 1.000772532 2.001545063 0.000000000
sum over m 1.000772532 1.000772532 2.001545063 0.000000000
s 1 0.207415903 0.207415903 0.414831807 0.000000000
sum over m 0.207415903 0.207415903 0.414831807 0.000000000
s 2 0.014725570 0.014725570 0.029451141 0.000000000
sum over m 0.014725570 0.014725570 0.029451141 0.000000000
sum over m+mul 1.222914005 1.222914005 2.445828011 0.000000000
px 0 1.006375748 1.006375748 2.012751496 0.000000000
py 0 1.006362969 1.006362969 2.012725938 0.000000000
pz 0 1.006206692 1.006206692 2.012413384 0.000000000
sum over m 3.018945409 3.018945409 6.037890818 0.000000000
px 1 0.065437315 0.065437315 0.130874631 0.000000000
py 1 0.065445106 0.065445106 0.130890212 0.000000000
pz 1 0.040372054 0.040372054 0.080744108 0.000000000
sum over m 0.171254475 0.171254475 0.342508951 0.000000000
sum over m+mul 3.190199884 3.190199884 6.380399768 0.000000000
d3z^2-r^2 0 0.196309061 0.196309061 0.392618122 0.000000000
dx^2-y^2 0 0.201508894 0.201508894 0.403017788 0.000000000
dxy 0 0.250944584 0.250944584 0.501889169 0.000000000
dxz 0 0.268487265 0.268487265 0.536974530 0.000000000
dyz 0 0.268511824 0.268511824 0.537023648 0.000000000
sum over m 1.185761628 1.185761628 2.371523256 0.000000000
d3z^2-r^2 1 0.003476755 0.003476755 0.006953511 0.000000000
dx^2-y^2 1 -0.004475955 -0.004475955 -0.008951910 0.000000000
dxy 1 0.015341110 0.015341110 0.030682220 0.000000000
dxz 1 0.003491944 0.003491944 0.006983887 0.000000000
dyz 1 0.003494011 0.003494011 0.006988021 0.000000000
sum over m 0.021327865 0.021327865 0.042655730 0.000000000
sum over m+mul 1.207089493 1.207089493 2.414178986 0.000000000
375 O Up spin Down spin Sum Diff
multiple
s 0 0.893870943 0.893870943 1.787741885 0.000000000
sum over m 0.893870943 0.893870943 1.787741885 0.000000000
s 1 -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m+mul 0.890828329 0.890828329 1.781656659 0.000000000
px 0 0.786897585 0.786897585 1.573795169 0.000000000
py 0 0.786994694 0.786994694 1.573989387 0.000000000
pz 0 0.779811673 0.779811673 1.559623345 0.000000000
sum over m 2.353703951 2.353703951 4.707407901 0.000000000
px 1 -0.008737807 -0.008737807 -0.017475614 0.000000000
py 1 -0.008732950 -0.008732950 -0.017465899 0.000000000
pz 1 -0.006463991 -0.006463991 -0.012927982 0.000000000
sum over m -0.023934748 -0.023934748 -0.047869495 0.000000000
sum over m+mul 2.329769203 2.329769203 4.659538406 0.000000000
d3z^2-r^2 0 -0.006389251 -0.006389251 -0.012778503 0.000000000
dx^2-y^2 0 -0.005059228 -0.005059228 -0.010118457 0.000000000
dxy 0 -0.005432622 -0.005432622 -0.010865243 0.000000000
dxz 0 -0.006931230 -0.006931230 -0.013862459 0.000000000
dyz 0 -0.006930964 -0.006930964 -0.013861928 0.000000000
sum over m -0.030743295 -0.030743295 -0.061486591 0.000000000
sum over m+mul -0.030743295 -0.030743295 -0.061486591 0.000000000
376 O Up spin Down spin Sum Diff
multiple
s 0 0.893906891 0.893906891 1.787813783 0.000000000
sum over m 0.893906891 0.893906891 1.787813783 0.000000000
s 1 -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m+mul 0.890864516 0.890864516 1.781729032 0.000000000
px 0 0.787136278 0.787136278 1.574272556 0.000000000
py 0 0.786887384 0.786887384 1.573774769 0.000000000
pz 0 0.779756985 0.779756985 1.559513971 0.000000000
sum over m 2.353780648 2.353780648 4.707561295 0.000000000
px 1 -0.008746839 -0.008746839 -0.017493677 0.000000000
py 1 -0.008733754 -0.008733754 -0.017467508 0.000000000
pz 1 -0.006460947 -0.006460947 -0.012921894 0.000000000
sum over m -0.023941540 -0.023941540 -0.047883080 0.000000000
sum over m+mul 2.329839108 2.329839108 4.659678216 0.000000000
d3z^2-r^2 0 -0.006390928 -0.006390928 -0.012781856 0.000000000
dx^2-y^2 0 -0.005057555 -0.005057555 -0.010115110 0.000000000
dxy 0 -0.005435139 -0.005435139 -0.010870279 0.000000000
dxz 0 -0.006925167 -0.006925167 -0.013850334 0.000000000
dyz 0 -0.006932324 -0.006932324 -0.013864649 0.000000000
sum over m -0.030741114 -0.030741114 -0.061482227 0.000000000
sum over m+mul -0.030741114 -0.030741114 -0.061482227 0.000000000
377 O Up spin Down spin Sum Diff
multiple
s 0 0.893867015 0.893867015 1.787734031 0.000000000
sum over m 0.893867015 0.893867015 1.787734031 0.000000000
s 1 -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m+mul 0.890824536 0.890824536 1.781649071 0.000000000
px 0 0.786842942 0.786842942 1.573685885 0.000000000
py 0 0.787005555 0.787005555 1.574011111 0.000000000
pz 0 0.779835772 0.779835772 1.559671543 0.000000000
sum over m 2.353684269 2.353684269 4.707368539 0.000000000
px 1 -0.008738661 -0.008738661 -0.017477321 0.000000000
py 1 -0.008736010 -0.008736010 -0.017472019 0.000000000
pz 1 -0.006464666 -0.006464666 -0.012929332 0.000000000
sum over m -0.023939336 -0.023939336 -0.047878672 0.000000000
sum over m+mul 2.329744933 2.329744933 4.659489866 0.000000000
d3z^2-r^2 0 -0.006389283 -0.006389283 -0.012778566 0.000000000
dx^2-y^2 0 -0.005060255 -0.005060255 -0.010120510 0.000000000
dxy 0 -0.005432451 -0.005432451 -0.010864901 0.000000000
dxz 0 -0.006933671 -0.006933671 -0.013867342 0.000000000
dyz 0 -0.006931778 -0.006931778 -0.013863555 0.000000000
sum over m -0.030747437 -0.030747437 -0.061494874 0.000000000
sum over m+mul -0.030747437 -0.030747437 -0.061494874 0.000000000
378 O Up spin Down spin Sum Diff
multiple
s 0 0.893899160 0.893899160 1.787798320 0.000000000
sum over m 0.893899160 0.893899160 1.787798320 0.000000000
s 1 -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m+mul 0.890856653 0.890856653 1.781713306 0.000000000
px 0 0.787022915 0.787022915 1.574045829 0.000000000
py 0 0.787024779 0.787024779 1.574049559 0.000000000
pz 0 0.779715302 0.779715302 1.559430604 0.000000000
sum over m 2.353762996 2.353762996 4.707525993 0.000000000
px 1 -0.008735679 -0.008735679 -0.017471358 0.000000000
py 1 -0.008731049 -0.008731049 -0.017462099 0.000000000
pz 1 -0.006456234 -0.006456234 -0.012912467 0.000000000
sum over m -0.023922962 -0.023922962 -0.047845924 0.000000000
sum over m+mul 2.329840034 2.329840034 4.659680068 0.000000000
d3z^2-r^2 0 -0.006389845 -0.006389845 -0.012779690 0.000000000
dx^2-y^2 0 -0.005054723 -0.005054723 -0.010109447 0.000000000
dxy 0 -0.005435254 -0.005435254 -0.010870509 0.000000000
dxz 0 -0.006924412 -0.006924412 -0.013848825 0.000000000
dyz 0 -0.006927007 -0.006927007 -0.013854014 0.000000000
sum over m -0.030731242 -0.030731242 -0.061462485 0.000000000
sum over m+mul -0.030731242 -0.030731242 -0.061462485 0.000000000
379 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000784858 1.000784858 2.001569716 0.000000000
sum over m 1.000784858 1.000784858 2.001569716 0.000000000
s 1 0.207406430 0.207406430 0.414812860 0.000000000
sum over m 0.207406430 0.207406430 0.414812860 0.000000000
s 2 0.014723064 0.014723064 0.029446129 0.000000000
sum over m 0.014723064 0.014723064 0.029446129 0.000000000
sum over m+mul 1.222914352 1.222914352 2.445828704 0.000000000
px 0 1.006381732 1.006381732 2.012763464 0.000000000
py 0 1.006363600 1.006363600 2.012727200 0.000000000
pz 0 1.006198562 1.006198562 2.012397125 0.000000000
sum over m 3.018943894 3.018943894 6.037887789 0.000000000
px 1 0.065428221 0.065428221 0.130856442 0.000000000
py 1 0.065442820 0.065442820 0.130885640 0.000000000
pz 1 0.040368160 0.040368160 0.080736319 0.000000000
sum over m 0.171239200 0.171239200 0.342478401 0.000000000
sum over m+mul 3.190183095 3.190183095 6.380366190 0.000000000
d3z^2-r^2 0 0.196306152 0.196306152 0.392612303 0.000000000
dx^2-y^2 0 0.201515767 0.201515767 0.403031535 0.000000000
dxy 0 0.250939758 0.250939758 0.501879517 0.000000000
dxz 0 0.268483614 0.268483614 0.536967227 0.000000000
dyz 0 0.268506732 0.268506732 0.537013464 0.000000000
sum over m 1.185752023 1.185752023 2.371504046 0.000000000
d3z^2-r^2 1 0.003471637 0.003471637 0.006943275 0.000000000
dx^2-y^2 1 -0.004480560 -0.004480560 -0.008961121 0.000000000
dxy 1 0.015341408 0.015341408 0.030682816 0.000000000
dxz 1 0.003487605 0.003487605 0.006975210 0.000000000
dyz 1 0.003488934 0.003488934 0.006977868 0.000000000
sum over m 0.021309024 0.021309024 0.042618048 0.000000000
sum over m+mul 1.207061047 1.207061047 2.414122094 0.000000000
380 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000783643 1.000783643 2.001567285 0.000000000
sum over m 1.000783643 1.000783643 2.001567285 0.000000000
s 1 0.207408351 0.207408351 0.414816702 0.000000000
sum over m 0.207408351 0.207408351 0.414816702 0.000000000
s 2 0.014721554 0.014721554 0.029443107 0.000000000
sum over m 0.014721554 0.014721554 0.029443107 0.000000000
sum over m+mul 1.222913547 1.222913547 2.445827094 0.000000000
px 0 1.006384949 1.006384949 2.012769898 0.000000000
py 0 1.006375218 1.006375218 2.012750436 0.000000000
pz 0 1.006197785 1.006197785 2.012395570 0.000000000
sum over m 3.018957952 3.018957952 6.037915903 0.000000000
px 1 0.065427635 0.065427635 0.130855270 0.000000000
py 1 0.065438475 0.065438475 0.130876949 0.000000000
pz 1 0.040371962 0.040371962 0.080743925 0.000000000
sum over m 0.171238072 0.171238072 0.342476144 0.000000000
sum over m+mul 3.190196024 3.190196024 6.380392048 0.000000000
d3z^2-r^2 0 0.196324306 0.196324306 0.392648612 0.000000000
dx^2-y^2 0 0.201532272 0.201532272 0.403064545 0.000000000
dxy 0 0.250936209 0.250936209 0.501872419 0.000000000
dxz 0 0.268484247 0.268484247 0.536968494 0.000000000
dyz 0 0.268490663 0.268490663 0.536981326 0.000000000
sum over m 1.185767697 1.185767697 2.371535395 0.000000000
d3z^2-r^2 1 0.003473111 0.003473111 0.006946223 0.000000000
dx^2-y^2 1 -0.004482190 -0.004482190 -0.008964380 0.000000000
dxy 1 0.015344359 0.015344359 0.030688718 0.000000000
dxz 1 0.003493350 0.003493350 0.006986700 0.000000000
dyz 1 0.003494209 0.003494209 0.006988418 0.000000000
sum over m 0.021322840 0.021322840 0.042645679 0.000000000
sum over m+mul 1.207090537 1.207090537 2.414181074 0.000000000
381 O Up spin Down spin Sum Diff
multiple
s 0 0.893901335 0.893901335 1.787802670 0.000000000
sum over m 0.893901335 0.893901335 1.787802670 0.000000000
s 1 -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m+mul 0.890859315 0.890859315 1.781718630 0.000000000
px 0 0.786866759 0.786866759 1.573733517 0.000000000
py 0 0.787114197 0.787114197 1.574228393 0.000000000
pz 0 0.779754467 0.779754467 1.559508933 0.000000000
sum over m 2.353735422 2.353735422 4.707470844 0.000000000
px 1 -0.008738330 -0.008738330 -0.017476661 0.000000000
py 1 -0.008742321 -0.008742321 -0.017484643 0.000000000
pz 1 -0.006463117 -0.006463117 -0.012926233 0.000000000
sum over m -0.023943768 -0.023943768 -0.047887537 0.000000000
sum over m+mul 2.329791653 2.329791653 4.659583307 0.000000000
d3z^2-r^2 0 -0.006391142 -0.006391142 -0.012782285 0.000000000
dx^2-y^2 0 -0.005057147 -0.005057147 -0.010114295 0.000000000
dxy 0 -0.005434410 -0.005434410 -0.010868819 0.000000000
dxz 0 -0.006929891 -0.006929891 -0.013859782 0.000000000
dyz 0 -0.006926802 -0.006926802 -0.013853605 0.000000000
sum over m -0.030739393 -0.030739393 -0.061478786 0.000000000
sum over m+mul -0.030739393 -0.030739393 -0.061478786 0.000000000
382 O Up spin Down spin Sum Diff
multiple
s 0 0.893909360 0.893909360 1.787818719 0.000000000
sum over m 0.893909360 0.893909360 1.787818719 0.000000000
s 1 -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m+mul 0.890867990 0.890867990 1.781735980 0.000000000
px 0 0.787144557 0.787144557 1.574289115 0.000000000
py 0 0.786826014 0.786826014 1.573652027 0.000000000
pz 0 0.779778083 0.779778083 1.559556165 0.000000000
sum over m 2.353748654 2.353748654 4.707497307 0.000000000
px 1 -0.008747399 -0.008747399 -0.017494798 0.000000000
py 1 -0.008734595 -0.008734595 -0.017469191 0.000000000
pz 1 -0.006462482 -0.006462482 -0.012924964 0.000000000
sum over m -0.023944477 -0.023944477 -0.047888953 0.000000000
sum over m+mul 2.329804177 2.329804177 4.659608354 0.000000000
d3z^2-r^2 0 -0.006392050 -0.006392050 -0.012784100 0.000000000
dx^2-y^2 0 -0.005058247 -0.005058247 -0.010116495 0.000000000
dxy 0 -0.005435091 -0.005435091 -0.010870182 0.000000000
dxz 0 -0.006926612 -0.006926612 -0.013853224 0.000000000
dyz 0 -0.006932038 -0.006932038 -0.013864076 0.000000000
sum over m -0.030744038 -0.030744038 -0.061488077 0.000000000
sum over m+mul -0.030744038 -0.030744038 -0.061488077 0.000000000
383 O Up spin Down spin Sum Diff
multiple
s 0 0.893846619 0.893846619 1.787693237 0.000000000
sum over m 0.893846619 0.893846619 1.787693237 0.000000000
s 1 -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m+mul 0.890804808 0.890804808 1.781609615 0.000000000
px 0 0.786881028 0.786881028 1.573762057 0.000000000
py 0 0.786881619 0.786881619 1.573763237 0.000000000
pz 0 0.779895839 0.779895839 1.559791679 0.000000000
sum over m 2.353658486 2.353658486 4.707316973 0.000000000
px 1 -0.008730718 -0.008730718 -0.017461435 0.000000000
py 1 -0.008727087 -0.008727087 -0.017454174 0.000000000
pz 1 -0.006467591 -0.006467591 -0.012935183 0.000000000
sum over m -0.023925396 -0.023925396 -0.047850792 0.000000000
sum over m+mul 2.329733091 2.329733091 4.659466181 0.000000000
d3z^2-r^2 0 -0.006389848 -0.006389848 -0.012779696 0.000000000
dx^2-y^2 0 -0.005061427 -0.005061427 -0.010122854 0.000000000
dxy 0 -0.005432516 -0.005432516 -0.010865032 0.000000000
dxz 0 -0.006934084 -0.006934084 -0.013868168 0.000000000
dyz 0 -0.006934596 -0.006934596 -0.013869192 0.000000000
sum over m -0.030752471 -0.030752471 -0.061504941 0.000000000
sum over m+mul -0.030752471 -0.030752471 -0.061504941 0.000000000
384 O Up spin Down spin Sum Diff
multiple
s 0 0.893910980 0.893910980 1.787821961 0.000000000
sum over m 0.893910980 0.893910980 1.787821961 0.000000000
s 1 -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m+mul 0.890868828 0.890868828 1.781737657 0.000000000
px 0 0.787000538 0.787000538 1.574001076 0.000000000
py 0 0.787056163 0.787056163 1.574112326 0.000000000
pz 0 0.779693219 0.779693219 1.559386438 0.000000000
sum over m 2.353749920 2.353749920 4.707499839 0.000000000
px 1 -0.008736984 -0.008736984 -0.017473968 0.000000000
py 1 -0.008736779 -0.008736779 -0.017473557 0.000000000
pz 1 -0.006460979 -0.006460979 -0.012921957 0.000000000
sum over m -0.023934741 -0.023934741 -0.047869482 0.000000000
sum over m+mul 2.329815178 2.329815178 4.659630357 0.000000000
d3z^2-r^2 0 -0.006391148 -0.006391148 -0.012782297 0.000000000
dx^2-y^2 0 -0.005053457 -0.005053457 -0.010106915 0.000000000
dxy 0 -0.005434790 -0.005434790 -0.010869579 0.000000000
dxz 0 -0.006925110 -0.006925110 -0.013850220 0.000000000
dyz 0 -0.006924704 -0.006924704 -0.013849407 0.000000000
sum over m -0.030729209 -0.030729209 -0.061458417 0.000000000
sum over m+mul -0.030729209 -0.030729209 -0.061458417 0.000000000
385 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000784858 1.000784858 2.001569716 0.000000000
sum over m 1.000784858 1.000784858 2.001569716 0.000000000
s 1 0.207406430 0.207406430 0.414812860 0.000000000
sum over m 0.207406430 0.207406430 0.414812860 0.000000000
s 2 0.014723064 0.014723064 0.029446129 0.000000000
sum over m 0.014723064 0.014723064 0.029446129 0.000000000
sum over m+mul 1.222914352 1.222914352 2.445828704 0.000000000
px 0 1.006381732 1.006381732 2.012763464 0.000000000
py 0 1.006363600 1.006363600 2.012727200 0.000000000
pz 0 1.006198562 1.006198562 2.012397125 0.000000000
sum over m 3.018943894 3.018943894 6.037887789 0.000000000
px 1 0.065428221 0.065428221 0.130856442 0.000000000
py 1 0.065442820 0.065442820 0.130885641 0.000000000
pz 1 0.040368160 0.040368160 0.080736319 0.000000000
sum over m 0.171239201 0.171239201 0.342478402 0.000000000
sum over m+mul 3.190183095 3.190183095 6.380366191 0.000000000
d3z^2-r^2 0 0.196306152 0.196306152 0.392612304 0.000000000
dx^2-y^2 0 0.201515767 0.201515767 0.403031534 0.000000000
dxy 0 0.250939758 0.250939758 0.501879517 0.000000000
dxz 0 0.268483614 0.268483614 0.536967227 0.000000000
dyz 0 0.268506732 0.268506732 0.537013463 0.000000000
sum over m 1.185752023 1.185752023 2.371504045 0.000000000
d3z^2-r^2 1 0.003471637 0.003471637 0.006943275 0.000000000
dx^2-y^2 1 -0.004480560 -0.004480560 -0.008961121 0.000000000
dxy 1 0.015341408 0.015341408 0.030682816 0.000000000
dxz 1 0.003487605 0.003487605 0.006975210 0.000000000
dyz 1 0.003488934 0.003488934 0.006977868 0.000000000
sum over m 0.021309024 0.021309024 0.042618048 0.000000000
sum over m+mul 1.207061047 1.207061047 2.414122093 0.000000000
386 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000783643 1.000783643 2.001567285 0.000000000
sum over m 1.000783643 1.000783643 2.001567285 0.000000000
s 1 0.207408351 0.207408351 0.414816702 0.000000000
sum over m 0.207408351 0.207408351 0.414816702 0.000000000
s 2 0.014721554 0.014721554 0.029443107 0.000000000
sum over m 0.014721554 0.014721554 0.029443107 0.000000000
sum over m+mul 1.222913547 1.222913547 2.445827094 0.000000000
px 0 1.006384949 1.006384949 2.012769898 0.000000000
py 0 1.006375218 1.006375218 2.012750436 0.000000000
pz 0 1.006197785 1.006197785 2.012395570 0.000000000
sum over m 3.018957952 3.018957952 6.037915903 0.000000000
px 1 0.065427635 0.065427635 0.130855269 0.000000000
py 1 0.065438475 0.065438475 0.130876949 0.000000000
pz 1 0.040371962 0.040371962 0.080743925 0.000000000
sum over m 0.171238071 0.171238071 0.342476143 0.000000000
sum over m+mul 3.190196023 3.190196023 6.380392046 0.000000000
d3z^2-r^2 0 0.196324306 0.196324306 0.392648612 0.000000000
dx^2-y^2 0 0.201532272 0.201532272 0.403064545 0.000000000
dxy 0 0.250936209 0.250936209 0.501872419 0.000000000
dxz 0 0.268484247 0.268484247 0.536968494 0.000000000
dyz 0 0.268490663 0.268490663 0.536981326 0.000000000
sum over m 1.185767698 1.185767698 2.371535395 0.000000000
d3z^2-r^2 1 0.003473111 0.003473111 0.006946223 0.000000000
dx^2-y^2 1 -0.004482190 -0.004482190 -0.008964379 0.000000000
dxy 1 0.015344359 0.015344359 0.030688718 0.000000000
dxz 1 0.003493350 0.003493350 0.006986700 0.000000000
dyz 1 0.003494209 0.003494209 0.006988418 0.000000000
sum over m 0.021322840 0.021322840 0.042645680 0.000000000
sum over m+mul 1.207090537 1.207090537 2.414181075 0.000000000
387 O Up spin Down spin Sum Diff
multiple
s 0 0.893901335 0.893901335 1.787802670 0.000000000
sum over m 0.893901335 0.893901335 1.787802670 0.000000000
s 1 -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m+mul 0.890859315 0.890859315 1.781718630 0.000000000
px 0 0.786866759 0.786866759 1.573733517 0.000000000
py 0 0.787114197 0.787114197 1.574228393 0.000000000
pz 0 0.779754467 0.779754467 1.559508933 0.000000000
sum over m 2.353735422 2.353735422 4.707470844 0.000000000
px 1 -0.008738330 -0.008738330 -0.017476661 0.000000000
py 1 -0.008742321 -0.008742321 -0.017484643 0.000000000
pz 1 -0.006463117 -0.006463117 -0.012926233 0.000000000
sum over m -0.023943768 -0.023943768 -0.047887536 0.000000000
sum over m+mul 2.329791654 2.329791654 4.659583307 0.000000000
d3z^2-r^2 0 -0.006391142 -0.006391142 -0.012782285 0.000000000
dx^2-y^2 0 -0.005057147 -0.005057147 -0.010114295 0.000000000
dxy 0 -0.005434410 -0.005434410 -0.010868819 0.000000000
dxz 0 -0.006929891 -0.006929891 -0.013859782 0.000000000
dyz 0 -0.006926802 -0.006926802 -0.013853605 0.000000000
sum over m -0.030739393 -0.030739393 -0.061478786 0.000000000
sum over m+mul -0.030739393 -0.030739393 -0.061478786 0.000000000
388 O Up spin Down spin Sum Diff
multiple
s 0 0.893909360 0.893909360 1.787818719 0.000000000
sum over m 0.893909360 0.893909360 1.787818719 0.000000000
s 1 -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m+mul 0.890867990 0.890867990 1.781735980 0.000000000
px 0 0.787144558 0.787144558 1.574289115 0.000000000
py 0 0.786826014 0.786826014 1.573652028 0.000000000
pz 0 0.779778083 0.779778083 1.559556166 0.000000000
sum over m 2.353748654 2.353748654 4.707497308 0.000000000
px 1 -0.008747399 -0.008747399 -0.017494798 0.000000000
py 1 -0.008734595 -0.008734595 -0.017469191 0.000000000
pz 1 -0.006462482 -0.006462482 -0.012924964 0.000000000
sum over m -0.023944477 -0.023944477 -0.047888954 0.000000000
sum over m+mul 2.329804177 2.329804177 4.659608355 0.000000000
d3z^2-r^2 0 -0.006392050 -0.006392050 -0.012784100 0.000000000
dx^2-y^2 0 -0.005058247 -0.005058247 -0.010116495 0.000000000
dxy 0 -0.005435091 -0.005435091 -0.010870182 0.000000000
dxz 0 -0.006926612 -0.006926612 -0.013853224 0.000000000
dyz 0 -0.006932038 -0.006932038 -0.013864076 0.000000000
sum over m -0.030744038 -0.030744038 -0.061488076 0.000000000
sum over m+mul -0.030744038 -0.030744038 -0.061488076 0.000000000
389 O Up spin Down spin Sum Diff
multiple
s 0 0.893846619 0.893846619 1.787693237 0.000000000
sum over m 0.893846619 0.893846619 1.787693237 0.000000000
s 1 -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m+mul 0.890804808 0.890804808 1.781609615 0.000000000
px 0 0.786881028 0.786881028 1.573762057 0.000000000
py 0 0.786881618 0.786881618 1.573763237 0.000000000
pz 0 0.779895839 0.779895839 1.559791679 0.000000000
sum over m 2.353658486 2.353658486 4.707316972 0.000000000
px 1 -0.008730718 -0.008730718 -0.017461435 0.000000000
py 1 -0.008727087 -0.008727087 -0.017454174 0.000000000
pz 1 -0.006467591 -0.006467591 -0.012935183 0.000000000
sum over m -0.023925396 -0.023925396 -0.047850792 0.000000000
sum over m+mul 2.329733090 2.329733090 4.659466181 0.000000000
d3z^2-r^2 0 -0.006389848 -0.006389848 -0.012779696 0.000000000
dx^2-y^2 0 -0.005061427 -0.005061427 -0.010122854 0.000000000
dxy 0 -0.005432516 -0.005432516 -0.010865032 0.000000000
dxz 0 -0.006934084 -0.006934084 -0.013868168 0.000000000
dyz 0 -0.006934596 -0.006934596 -0.013869192 0.000000000
sum over m -0.030752471 -0.030752471 -0.061504941 0.000000000
sum over m+mul -0.030752471 -0.030752471 -0.061504941 0.000000000
390 O Up spin Down spin Sum Diff
multiple
s 0 0.893910980 0.893910980 1.787821961 0.000000000
sum over m 0.893910980 0.893910980 1.787821961 0.000000000
s 1 -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m+mul 0.890868828 0.890868828 1.781737657 0.000000000
px 0 0.787000538 0.787000538 1.574001076 0.000000000
py 0 0.787056163 0.787056163 1.574112326 0.000000000
pz 0 0.779693219 0.779693219 1.559386438 0.000000000
sum over m 2.353749920 2.353749920 4.707499840 0.000000000
px 1 -0.008736984 -0.008736984 -0.017473968 0.000000000
py 1 -0.008736779 -0.008736779 -0.017473557 0.000000000
pz 1 -0.006460979 -0.006460979 -0.012921957 0.000000000
sum over m -0.023934741 -0.023934741 -0.047869482 0.000000000
sum over m+mul 2.329815179 2.329815179 4.659630358 0.000000000
d3z^2-r^2 0 -0.006391148 -0.006391148 -0.012782297 0.000000000
dx^2-y^2 0 -0.005053457 -0.005053457 -0.010106915 0.000000000
dxy 0 -0.005434790 -0.005434790 -0.010869579 0.000000000
dxz 0 -0.006925110 -0.006925110 -0.013850219 0.000000000
dyz 0 -0.006924704 -0.006924704 -0.013849407 0.000000000
sum over m -0.030729209 -0.030729209 -0.061458417 0.000000000
sum over m+mul -0.030729209 -0.030729209 -0.061458417 0.000000000
391 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000784858 1.000784858 2.001569716 0.000000000
sum over m 1.000784858 1.000784858 2.001569716 0.000000000
s 1 0.207406430 0.207406430 0.414812860 0.000000000
sum over m 0.207406430 0.207406430 0.414812860 0.000000000
s 2 0.014723064 0.014723064 0.029446129 0.000000000
sum over m 0.014723064 0.014723064 0.029446129 0.000000000
sum over m+mul 1.222914352 1.222914352 2.445828704 0.000000000
px 0 1.006381732 1.006381732 2.012763464 0.000000000
py 0 1.006363600 1.006363600 2.012727200 0.000000000
pz 0 1.006198562 1.006198562 2.012397125 0.000000000
sum over m 3.018943894 3.018943894 6.037887789 0.000000000
px 1 0.065428221 0.065428221 0.130856442 0.000000000
py 1 0.065442820 0.065442820 0.130885641 0.000000000
pz 1 0.040368160 0.040368160 0.080736319 0.000000000
sum over m 0.171239201 0.171239201 0.342478402 0.000000000
sum over m+mul 3.190183095 3.190183095 6.380366191 0.000000000
d3z^2-r^2 0 0.196306152 0.196306152 0.392612304 0.000000000
dx^2-y^2 0 0.201515767 0.201515767 0.403031534 0.000000000
dxy 0 0.250939759 0.250939759 0.501879517 0.000000000
dxz 0 0.268483613 0.268483613 0.536967227 0.000000000
dyz 0 0.268506731 0.268506731 0.537013463 0.000000000
sum over m 1.185752022 1.185752022 2.371504045 0.000000000
d3z^2-r^2 1 0.003471637 0.003471637 0.006943275 0.000000000
dx^2-y^2 1 -0.004480560 -0.004480560 -0.008961121 0.000000000
dxy 1 0.015341408 0.015341408 0.030682816 0.000000000
dxz 1 0.003487605 0.003487605 0.006975210 0.000000000
dyz 1 0.003488934 0.003488934 0.006977868 0.000000000
sum over m 0.021309024 0.021309024 0.042618048 0.000000000
sum over m+mul 1.207061047 1.207061047 2.414122093 0.000000000
392 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000783643 1.000783643 2.001567285 0.000000000
sum over m 1.000783643 1.000783643 2.001567285 0.000000000
s 1 0.207408351 0.207408351 0.414816702 0.000000000
sum over m 0.207408351 0.207408351 0.414816702 0.000000000
s 2 0.014721554 0.014721554 0.029443107 0.000000000
sum over m 0.014721554 0.014721554 0.029443107 0.000000000
sum over m+mul 1.222913547 1.222913547 2.445827094 0.000000000
px 0 1.006384949 1.006384949 2.012769898 0.000000000
py 0 1.006375218 1.006375218 2.012750436 0.000000000
pz 0 1.006197785 1.006197785 2.012395569 0.000000000
sum over m 3.018957952 3.018957952 6.037915903 0.000000000
px 1 0.065427635 0.065427635 0.130855269 0.000000000
py 1 0.065438474 0.065438474 0.130876949 0.000000000
pz 1 0.040371962 0.040371962 0.080743925 0.000000000
sum over m 0.171238071 0.171238071 0.342476143 0.000000000
sum over m+mul 3.190196023 3.190196023 6.380392046 0.000000000
d3z^2-r^2 0 0.196324306 0.196324306 0.392648612 0.000000000
dx^2-y^2 0 0.201532272 0.201532272 0.403064544 0.000000000
dxy 0 0.250936209 0.250936209 0.501872418 0.000000000
dxz 0 0.268484247 0.268484247 0.536968494 0.000000000
dyz 0 0.268490663 0.268490663 0.536981326 0.000000000
sum over m 1.185767697 1.185767697 2.371535394 0.000000000
d3z^2-r^2 1 0.003473111 0.003473111 0.006946223 0.000000000
dx^2-y^2 1 -0.004482190 -0.004482190 -0.008964380 0.000000000
dxy 1 0.015344359 0.015344359 0.030688718 0.000000000
dxz 1 0.003493350 0.003493350 0.006986700 0.000000000
dyz 1 0.003494209 0.003494209 0.006988418 0.000000000
sum over m 0.021322840 0.021322840 0.042645679 0.000000000
sum over m+mul 1.207090536 1.207090536 2.414181073 0.000000000
393 O Up spin Down spin Sum Diff
multiple
s 0 0.893901335 0.893901335 1.787802670 0.000000000
sum over m 0.893901335 0.893901335 1.787802670 0.000000000
s 1 -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m+mul 0.890859315 0.890859315 1.781718630 0.000000000
px 0 0.786866759 0.786866759 1.573733517 0.000000000
py 0 0.787114197 0.787114197 1.574228393 0.000000000
pz 0 0.779754467 0.779754467 1.559508933 0.000000000
sum over m 2.353735422 2.353735422 4.707470844 0.000000000
px 1 -0.008738330 -0.008738330 -0.017476661 0.000000000
py 1 -0.008742321 -0.008742321 -0.017484643 0.000000000
pz 1 -0.006463117 -0.006463117 -0.012926233 0.000000000
sum over m -0.023943768 -0.023943768 -0.047887536 0.000000000
sum over m+mul 2.329791654 2.329791654 4.659583307 0.000000000
d3z^2-r^2 0 -0.006391142 -0.006391142 -0.012782285 0.000000000
dx^2-y^2 0 -0.005057147 -0.005057147 -0.010114295 0.000000000
dxy 0 -0.005434410 -0.005434410 -0.010868819 0.000000000
dxz 0 -0.006929891 -0.006929891 -0.013859782 0.000000000
dyz 0 -0.006926802 -0.006926802 -0.013853605 0.000000000
sum over m -0.030739393 -0.030739393 -0.061478786 0.000000000
sum over m+mul -0.030739393 -0.030739393 -0.061478786 0.000000000
394 O Up spin Down spin Sum Diff
multiple
s 0 0.893909360 0.893909360 1.787818719 0.000000000
sum over m 0.893909360 0.893909360 1.787818719 0.000000000
s 1 -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m+mul 0.890867990 0.890867990 1.781735980 0.000000000
px 0 0.787144558 0.787144558 1.574289115 0.000000000
py 0 0.786826014 0.786826014 1.573652028 0.000000000
pz 0 0.779778083 0.779778083 1.559556166 0.000000000
sum over m 2.353748654 2.353748654 4.707497308 0.000000000
px 1 -0.008747399 -0.008747399 -0.017494798 0.000000000
py 1 -0.008734595 -0.008734595 -0.017469191 0.000000000
pz 1 -0.006462482 -0.006462482 -0.012924964 0.000000000
sum over m -0.023944477 -0.023944477 -0.047888953 0.000000000
sum over m+mul 2.329804178 2.329804178 4.659608355 0.000000000
d3z^2-r^2 0 -0.006392050 -0.006392050 -0.012784100 0.000000000
dx^2-y^2 0 -0.005058247 -0.005058247 -0.010116495 0.000000000
dxy 0 -0.005435091 -0.005435091 -0.010870182 0.000000000
dxz 0 -0.006926612 -0.006926612 -0.013853224 0.000000000
dyz 0 -0.006932038 -0.006932038 -0.013864076 0.000000000
sum over m -0.030744038 -0.030744038 -0.061488076 0.000000000
sum over m+mul -0.030744038 -0.030744038 -0.061488076 0.000000000
395 O Up spin Down spin Sum Diff
multiple
s 0 0.893846619 0.893846619 1.787693238 0.000000000
sum over m 0.893846619 0.893846619 1.787693238 0.000000000
s 1 -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m+mul 0.890804808 0.890804808 1.781609616 0.000000000
px 0 0.786881028 0.786881028 1.573762057 0.000000000
py 0 0.786881619 0.786881619 1.573763237 0.000000000
pz 0 0.779895839 0.779895839 1.559791679 0.000000000
sum over m 2.353658486 2.353658486 4.707316973 0.000000000
px 1 -0.008730718 -0.008730718 -0.017461435 0.000000000
py 1 -0.008727087 -0.008727087 -0.017454174 0.000000000
pz 1 -0.006467591 -0.006467591 -0.012935183 0.000000000
sum over m -0.023925396 -0.023925396 -0.047850792 0.000000000
sum over m+mul 2.329733091 2.329733091 4.659466181 0.000000000
d3z^2-r^2 0 -0.006389848 -0.006389848 -0.012779696 0.000000000
dx^2-y^2 0 -0.005061427 -0.005061427 -0.010122854 0.000000000
dxy 0 -0.005432516 -0.005432516 -0.010865032 0.000000000
dxz 0 -0.006934084 -0.006934084 -0.013868168 0.000000000
dyz 0 -0.006934596 -0.006934596 -0.013869192 0.000000000
sum over m -0.030752471 -0.030752471 -0.061504941 0.000000000
sum over m+mul -0.030752471 -0.030752471 -0.061504941 0.000000000
396 O Up spin Down spin Sum Diff
multiple
s 0 0.893910980 0.893910980 1.787821961 0.000000000
sum over m 0.893910980 0.893910980 1.787821961 0.000000000
s 1 -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m+mul 0.890868828 0.890868828 1.781737657 0.000000000
px 0 0.787000538 0.787000538 1.574001076 0.000000000
py 0 0.787056163 0.787056163 1.574112326 0.000000000
pz 0 0.779693219 0.779693219 1.559386438 0.000000000
sum over m 2.353749920 2.353749920 4.707499839 0.000000000
px 1 -0.008736984 -0.008736984 -0.017473968 0.000000000
py 1 -0.008736779 -0.008736779 -0.017473557 0.000000000
pz 1 -0.006460979 -0.006460979 -0.012921957 0.000000000
sum over m -0.023934741 -0.023934741 -0.047869482 0.000000000
sum over m+mul 2.329815179 2.329815179 4.659630357 0.000000000
d3z^2-r^2 0 -0.006391148 -0.006391148 -0.012782297 0.000000000
dx^2-y^2 0 -0.005053457 -0.005053457 -0.010106915 0.000000000
dxy 0 -0.005434790 -0.005434790 -0.010869579 0.000000000
dxz 0 -0.006925110 -0.006925110 -0.013850219 0.000000000
dyz 0 -0.006924704 -0.006924704 -0.013849407 0.000000000
sum over m -0.030729209 -0.030729209 -0.061458417 0.000000000
sum over m+mul -0.030729209 -0.030729209 -0.061458417 0.000000000
397 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000784858 1.000784858 2.001569716 0.000000000
sum over m 1.000784858 1.000784858 2.001569716 0.000000000
s 1 0.207406430 0.207406430 0.414812860 0.000000000
sum over m 0.207406430 0.207406430 0.414812860 0.000000000
s 2 0.014723064 0.014723064 0.029446129 0.000000000
sum over m 0.014723064 0.014723064 0.029446129 0.000000000
sum over m+mul 1.222914352 1.222914352 2.445828704 0.000000000
px 0 1.006381732 1.006381732 2.012763464 0.000000000
py 0 1.006363600 1.006363600 2.012727200 0.000000000
pz 0 1.006198562 1.006198562 2.012397125 0.000000000
sum over m 3.018943894 3.018943894 6.037887789 0.000000000
px 1 0.065428221 0.065428221 0.130856442 0.000000000
py 1 0.065442820 0.065442820 0.130885641 0.000000000
pz 1 0.040368160 0.040368160 0.080736319 0.000000000
sum over m 0.171239201 0.171239201 0.342478402 0.000000000
sum over m+mul 3.190183095 3.190183095 6.380366191 0.000000000
d3z^2-r^2 0 0.196306152 0.196306152 0.392612304 0.000000000
dx^2-y^2 0 0.201515767 0.201515767 0.403031535 0.000000000
dxy 0 0.250939758 0.250939758 0.501879517 0.000000000
dxz 0 0.268483614 0.268483614 0.536967227 0.000000000
dyz 0 0.268506732 0.268506732 0.537013464 0.000000000
sum over m 1.185752023 1.185752023 2.371504046 0.000000000
d3z^2-r^2 1 0.003471637 0.003471637 0.006943275 0.000000000
dx^2-y^2 1 -0.004480560 -0.004480560 -0.008961121 0.000000000
dxy 1 0.015341408 0.015341408 0.030682816 0.000000000
dxz 1 0.003487605 0.003487605 0.006975210 0.000000000
dyz 1 0.003488934 0.003488934 0.006977868 0.000000000
sum over m 0.021309024 0.021309024 0.042618048 0.000000000
sum over m+mul 1.207061047 1.207061047 2.414122094 0.000000000
398 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000783643 1.000783643 2.001567285 0.000000000
sum over m 1.000783643 1.000783643 2.001567285 0.000000000
s 1 0.207408351 0.207408351 0.414816702 0.000000000
sum over m 0.207408351 0.207408351 0.414816702 0.000000000
s 2 0.014721554 0.014721554 0.029443107 0.000000000
sum over m 0.014721554 0.014721554 0.029443107 0.000000000
sum over m+mul 1.222913547 1.222913547 2.445827095 0.000000000
px 0 1.006384949 1.006384949 2.012769898 0.000000000
py 0 1.006375218 1.006375218 2.012750436 0.000000000
pz 0 1.006197785 1.006197785 2.012395569 0.000000000
sum over m 3.018957952 3.018957952 6.037915903 0.000000000
px 1 0.065427635 0.065427635 0.130855270 0.000000000
py 1 0.065438475 0.065438475 0.130876949 0.000000000
pz 1 0.040371962 0.040371962 0.080743925 0.000000000
sum over m 0.171238072 0.171238072 0.342476143 0.000000000
sum over m+mul 3.190196023 3.190196023 6.380392047 0.000000000
d3z^2-r^2 0 0.196324306 0.196324306 0.392648612 0.000000000
dx^2-y^2 0 0.201532272 0.201532272 0.403064544 0.000000000
dxy 0 0.250936209 0.250936209 0.501872419 0.000000000
dxz 0 0.268484248 0.268484248 0.536968495 0.000000000
dyz 0 0.268490663 0.268490663 0.536981326 0.000000000
sum over m 1.185767698 1.185767698 2.371535395 0.000000000
d3z^2-r^2 1 0.003473111 0.003473111 0.006946223 0.000000000
dx^2-y^2 1 -0.004482190 -0.004482190 -0.008964380 0.000000000
dxy 1 0.015344359 0.015344359 0.030688718 0.000000000
dxz 1 0.003493350 0.003493350 0.006986700 0.000000000
dyz 1 0.003494209 0.003494209 0.006988418 0.000000000
sum over m 0.021322840 0.021322840 0.042645679 0.000000000
sum over m+mul 1.207090537 1.207090537 2.414181075 0.000000000
399 O Up spin Down spin Sum Diff
multiple
s 0 0.893901335 0.893901335 1.787802670 0.000000000
sum over m 0.893901335 0.893901335 1.787802670 0.000000000
s 1 -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m+mul 0.890859315 0.890859315 1.781718630 0.000000000
px 0 0.786866759 0.786866759 1.573733517 0.000000000
py 0 0.787114197 0.787114197 1.574228394 0.000000000
pz 0 0.779754467 0.779754467 1.559508933 0.000000000
sum over m 2.353735422 2.353735422 4.707470844 0.000000000
px 1 -0.008738330 -0.008738330 -0.017476661 0.000000000
py 1 -0.008742321 -0.008742321 -0.017484643 0.000000000
pz 1 -0.006463117 -0.006463117 -0.012926233 0.000000000
sum over m -0.023943768 -0.023943768 -0.047887537 0.000000000
sum over m+mul 2.329791654 2.329791654 4.659583308 0.000000000
d3z^2-r^2 0 -0.006391142 -0.006391142 -0.012782285 0.000000000
dx^2-y^2 0 -0.005057147 -0.005057147 -0.010114295 0.000000000
dxy 0 -0.005434410 -0.005434410 -0.010868819 0.000000000
dxz 0 -0.006929891 -0.006929891 -0.013859782 0.000000000
dyz 0 -0.006926802 -0.006926802 -0.013853605 0.000000000
sum over m -0.030739393 -0.030739393 -0.061478786 0.000000000
sum over m+mul -0.030739393 -0.030739393 -0.061478786 0.000000000
400 O Up spin Down spin Sum Diff
multiple
s 0 0.893909360 0.893909360 1.787818719 0.000000000
sum over m 0.893909360 0.893909360 1.787818719 0.000000000
s 1 -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m+mul 0.890867990 0.890867990 1.781735980 0.000000000
px 0 0.787144557 0.787144557 1.574289115 0.000000000
py 0 0.786826014 0.786826014 1.573652028 0.000000000
pz 0 0.779778083 0.779778083 1.559556165 0.000000000
sum over m 2.353748654 2.353748654 4.707497307 0.000000000
px 1 -0.008747399 -0.008747399 -0.017494798 0.000000000
py 1 -0.008734596 -0.008734596 -0.017469191 0.000000000
pz 1 -0.006462482 -0.006462482 -0.012924964 0.000000000
sum over m -0.023944477 -0.023944477 -0.047888953 0.000000000
sum over m+mul 2.329804177 2.329804177 4.659608354 0.000000000
d3z^2-r^2 0 -0.006392050 -0.006392050 -0.012784100 0.000000000
dx^2-y^2 0 -0.005058247 -0.005058247 -0.010116495 0.000000000
dxy 0 -0.005435091 -0.005435091 -0.010870182 0.000000000
dxz 0 -0.006926612 -0.006926612 -0.013853224 0.000000000
dyz 0 -0.006932038 -0.006932038 -0.013864076 0.000000000
sum over m -0.030744038 -0.030744038 -0.061488076 0.000000000
sum over m+mul -0.030744038 -0.030744038 -0.061488076 0.000000000
401 O Up spin Down spin Sum Diff
multiple
s 0 0.893846619 0.893846619 1.787693237 0.000000000
sum over m 0.893846619 0.893846619 1.787693237 0.000000000
s 1 -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m+mul 0.890804808 0.890804808 1.781609615 0.000000000
px 0 0.786881029 0.786881029 1.573762057 0.000000000
py 0 0.786881618 0.786881618 1.573763237 0.000000000
pz 0 0.779895839 0.779895839 1.559791679 0.000000000
sum over m 2.353658486 2.353658486 4.707316973 0.000000000
px 1 -0.008730718 -0.008730718 -0.017461435 0.000000000
py 1 -0.008727087 -0.008727087 -0.017454174 0.000000000
pz 1 -0.006467591 -0.006467591 -0.012935183 0.000000000
sum over m -0.023925396 -0.023925396 -0.047850791 0.000000000
sum over m+mul 2.329733091 2.329733091 4.659466181 0.000000000
d3z^2-r^2 0 -0.006389848 -0.006389848 -0.012779696 0.000000000
dx^2-y^2 0 -0.005061427 -0.005061427 -0.010122854 0.000000000
dxy 0 -0.005432516 -0.005432516 -0.010865032 0.000000000
dxz 0 -0.006934084 -0.006934084 -0.013868168 0.000000000
dyz 0 -0.006934596 -0.006934596 -0.013869192 0.000000000
sum over m -0.030752471 -0.030752471 -0.061504941 0.000000000
sum over m+mul -0.030752471 -0.030752471 -0.061504941 0.000000000
402 O Up spin Down spin Sum Diff
multiple
s 0 0.893910980 0.893910980 1.787821961 0.000000000
sum over m 0.893910980 0.893910980 1.787821961 0.000000000
s 1 -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m+mul 0.890868828 0.890868828 1.781737657 0.000000000
px 0 0.787000538 0.787000538 1.574001076 0.000000000
py 0 0.787056163 0.787056163 1.574112326 0.000000000
pz 0 0.779693219 0.779693219 1.559386438 0.000000000
sum over m 2.353749920 2.353749920 4.707499840 0.000000000
px 1 -0.008736984 -0.008736984 -0.017473968 0.000000000
py 1 -0.008736779 -0.008736779 -0.017473557 0.000000000
pz 1 -0.006460979 -0.006460979 -0.012921957 0.000000000
sum over m -0.023934741 -0.023934741 -0.047869482 0.000000000
sum over m+mul 2.329815179 2.329815179 4.659630357 0.000000000
d3z^2-r^2 0 -0.006391148 -0.006391148 -0.012782297 0.000000000
dx^2-y^2 0 -0.005053457 -0.005053457 -0.010106915 0.000000000
dxy 0 -0.005434790 -0.005434790 -0.010869579 0.000000000
dxz 0 -0.006925110 -0.006925110 -0.013850219 0.000000000
dyz 0 -0.006924704 -0.006924704 -0.013849407 0.000000000
sum over m -0.030729209 -0.030729209 -0.061458417 0.000000000
sum over m+mul -0.030729209 -0.030729209 -0.061458417 0.000000000
403 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000784858 1.000784858 2.001569716 0.000000000
sum over m 1.000784858 1.000784858 2.001569716 0.000000000
s 1 0.207406430 0.207406430 0.414812860 0.000000000
sum over m 0.207406430 0.207406430 0.414812860 0.000000000
s 2 0.014723064 0.014723064 0.029446129 0.000000000
sum over m 0.014723064 0.014723064 0.029446129 0.000000000
sum over m+mul 1.222914352 1.222914352 2.445828704 0.000000000
px 0 1.006381732 1.006381732 2.012763463 0.000000000
py 0 1.006363600 1.006363600 2.012727200 0.000000000
pz 0 1.006198562 1.006198562 2.012397125 0.000000000
sum over m 3.018943894 3.018943894 6.037887788 0.000000000
px 1 0.065428221 0.065428221 0.130856442 0.000000000
py 1 0.065442820 0.065442820 0.130885640 0.000000000
pz 1 0.040368160 0.040368160 0.080736319 0.000000000
sum over m 0.171239201 0.171239201 0.342478401 0.000000000
sum over m+mul 3.190183095 3.190183095 6.380366190 0.000000000
d3z^2-r^2 0 0.196306152 0.196306152 0.392612304 0.000000000
dx^2-y^2 0 0.201515767 0.201515767 0.403031534 0.000000000
dxy 0 0.250939758 0.250939758 0.501879517 0.000000000
dxz 0 0.268483614 0.268483614 0.536967227 0.000000000
dyz 0 0.268506732 0.268506732 0.537013464 0.000000000
sum over m 1.185752023 1.185752023 2.371504046 0.000000000
d3z^2-r^2 1 0.003471637 0.003471637 0.006943275 0.000000000
dx^2-y^2 1 -0.004480560 -0.004480560 -0.008961121 0.000000000
dxy 1 0.015341408 0.015341408 0.030682816 0.000000000
dxz 1 0.003487605 0.003487605 0.006975210 0.000000000
dyz 1 0.003488934 0.003488934 0.006977868 0.000000000
sum over m 0.021309024 0.021309024 0.042618048 0.000000000
sum over m+mul 1.207061047 1.207061047 2.414122094 0.000000000
404 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000783643 1.000783643 2.001567285 0.000000000
sum over m 1.000783643 1.000783643 2.001567285 0.000000000
s 1 0.207408351 0.207408351 0.414816702 0.000000000
sum over m 0.207408351 0.207408351 0.414816702 0.000000000
s 2 0.014721554 0.014721554 0.029443107 0.000000000
sum over m 0.014721554 0.014721554 0.029443107 0.000000000
sum over m+mul 1.222913547 1.222913547 2.445827095 0.000000000
px 0 1.006384949 1.006384949 2.012769898 0.000000000
py 0 1.006375218 1.006375218 2.012750436 0.000000000
pz 0 1.006197785 1.006197785 2.012395569 0.000000000
sum over m 3.018957952 3.018957952 6.037915904 0.000000000
px 1 0.065427635 0.065427635 0.130855269 0.000000000
py 1 0.065438474 0.065438474 0.130876949 0.000000000
pz 1 0.040371962 0.040371962 0.080743925 0.000000000
sum over m 0.171238072 0.171238072 0.342476143 0.000000000
sum over m+mul 3.190196023 3.190196023 6.380392047 0.000000000
d3z^2-r^2 0 0.196324306 0.196324306 0.392648612 0.000000000
dx^2-y^2 0 0.201532272 0.201532272 0.403064545 0.000000000
dxy 0 0.250936209 0.250936209 0.501872418 0.000000000
dxz 0 0.268484247 0.268484247 0.536968495 0.000000000
dyz 0 0.268490663 0.268490663 0.536981326 0.000000000
sum over m 1.185767698 1.185767698 2.371535395 0.000000000
d3z^2-r^2 1 0.003473111 0.003473111 0.006946223 0.000000000
dx^2-y^2 1 -0.004482190 -0.004482190 -0.008964380 0.000000000
dxy 1 0.015344359 0.015344359 0.030688718 0.000000000
dxz 1 0.003493350 0.003493350 0.006986700 0.000000000
dyz 1 0.003494209 0.003494209 0.006988418 0.000000000
sum over m 0.021322840 0.021322840 0.042645679 0.000000000
sum over m+mul 1.207090537 1.207090537 2.414181074 0.000000000
405 O Up spin Down spin Sum Diff
multiple
s 0 0.893901335 0.893901335 1.787802671 0.000000000
sum over m 0.893901335 0.893901335 1.787802671 0.000000000
s 1 -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m+mul 0.890859315 0.890859315 1.781718630 0.000000000
px 0 0.786866759 0.786866759 1.573733517 0.000000000
py 0 0.787114197 0.787114197 1.574228393 0.000000000
pz 0 0.779754467 0.779754467 1.559508933 0.000000000
sum over m 2.353735422 2.353735422 4.707470844 0.000000000
px 1 -0.008738330 -0.008738330 -0.017476661 0.000000000
py 1 -0.008742321 -0.008742321 -0.017484643 0.000000000
pz 1 -0.006463117 -0.006463117 -0.012926233 0.000000000
sum over m -0.023943768 -0.023943768 -0.047887536 0.000000000
sum over m+mul 2.329791654 2.329791654 4.659583308 0.000000000
d3z^2-r^2 0 -0.006391142 -0.006391142 -0.012782285 0.000000000
dx^2-y^2 0 -0.005057147 -0.005057147 -0.010114295 0.000000000
dxy 0 -0.005434410 -0.005434410 -0.010868819 0.000000000
dxz 0 -0.006929891 -0.006929891 -0.013859782 0.000000000
dyz 0 -0.006926802 -0.006926802 -0.013853605 0.000000000
sum over m -0.030739393 -0.030739393 -0.061478786 0.000000000
sum over m+mul -0.030739393 -0.030739393 -0.061478786 0.000000000
406 O Up spin Down spin Sum Diff
multiple
s 0 0.893909360 0.893909360 1.787818719 0.000000000
sum over m 0.893909360 0.893909360 1.787818719 0.000000000
s 1 -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m+mul 0.890867990 0.890867990 1.781735980 0.000000000
px 0 0.787144558 0.787144558 1.574289115 0.000000000
py 0 0.786826014 0.786826014 1.573652027 0.000000000
pz 0 0.779778082 0.779778082 1.559556165 0.000000000
sum over m 2.353748654 2.353748654 4.707497307 0.000000000
px 1 -0.008747399 -0.008747399 -0.017494798 0.000000000
py 1 -0.008734595 -0.008734595 -0.017469191 0.000000000
pz 1 -0.006462482 -0.006462482 -0.012924964 0.000000000
sum over m -0.023944477 -0.023944477 -0.047888953 0.000000000
sum over m+mul 2.329804177 2.329804177 4.659608354 0.000000000
d3z^2-r^2 0 -0.006392050 -0.006392050 -0.012784100 0.000000000
dx^2-y^2 0 -0.005058247 -0.005058247 -0.010116495 0.000000000
dxy 0 -0.005435091 -0.005435091 -0.010870182 0.000000000
dxz 0 -0.006926612 -0.006926612 -0.013853224 0.000000000
dyz 0 -0.006932038 -0.006932038 -0.013864076 0.000000000
sum over m -0.030744038 -0.030744038 -0.061488076 0.000000000
sum over m+mul -0.030744038 -0.030744038 -0.061488076 0.000000000
407 O Up spin Down spin Sum Diff
multiple
s 0 0.893846619 0.893846619 1.787693238 0.000000000
sum over m 0.893846619 0.893846619 1.787693238 0.000000000
s 1 -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m+mul 0.890804808 0.890804808 1.781609616 0.000000000
px 0 0.786881028 0.786881028 1.573762057 0.000000000
py 0 0.786881618 0.786881618 1.573763237 0.000000000
pz 0 0.779895840 0.779895840 1.559791679 0.000000000
sum over m 2.353658486 2.353658486 4.707316973 0.000000000
px 1 -0.008730718 -0.008730718 -0.017461435 0.000000000
py 1 -0.008727087 -0.008727087 -0.017454174 0.000000000
pz 1 -0.006467591 -0.006467591 -0.012935183 0.000000000
sum over m -0.023925396 -0.023925396 -0.047850792 0.000000000
sum over m+mul 2.329733091 2.329733091 4.659466181 0.000000000
d3z^2-r^2 0 -0.006389848 -0.006389848 -0.012779696 0.000000000
dx^2-y^2 0 -0.005061427 -0.005061427 -0.010122854 0.000000000
dxy 0 -0.005432516 -0.005432516 -0.010865032 0.000000000
dxz 0 -0.006934084 -0.006934084 -0.013868168 0.000000000
dyz 0 -0.006934596 -0.006934596 -0.013869192 0.000000000
sum over m -0.030752471 -0.030752471 -0.061504941 0.000000000
sum over m+mul -0.030752471 -0.030752471 -0.061504941 0.000000000
408 O Up spin Down spin Sum Diff
multiple
s 0 0.893910980 0.893910980 1.787821961 0.000000000
sum over m 0.893910980 0.893910980 1.787821961 0.000000000
s 1 -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m+mul 0.890868828 0.890868828 1.781737657 0.000000000
px 0 0.787000538 0.787000538 1.574001075 0.000000000
py 0 0.787056163 0.787056163 1.574112326 0.000000000
pz 0 0.779693219 0.779693219 1.559386438 0.000000000
sum over m 2.353749920 2.353749920 4.707499839 0.000000000
px 1 -0.008736984 -0.008736984 -0.017473968 0.000000000
py 1 -0.008736779 -0.008736779 -0.017473557 0.000000000
pz 1 -0.006460979 -0.006460979 -0.012921957 0.000000000
sum over m -0.023934741 -0.023934741 -0.047869482 0.000000000
sum over m+mul 2.329815178 2.329815178 4.659630357 0.000000000
d3z^2-r^2 0 -0.006391148 -0.006391148 -0.012782297 0.000000000
dx^2-y^2 0 -0.005053457 -0.005053457 -0.010106915 0.000000000
dxy 0 -0.005434790 -0.005434790 -0.010869579 0.000000000
dxz 0 -0.006925110 -0.006925110 -0.013850220 0.000000000
dyz 0 -0.006924704 -0.006924704 -0.013849407 0.000000000
sum over m -0.030729209 -0.030729209 -0.061458417 0.000000000
sum over m+mul -0.030729209 -0.030729209 -0.061458417 0.000000000
409 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000784858 1.000784858 2.001569716 0.000000000
sum over m 1.000784858 1.000784858 2.001569716 0.000000000
s 1 0.207406430 0.207406430 0.414812860 0.000000000
sum over m 0.207406430 0.207406430 0.414812860 0.000000000
s 2 0.014723064 0.014723064 0.029446129 0.000000000
sum over m 0.014723064 0.014723064 0.029446129 0.000000000
sum over m+mul 1.222914352 1.222914352 2.445828704 0.000000000
px 0 1.006381732 1.006381732 2.012763464 0.000000000
py 0 1.006363600 1.006363600 2.012727200 0.000000000
pz 0 1.006198562 1.006198562 2.012397125 0.000000000
sum over m 3.018943894 3.018943894 6.037887789 0.000000000
px 1 0.065428221 0.065428221 0.130856443 0.000000000
py 1 0.065442820 0.065442820 0.130885640 0.000000000
pz 1 0.040368159 0.040368159 0.080736319 0.000000000
sum over m 0.171239201 0.171239201 0.342478402 0.000000000
sum over m+mul 3.190183095 3.190183095 6.380366190 0.000000000
d3z^2-r^2 0 0.196306152 0.196306152 0.392612303 0.000000000
dx^2-y^2 0 0.201515767 0.201515767 0.403031534 0.000000000
dxy 0 0.250939758 0.250939758 0.501879517 0.000000000
dxz 0 0.268483613 0.268483613 0.536967227 0.000000000
dyz 0 0.268506732 0.268506732 0.537013464 0.000000000
sum over m 1.185752022 1.185752022 2.371504045 0.000000000
d3z^2-r^2 1 0.003471637 0.003471637 0.006943275 0.000000000
dx^2-y^2 1 -0.004480560 -0.004480560 -0.008961121 0.000000000
dxy 1 0.015341408 0.015341408 0.030682816 0.000000000
dxz 1 0.003487605 0.003487605 0.006975210 0.000000000
dyz 1 0.003488934 0.003488934 0.006977868 0.000000000
sum over m 0.021309024 0.021309024 0.042618048 0.000000000
sum over m+mul 1.207061046 1.207061046 2.414122093 0.000000000
410 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000783643 1.000783643 2.001567285 0.000000000
sum over m 1.000783643 1.000783643 2.001567285 0.000000000
s 1 0.207408351 0.207408351 0.414816702 0.000000000
sum over m 0.207408351 0.207408351 0.414816702 0.000000000
s 2 0.014721554 0.014721554 0.029443107 0.000000000
sum over m 0.014721554 0.014721554 0.029443107 0.000000000
sum over m+mul 1.222913547 1.222913547 2.445827095 0.000000000
px 0 1.006384949 1.006384949 2.012769898 0.000000000
py 0 1.006375218 1.006375218 2.012750436 0.000000000
pz 0 1.006197785 1.006197785 2.012395570 0.000000000
sum over m 3.018957952 3.018957952 6.037915903 0.000000000
px 1 0.065427635 0.065427635 0.130855270 0.000000000
py 1 0.065438475 0.065438475 0.130876949 0.000000000
pz 1 0.040371962 0.040371962 0.080743925 0.000000000
sum over m 0.171238072 0.171238072 0.342476144 0.000000000
sum over m+mul 3.190196024 3.190196024 6.380392047 0.000000000
d3z^2-r^2 0 0.196324306 0.196324306 0.392648612 0.000000000
dx^2-y^2 0 0.201532272 0.201532272 0.403064544 0.000000000
dxy 0 0.250936209 0.250936209 0.501872419 0.000000000
dxz 0 0.268484247 0.268484247 0.536968494 0.000000000
dyz 0 0.268490663 0.268490663 0.536981326 0.000000000
sum over m 1.185767697 1.185767697 2.371535395 0.000000000
d3z^2-r^2 1 0.003473111 0.003473111 0.006946223 0.000000000
dx^2-y^2 1 -0.004482190 -0.004482190 -0.008964380 0.000000000
dxy 1 0.015344359 0.015344359 0.030688718 0.000000000
dxz 1 0.003493350 0.003493350 0.006986700 0.000000000
dyz 1 0.003494209 0.003494209 0.006988418 0.000000000
sum over m 0.021322840 0.021322840 0.042645679 0.000000000
sum over m+mul 1.207090537 1.207090537 2.414181074 0.000000000
411 O Up spin Down spin Sum Diff
multiple
s 0 0.893901335 0.893901335 1.787802670 0.000000000
sum over m 0.893901335 0.893901335 1.787802670 0.000000000
s 1 -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m+mul 0.890859315 0.890859315 1.781718630 0.000000000
px 0 0.786866759 0.786866759 1.573733517 0.000000000
py 0 0.787114197 0.787114197 1.574228393 0.000000000
pz 0 0.779754467 0.779754467 1.559508933 0.000000000
sum over m 2.353735422 2.353735422 4.707470844 0.000000000
px 1 -0.008738330 -0.008738330 -0.017476661 0.000000000
py 1 -0.008742321 -0.008742321 -0.017484643 0.000000000
pz 1 -0.006463117 -0.006463117 -0.012926233 0.000000000
sum over m -0.023943768 -0.023943768 -0.047887537 0.000000000
sum over m+mul 2.329791653 2.329791653 4.659583307 0.000000000
d3z^2-r^2 0 -0.006391142 -0.006391142 -0.012782285 0.000000000
dx^2-y^2 0 -0.005057147 -0.005057147 -0.010114295 0.000000000
dxy 0 -0.005434410 -0.005434410 -0.010868819 0.000000000
dxz 0 -0.006929891 -0.006929891 -0.013859782 0.000000000
dyz 0 -0.006926802 -0.006926802 -0.013853605 0.000000000
sum over m -0.030739393 -0.030739393 -0.061478786 0.000000000
sum over m+mul -0.030739393 -0.030739393 -0.061478786 0.000000000
412 O Up spin Down spin Sum Diff
multiple
s 0 0.893909360 0.893909360 1.787818719 0.000000000
sum over m 0.893909360 0.893909360 1.787818719 0.000000000
s 1 -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m+mul 0.890867990 0.890867990 1.781735980 0.000000000
px 0 0.787144558 0.787144558 1.574289115 0.000000000
py 0 0.786826014 0.786826014 1.573652028 0.000000000
pz 0 0.779778082 0.779778082 1.559556165 0.000000000
sum over m 2.353748654 2.353748654 4.707497308 0.000000000
px 1 -0.008747399 -0.008747399 -0.017494798 0.000000000
py 1 -0.008734595 -0.008734595 -0.017469191 0.000000000
pz 1 -0.006462482 -0.006462482 -0.012924964 0.000000000
sum over m -0.023944477 -0.023944477 -0.047888953 0.000000000
sum over m+mul 2.329804177 2.329804177 4.659608354 0.000000000
d3z^2-r^2 0 -0.006392050 -0.006392050 -0.012784100 0.000000000
dx^2-y^2 0 -0.005058247 -0.005058247 -0.010116495 0.000000000
dxy 0 -0.005435091 -0.005435091 -0.010870182 0.000000000
dxz 0 -0.006926612 -0.006926612 -0.013853224 0.000000000
dyz 0 -0.006932038 -0.006932038 -0.013864076 0.000000000
sum over m -0.030744038 -0.030744038 -0.061488076 0.000000000
sum over m+mul -0.030744038 -0.030744038 -0.061488076 0.000000000
413 O Up spin Down spin Sum Diff
multiple
s 0 0.893846619 0.893846619 1.787693237 0.000000000
sum over m 0.893846619 0.893846619 1.787693237 0.000000000
s 1 -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m+mul 0.890804808 0.890804808 1.781609615 0.000000000
px 0 0.786881028 0.786881028 1.573762057 0.000000000
py 0 0.786881619 0.786881619 1.573763237 0.000000000
pz 0 0.779895840 0.779895840 1.559791679 0.000000000
sum over m 2.353658486 2.353658486 4.707316973 0.000000000
px 1 -0.008730718 -0.008730718 -0.017461435 0.000000000
py 1 -0.008727087 -0.008727087 -0.017454174 0.000000000
pz 1 -0.006467591 -0.006467591 -0.012935183 0.000000000
sum over m -0.023925396 -0.023925396 -0.047850792 0.000000000
sum over m+mul 2.329733091 2.329733091 4.659466181 0.000000000
d3z^2-r^2 0 -0.006389848 -0.006389848 -0.012779696 0.000000000
dx^2-y^2 0 -0.005061427 -0.005061427 -0.010122854 0.000000000
dxy 0 -0.005432516 -0.005432516 -0.010865032 0.000000000
dxz 0 -0.006934084 -0.006934084 -0.013868168 0.000000000
dyz 0 -0.006934596 -0.006934596 -0.013869192 0.000000000
sum over m -0.030752471 -0.030752471 -0.061504941 0.000000000
sum over m+mul -0.030752471 -0.030752471 -0.061504941 0.000000000
414 O Up spin Down spin Sum Diff
multiple
s 0 0.893910980 0.893910980 1.787821961 0.000000000
sum over m 0.893910980 0.893910980 1.787821961 0.000000000
s 1 -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m+mul 0.890868828 0.890868828 1.781737657 0.000000000
px 0 0.787000538 0.787000538 1.574001075 0.000000000
py 0 0.787056163 0.787056163 1.574112326 0.000000000
pz 0 0.779693219 0.779693219 1.559386438 0.000000000
sum over m 2.353749920 2.353749920 4.707499839 0.000000000
px 1 -0.008736984 -0.008736984 -0.017473968 0.000000000
py 1 -0.008736779 -0.008736779 -0.017473557 0.000000000
pz 1 -0.006460979 -0.006460979 -0.012921957 0.000000000
sum over m -0.023934741 -0.023934741 -0.047869482 0.000000000
sum over m+mul 2.329815179 2.329815179 4.659630357 0.000000000
d3z^2-r^2 0 -0.006391148 -0.006391148 -0.012782297 0.000000000
dx^2-y^2 0 -0.005053457 -0.005053457 -0.010106915 0.000000000
dxy 0 -0.005434790 -0.005434790 -0.010869579 0.000000000
dxz 0 -0.006925110 -0.006925110 -0.013850220 0.000000000
dyz 0 -0.006924704 -0.006924704 -0.013849407 0.000000000
sum over m -0.030729209 -0.030729209 -0.061458417 0.000000000
sum over m+mul -0.030729209 -0.030729209 -0.061458417 0.000000000
415 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000784858 1.000784858 2.001569716 0.000000000
sum over m 1.000784858 1.000784858 2.001569716 0.000000000
s 1 0.207406430 0.207406430 0.414812860 0.000000000
sum over m 0.207406430 0.207406430 0.414812860 0.000000000
s 2 0.014723064 0.014723064 0.029446129 0.000000000
sum over m 0.014723064 0.014723064 0.029446129 0.000000000
sum over m+mul 1.222914352 1.222914352 2.445828704 0.000000000
px 0 1.006381732 1.006381732 2.012763464 0.000000000
py 0 1.006363600 1.006363600 2.012727200 0.000000000
pz 0 1.006198562 1.006198562 2.012397125 0.000000000
sum over m 3.018943894 3.018943894 6.037887789 0.000000000
px 1 0.065428221 0.065428221 0.130856442 0.000000000
py 1 0.065442820 0.065442820 0.130885640 0.000000000
pz 1 0.040368160 0.040368160 0.080736319 0.000000000
sum over m 0.171239201 0.171239201 0.342478402 0.000000000
sum over m+mul 3.190183095 3.190183095 6.380366190 0.000000000
d3z^2-r^2 0 0.196306152 0.196306152 0.392612304 0.000000000
dx^2-y^2 0 0.201515767 0.201515767 0.403031534 0.000000000
dxy 0 0.250939759 0.250939759 0.501879517 0.000000000
dxz 0 0.268483613 0.268483613 0.536967227 0.000000000
dyz 0 0.268506732 0.268506732 0.537013464 0.000000000
sum over m 1.185752023 1.185752023 2.371504046 0.000000000
d3z^2-r^2 1 0.003471637 0.003471637 0.006943275 0.000000000
dx^2-y^2 1 -0.004480560 -0.004480560 -0.008961121 0.000000000
dxy 1 0.015341408 0.015341408 0.030682816 0.000000000
dxz 1 0.003487605 0.003487605 0.006975210 0.000000000
dyz 1 0.003488934 0.003488934 0.006977868 0.000000000
sum over m 0.021309024 0.021309024 0.042618048 0.000000000
sum over m+mul 1.207061047 1.207061047 2.414122094 0.000000000
416 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000783643 1.000783643 2.001567285 0.000000000
sum over m 1.000783643 1.000783643 2.001567285 0.000000000
s 1 0.207408351 0.207408351 0.414816702 0.000000000
sum over m 0.207408351 0.207408351 0.414816702 0.000000000
s 2 0.014721554 0.014721554 0.029443107 0.000000000
sum over m 0.014721554 0.014721554 0.029443107 0.000000000
sum over m+mul 1.222913547 1.222913547 2.445827095 0.000000000
px 0 1.006384949 1.006384949 2.012769898 0.000000000
py 0 1.006375218 1.006375218 2.012750436 0.000000000
pz 0 1.006197785 1.006197785 2.012395569 0.000000000
sum over m 3.018957952 3.018957952 6.037915904 0.000000000
px 1 0.065427635 0.065427635 0.130855269 0.000000000
py 1 0.065438474 0.065438474 0.130876949 0.000000000
pz 1 0.040371962 0.040371962 0.080743925 0.000000000
sum over m 0.171238071 0.171238071 0.342476143 0.000000000
sum over m+mul 3.190196023 3.190196023 6.380392046 0.000000000
d3z^2-r^2 0 0.196324306 0.196324306 0.392648612 0.000000000
dx^2-y^2 0 0.201532272 0.201532272 0.403064544 0.000000000
dxy 0 0.250936209 0.250936209 0.501872419 0.000000000
dxz 0 0.268484247 0.268484247 0.536968494 0.000000000
dyz 0 0.268490663 0.268490663 0.536981326 0.000000000
sum over m 1.185767697 1.185767697 2.371535394 0.000000000
d3z^2-r^2 1 0.003473111 0.003473111 0.006946223 0.000000000
dx^2-y^2 1 -0.004482190 -0.004482190 -0.008964380 0.000000000
dxy 1 0.015344359 0.015344359 0.030688718 0.000000000
dxz 1 0.003493350 0.003493350 0.006986700 0.000000000
dyz 1 0.003494209 0.003494209 0.006988418 0.000000000
sum over m 0.021322840 0.021322840 0.042645679 0.000000000
sum over m+mul 1.207090537 1.207090537 2.414181073 0.000000000
417 O Up spin Down spin Sum Diff
multiple
s 0 0.893901335 0.893901335 1.787802670 0.000000000
sum over m 0.893901335 0.893901335 1.787802670 0.000000000
s 1 -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m+mul 0.890859315 0.890859315 1.781718630 0.000000000
px 0 0.786866759 0.786866759 1.573733517 0.000000000
py 0 0.787114197 0.787114197 1.574228393 0.000000000
pz 0 0.779754467 0.779754467 1.559508933 0.000000000
sum over m 2.353735422 2.353735422 4.707470844 0.000000000
px 1 -0.008738330 -0.008738330 -0.017476661 0.000000000
py 1 -0.008742321 -0.008742321 -0.017484643 0.000000000
pz 1 -0.006463117 -0.006463117 -0.012926233 0.000000000
sum over m -0.023943768 -0.023943768 -0.047887537 0.000000000
sum over m+mul 2.329791654 2.329791654 4.659583307 0.000000000
d3z^2-r^2 0 -0.006391142 -0.006391142 -0.012782285 0.000000000
dx^2-y^2 0 -0.005057147 -0.005057147 -0.010114295 0.000000000
dxy 0 -0.005434410 -0.005434410 -0.010868819 0.000000000
dxz 0 -0.006929891 -0.006929891 -0.013859782 0.000000000
dyz 0 -0.006926802 -0.006926802 -0.013853605 0.000000000
sum over m -0.030739393 -0.030739393 -0.061478786 0.000000000
sum over m+mul -0.030739393 -0.030739393 -0.061478786 0.000000000
418 O Up spin Down spin Sum Diff
multiple
s 0 0.893909360 0.893909360 1.787818719 0.000000000
sum over m 0.893909360 0.893909360 1.787818719 0.000000000
s 1 -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m+mul 0.890867990 0.890867990 1.781735980 0.000000000
px 0 0.787144558 0.787144558 1.574289115 0.000000000
py 0 0.786826014 0.786826014 1.573652027 0.000000000
pz 0 0.779778083 0.779778083 1.559556165 0.000000000
sum over m 2.353748654 2.353748654 4.707497308 0.000000000
px 1 -0.008747399 -0.008747399 -0.017494798 0.000000000
py 1 -0.008734595 -0.008734595 -0.017469191 0.000000000
pz 1 -0.006462482 -0.006462482 -0.012924964 0.000000000
sum over m -0.023944477 -0.023944477 -0.047888953 0.000000000
sum over m+mul 2.329804177 2.329804177 4.659608354 0.000000000
d3z^2-r^2 0 -0.006392050 -0.006392050 -0.012784100 0.000000000
dx^2-y^2 0 -0.005058247 -0.005058247 -0.010116495 0.000000000
dxy 0 -0.005435091 -0.005435091 -0.010870182 0.000000000
dxz 0 -0.006926612 -0.006926612 -0.013853224 0.000000000
dyz 0 -0.006932038 -0.006932038 -0.013864076 0.000000000
sum over m -0.030744038 -0.030744038 -0.061488076 0.000000000
sum over m+mul -0.030744038 -0.030744038 -0.061488076 0.000000000
419 O Up spin Down spin Sum Diff
multiple
s 0 0.893846619 0.893846619 1.787693237 0.000000000
sum over m 0.893846619 0.893846619 1.787693237 0.000000000
s 1 -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m+mul 0.890804808 0.890804808 1.781609615 0.000000000
px 0 0.786881029 0.786881029 1.573762057 0.000000000
py 0 0.786881618 0.786881618 1.573763237 0.000000000
pz 0 0.779895839 0.779895839 1.559791679 0.000000000
sum over m 2.353658486 2.353658486 4.707316973 0.000000000
px 1 -0.008730718 -0.008730718 -0.017461435 0.000000000
py 1 -0.008727087 -0.008727087 -0.017454174 0.000000000
pz 1 -0.006467591 -0.006467591 -0.012935183 0.000000000
sum over m -0.023925396 -0.023925396 -0.047850792 0.000000000
sum over m+mul 2.329733091 2.329733091 4.659466181 0.000000000
d3z^2-r^2 0 -0.006389848 -0.006389848 -0.012779696 0.000000000
dx^2-y^2 0 -0.005061427 -0.005061427 -0.010122854 0.000000000
dxy 0 -0.005432516 -0.005432516 -0.010865032 0.000000000
dxz 0 -0.006934084 -0.006934084 -0.013868168 0.000000000
dyz 0 -0.006934596 -0.006934596 -0.013869192 0.000000000
sum over m -0.030752471 -0.030752471 -0.061504941 0.000000000
sum over m+mul -0.030752471 -0.030752471 -0.061504941 0.000000000
420 O Up spin Down spin Sum Diff
multiple
s 0 0.893910980 0.893910980 1.787821961 0.000000000
sum over m 0.893910980 0.893910980 1.787821961 0.000000000
s 1 -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m+mul 0.890868828 0.890868828 1.781737657 0.000000000
px 0 0.787000538 0.787000538 1.574001076 0.000000000
py 0 0.787056163 0.787056163 1.574112326 0.000000000
pz 0 0.779693219 0.779693219 1.559386438 0.000000000
sum over m 2.353749920 2.353749920 4.707499839 0.000000000
px 1 -0.008736984 -0.008736984 -0.017473968 0.000000000
py 1 -0.008736779 -0.008736779 -0.017473557 0.000000000
pz 1 -0.006460979 -0.006460979 -0.012921957 0.000000000
sum over m -0.023934741 -0.023934741 -0.047869482 0.000000000
sum over m+mul 2.329815179 2.329815179 4.659630357 0.000000000
d3z^2-r^2 0 -0.006391148 -0.006391148 -0.012782297 0.000000000
dx^2-y^2 0 -0.005053457 -0.005053457 -0.010106915 0.000000000
dxy 0 -0.005434790 -0.005434790 -0.010869579 0.000000000
dxz 0 -0.006925110 -0.006925110 -0.013850220 0.000000000
dyz 0 -0.006924704 -0.006924704 -0.013849407 0.000000000
sum over m -0.030729209 -0.030729209 -0.061458417 0.000000000
sum over m+mul -0.030729209 -0.030729209 -0.061458417 0.000000000
421 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779759 1.000779759 2.001559517 0.000000000
sum over m 1.000779759 1.000779759 2.001559517 0.000000000
s 1 0.207398342 0.207398342 0.414796684 0.000000000
sum over m 0.207398342 0.207398342 0.414796684 0.000000000
s 2 0.014720594 0.014720594 0.029441188 0.000000000
sum over m 0.014720594 0.014720594 0.029441188 0.000000000
sum over m+mul 1.222898694 1.222898694 2.445797389 0.000000000
px 0 1.006387973 1.006387973 2.012775946 0.000000000
py 0 1.006400421 1.006400421 2.012800841 0.000000000
pz 0 1.006194818 1.006194818 2.012389636 0.000000000
sum over m 3.018983212 3.018983212 6.037966423 0.000000000
px 1 0.065427752 0.065427752 0.130855505 0.000000000
py 1 0.065430720 0.065430720 0.130861440 0.000000000
pz 1 0.040362129 0.040362129 0.080724258 0.000000000
sum over m 0.171220601 0.171220601 0.342441202 0.000000000
sum over m+mul 3.190203813 3.190203813 6.380407625 0.000000000
d3z^2-r^2 0 0.196297199 0.196297199 0.392594398 0.000000000
dx^2-y^2 0 0.201534012 0.201534012 0.403068025 0.000000000
dxy 0 0.250918262 0.250918262 0.501836525 0.000000000
dxz 0 0.268505878 0.268505878 0.537011755 0.000000000
dyz 0 0.268497934 0.268497934 0.536995869 0.000000000
sum over m 1.185753286 1.185753286 2.371506572 0.000000000
d3z^2-r^2 1 0.003469582 0.003469582 0.006939165 0.000000000
dx^2-y^2 1 -0.004482525 -0.004482525 -0.008965050 0.000000000
dxy 1 0.015342841 0.015342841 0.030685682 0.000000000
dxz 1 0.003485057 0.003485057 0.006970114 0.000000000
dyz 1 0.003484969 0.003484969 0.006969937 0.000000000
sum over m 0.021299924 0.021299924 0.042599849 0.000000000
sum over m+mul 1.207053210 1.207053210 2.414106421 0.000000000
422 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000786629 1.000786629 2.001573258 0.000000000
sum over m 1.000786629 1.000786629 2.001573258 0.000000000
s 1 0.207412251 0.207412251 0.414824502 0.000000000
sum over m 0.207412251 0.207412251 0.414824502 0.000000000
s 2 0.014723217 0.014723217 0.029446435 0.000000000
sum over m 0.014723217 0.014723217 0.029446435 0.000000000
sum over m+mul 1.222922097 1.222922097 2.445844194 0.000000000
px 0 1.006362926 1.006362926 2.012725851 0.000000000
py 0 1.006379604 1.006379604 2.012759208 0.000000000
pz 0 1.006207568 1.006207568 2.012415137 0.000000000
sum over m 3.018950098 3.018950098 6.037900196 0.000000000
px 1 0.065449661 0.065449661 0.130899321 0.000000000
py 1 0.065424391 0.065424391 0.130848782 0.000000000
pz 1 0.040363083 0.040363083 0.080726165 0.000000000
sum over m 0.171237134 0.171237134 0.342474269 0.000000000
sum over m+mul 3.190187232 3.190187232 6.380374465 0.000000000
d3z^2-r^2 0 0.196314103 0.196314103 0.392628205 0.000000000
dx^2-y^2 0 0.201515300 0.201515300 0.403030601 0.000000000
dxy 0 0.250946197 0.250946197 0.501892393 0.000000000
dxz 0 0.268502100 0.268502100 0.537004199 0.000000000
dyz 0 0.268479092 0.268479092 0.536958185 0.000000000
sum over m 1.185756792 1.185756792 2.371513583 0.000000000
d3z^2-r^2 1 0.003472794 0.003472794 0.006945587 0.000000000
dx^2-y^2 1 -0.004480490 -0.004480490 -0.008960980 0.000000000
dxy 1 0.015341851 0.015341851 0.030683703 0.000000000
dxz 1 0.003492223 0.003492223 0.006984446 0.000000000
dyz 1 0.003489723 0.003489723 0.006979446 0.000000000
sum over m 0.021316101 0.021316101 0.042632202 0.000000000
sum over m+mul 1.207072892 1.207072892 2.414145785 0.000000000
423 O Up spin Down spin Sum Diff
multiple
s 0 0.893895651 0.893895651 1.787791303 0.000000000
sum over m 0.893895651 0.893895651 1.787791303 0.000000000
s 1 -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m+mul 0.890854063 0.890854063 1.781708126 0.000000000
px 0 0.786850013 0.786850013 1.573700025 0.000000000
py 0 0.787109858 0.787109858 1.574219715 0.000000000
pz 0 0.779796894 0.779796894 1.559593789 0.000000000
sum over m 2.353756765 2.353756765 4.707513530 0.000000000
px 1 -0.008731747 -0.008731747 -0.017463493 0.000000000
py 1 -0.008747356 -0.008747356 -0.017494712 0.000000000
pz 1 -0.006464716 -0.006464716 -0.012929431 0.000000000
sum over m -0.023943818 -0.023943818 -0.047887637 0.000000000
sum over m+mul 2.329812946 2.329812946 4.659625893 0.000000000
d3z^2-r^2 0 -0.006391488 -0.006391488 -0.012782975 0.000000000
dx^2-y^2 0 -0.005058784 -0.005058784 -0.010117568 0.000000000
dxy 0 -0.005434639 -0.005434639 -0.010869278 0.000000000
dxz 0 -0.006933227 -0.006933227 -0.013866455 0.000000000
dyz 0 -0.006927417 -0.006927417 -0.013854833 0.000000000
sum over m -0.030745555 -0.030745555 -0.061491109 0.000000000
sum over m+mul -0.030745555 -0.030745555 -0.061491109 0.000000000
424 O Up spin Down spin Sum Diff
multiple
s 0 0.893891025 0.893891025 1.787782050 0.000000000
sum over m 0.893891025 0.893891025 1.787782050 0.000000000
s 1 -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m+mul 0.890848335 0.890848335 1.781696669 0.000000000
px 0 0.787044161 0.787044161 1.574088321 0.000000000
py 0 0.786953979 0.786953979 1.573907958 0.000000000
pz 0 0.779742007 0.779742007 1.559484014 0.000000000
sum over m 2.353740147 2.353740147 4.707480293 0.000000000
px 1 -0.008733766 -0.008733766 -0.017467533 0.000000000
py 1 -0.008738783 -0.008738783 -0.017477566 0.000000000
pz 1 -0.006460366 -0.006460366 -0.012920731 0.000000000
sum over m -0.023932915 -0.023932915 -0.047865831 0.000000000
sum over m+mul 2.329807231 2.329807231 4.659614463 0.000000000
d3z^2-r^2 0 -0.006389838 -0.006389838 -0.012779676 0.000000000
dx^2-y^2 0 -0.005056265 -0.005056265 -0.010112529 0.000000000
dxy 0 -0.005433964 -0.005433964 -0.010867928 0.000000000
dxz 0 -0.006927781 -0.006927781 -0.013855563 0.000000000
dyz 0 -0.006927405 -0.006927405 -0.013854811 0.000000000
sum over m -0.030735253 -0.030735253 -0.061470507 0.000000000
sum over m+mul -0.030735253 -0.030735253 -0.061470507 0.000000000
425 O Up spin Down spin Sum Diff
multiple
s 0 0.893859606 0.893859606 1.787719211 0.000000000
sum over m 0.893859606 0.893859606 1.787719211 0.000000000
s 1 -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m+mul 0.890817400 0.890817400 1.781634799 0.000000000
px 0 0.786920290 0.786920290 1.573840580 0.000000000
py 0 0.786920140 0.786920140 1.573840280 0.000000000
pz 0 0.779851140 0.779851140 1.559702279 0.000000000
sum over m 2.353691569 2.353691569 4.707383139 0.000000000
px 1 -0.008726755 -0.008726755 -0.017453510 0.000000000
py 1 -0.008734849 -0.008734849 -0.017469698 0.000000000
pz 1 -0.006464764 -0.006464764 -0.012929529 0.000000000
sum over m -0.023926368 -0.023926368 -0.047852736 0.000000000
sum over m+mul 2.329765201 2.329765201 4.659530402 0.000000000
d3z^2-r^2 0 -0.006389399 -0.006389399 -0.012778797 0.000000000
dx^2-y^2 0 -0.005060127 -0.005060127 -0.010120254 0.000000000
dxy 0 -0.005433050 -0.005433050 -0.010866099 0.000000000
dxz 0 -0.006932951 -0.006932951 -0.013865902 0.000000000
dyz 0 -0.006931581 -0.006931581 -0.013863162 0.000000000
sum over m -0.030747107 -0.030747107 -0.061494214 0.000000000
sum over m+mul -0.030747107 -0.030747107 -0.061494214 0.000000000
426 O Up spin Down spin Sum Diff
multiple
s 0 0.893902429 0.893902429 1.787804858 0.000000000
sum over m 0.893902429 0.893902429 1.787804858 0.000000000
s 1 -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m+mul 0.890860132 0.890860132 1.781720264 0.000000000
px 0 0.787083683 0.787083683 1.574167366 0.000000000
py 0 0.786938366 0.786938366 1.573876732 0.000000000
pz 0 0.779721516 0.779721516 1.559443032 0.000000000
sum over m 2.353743565 2.353743565 4.707487130 0.000000000
px 1 -0.008739175 -0.008739175 -0.017478349 0.000000000
py 1 -0.008738389 -0.008738389 -0.017476778 0.000000000
pz 1 -0.006462094 -0.006462094 -0.012924187 0.000000000
sum over m -0.023939657 -0.023939657 -0.047879315 0.000000000
sum over m+mul 2.329803908 2.329803908 4.659607815 0.000000000
d3z^2-r^2 0 -0.006390665 -0.006390665 -0.012781330 0.000000000
dx^2-y^2 0 -0.005055239 -0.005055239 -0.010110477 0.000000000
dxy 0 -0.005434586 -0.005434586 -0.010869173 0.000000000
dxz 0 -0.006926101 -0.006926101 -0.013852202 0.000000000
dyz 0 -0.006927242 -0.006927242 -0.013854483 0.000000000
sum over m -0.030733833 -0.030733833 -0.061467665 0.000000000
sum over m+mul -0.030733833 -0.030733833 -0.061467665 0.000000000
427 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779759 1.000779759 2.001559517 0.000000000
sum over m 1.000779759 1.000779759 2.001559517 0.000000000
s 1 0.207398342 0.207398342 0.414796684 0.000000000
sum over m 0.207398342 0.207398342 0.414796684 0.000000000
s 2 0.014720594 0.014720594 0.029441188 0.000000000
sum over m 0.014720594 0.014720594 0.029441188 0.000000000
sum over m+mul 1.222898695 1.222898695 2.445797389 0.000000000
px 0 1.006387973 1.006387973 2.012775946 0.000000000
py 0 1.006400420 1.006400420 2.012800841 0.000000000
pz 0 1.006194818 1.006194818 2.012389636 0.000000000
sum over m 3.018983212 3.018983212 6.037966423 0.000000000
px 1 0.065427752 0.065427752 0.130855504 0.000000000
py 1 0.065430720 0.065430720 0.130861440 0.000000000
pz 1 0.040362129 0.040362129 0.080724259 0.000000000
sum over m 0.171220601 0.171220601 0.342441203 0.000000000
sum over m+mul 3.190203813 3.190203813 6.380407626 0.000000000
d3z^2-r^2 0 0.196297199 0.196297199 0.392594399 0.000000000
dx^2-y^2 0 0.201534012 0.201534012 0.403068025 0.000000000
dxy 0 0.250918262 0.250918262 0.501836525 0.000000000
dxz 0 0.268505878 0.268505878 0.537011756 0.000000000
dyz 0 0.268497934 0.268497934 0.536995869 0.000000000
sum over m 1.185753287 1.185753287 2.371506573 0.000000000
d3z^2-r^2 1 0.003469582 0.003469582 0.006939165 0.000000000
dx^2-y^2 1 -0.004482525 -0.004482525 -0.008965050 0.000000000
dxy 1 0.015342841 0.015342841 0.030685682 0.000000000
dxz 1 0.003485057 0.003485057 0.006970114 0.000000000
dyz 1 0.003484969 0.003484969 0.006969937 0.000000000
sum over m 0.021299924 0.021299924 0.042599849 0.000000000
sum over m+mul 1.207053211 1.207053211 2.414106422 0.000000000
428 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000786629 1.000786629 2.001573258 0.000000000
sum over m 1.000786629 1.000786629 2.001573258 0.000000000
s 1 0.207412251 0.207412251 0.414824502 0.000000000
sum over m 0.207412251 0.207412251 0.414824502 0.000000000
s 2 0.014723217 0.014723217 0.029446435 0.000000000
sum over m 0.014723217 0.014723217 0.029446435 0.000000000
sum over m+mul 1.222922097 1.222922097 2.445844194 0.000000000
px 0 1.006362926 1.006362926 2.012725851 0.000000000
py 0 1.006379604 1.006379604 2.012759208 0.000000000
pz 0 1.006207568 1.006207568 2.012415137 0.000000000
sum over m 3.018950098 3.018950098 6.037900196 0.000000000
px 1 0.065449661 0.065449661 0.130899321 0.000000000
py 1 0.065424391 0.065424391 0.130848783 0.000000000
pz 1 0.040363083 0.040363083 0.080726166 0.000000000
sum over m 0.171237135 0.171237135 0.342474270 0.000000000
sum over m+mul 3.190187233 3.190187233 6.380374465 0.000000000
d3z^2-r^2 0 0.196314102 0.196314102 0.392628205 0.000000000
dx^2-y^2 0 0.201515301 0.201515301 0.403030601 0.000000000
dxy 0 0.250946196 0.250946196 0.501892393 0.000000000
dxz 0 0.268502099 0.268502099 0.537004199 0.000000000
dyz 0 0.268479092 0.268479092 0.536958184 0.000000000
sum over m 1.185756791 1.185756791 2.371513582 0.000000000
d3z^2-r^2 1 0.003472794 0.003472794 0.006945587 0.000000000
dx^2-y^2 1 -0.004480490 -0.004480490 -0.008960980 0.000000000
dxy 1 0.015341851 0.015341851 0.030683703 0.000000000
dxz 1 0.003492223 0.003492223 0.006984446 0.000000000
dyz 1 0.003489723 0.003489723 0.006979446 0.000000000
sum over m 0.021316101 0.021316101 0.042632202 0.000000000
sum over m+mul 1.207072892 1.207072892 2.414145784 0.000000000
429 O Up spin Down spin Sum Diff
multiple
s 0 0.893895651 0.893895651 1.787791303 0.000000000
sum over m 0.893895651 0.893895651 1.787791303 0.000000000
s 1 -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m+mul 0.890854063 0.890854063 1.781708126 0.000000000
px 0 0.786850013 0.786850013 1.573700026 0.000000000
py 0 0.787109857 0.787109857 1.574219715 0.000000000
pz 0 0.779796894 0.779796894 1.559593789 0.000000000
sum over m 2.353756765 2.353756765 4.707513530 0.000000000
px 1 -0.008731747 -0.008731747 -0.017463493 0.000000000
py 1 -0.008747356 -0.008747356 -0.017494712 0.000000000
pz 1 -0.006464716 -0.006464716 -0.012929431 0.000000000
sum over m -0.023943818 -0.023943818 -0.047887637 0.000000000
sum over m+mul 2.329812946 2.329812946 4.659625893 0.000000000
d3z^2-r^2 0 -0.006391488 -0.006391488 -0.012782975 0.000000000
dx^2-y^2 0 -0.005058784 -0.005058784 -0.010117568 0.000000000
dxy 0 -0.005434639 -0.005434639 -0.010869278 0.000000000
dxz 0 -0.006933227 -0.006933227 -0.013866455 0.000000000
dyz 0 -0.006927417 -0.006927417 -0.013854833 0.000000000
sum over m -0.030745555 -0.030745555 -0.061491109 0.000000000
sum over m+mul -0.030745555 -0.030745555 -0.061491109 0.000000000
430 O Up spin Down spin Sum Diff
multiple
s 0 0.893891025 0.893891025 1.787782050 0.000000000
sum over m 0.893891025 0.893891025 1.787782050 0.000000000
s 1 -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m+mul 0.890848335 0.890848335 1.781696669 0.000000000
px 0 0.787044161 0.787044161 1.574088321 0.000000000
py 0 0.786953979 0.786953979 1.573907958 0.000000000
pz 0 0.779742007 0.779742007 1.559484015 0.000000000
sum over m 2.353740147 2.353740147 4.707480293 0.000000000
px 1 -0.008733766 -0.008733766 -0.017467533 0.000000000
py 1 -0.008738783 -0.008738783 -0.017477566 0.000000000
pz 1 -0.006460366 -0.006460366 -0.012920731 0.000000000
sum over m -0.023932915 -0.023932915 -0.047865830 0.000000000
sum over m+mul 2.329807231 2.329807231 4.659614463 0.000000000
d3z^2-r^2 0 -0.006389838 -0.006389838 -0.012779676 0.000000000
dx^2-y^2 0 -0.005056265 -0.005056265 -0.010112529 0.000000000
dxy 0 -0.005433964 -0.005433964 -0.010867928 0.000000000
dxz 0 -0.006927781 -0.006927781 -0.013855563 0.000000000
dyz 0 -0.006927405 -0.006927405 -0.013854811 0.000000000
sum over m -0.030735253 -0.030735253 -0.061470507 0.000000000
sum over m+mul -0.030735253 -0.030735253 -0.061470507 0.000000000
431 O Up spin Down spin Sum Diff
multiple
s 0 0.893859606 0.893859606 1.787719211 0.000000000
sum over m 0.893859606 0.893859606 1.787719211 0.000000000
s 1 -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m+mul 0.890817400 0.890817400 1.781634799 0.000000000
px 0 0.786920290 0.786920290 1.573840580 0.000000000
py 0 0.786920140 0.786920140 1.573840280 0.000000000
pz 0 0.779851139 0.779851139 1.559702279 0.000000000
sum over m 2.353691569 2.353691569 4.707383139 0.000000000
px 1 -0.008726755 -0.008726755 -0.017453510 0.000000000
py 1 -0.008734849 -0.008734849 -0.017469697 0.000000000
pz 1 -0.006464764 -0.006464764 -0.012929529 0.000000000
sum over m -0.023926368 -0.023926368 -0.047852736 0.000000000
sum over m+mul 2.329765201 2.329765201 4.659530402 0.000000000
d3z^2-r^2 0 -0.006389399 -0.006389399 -0.012778797 0.000000000
dx^2-y^2 0 -0.005060127 -0.005060127 -0.010120254 0.000000000
dxy 0 -0.005433050 -0.005433050 -0.010866099 0.000000000
dxz 0 -0.006932951 -0.006932951 -0.013865902 0.000000000
dyz 0 -0.006931581 -0.006931581 -0.013863162 0.000000000
sum over m -0.030747107 -0.030747107 -0.061494214 0.000000000
sum over m+mul -0.030747107 -0.030747107 -0.061494214 0.000000000
432 O Up spin Down spin Sum Diff
multiple
s 0 0.893902429 0.893902429 1.787804857 0.000000000
sum over m 0.893902429 0.893902429 1.787804857 0.000000000
s 1 -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m+mul 0.890860132 0.890860132 1.781720264 0.000000000
px 0 0.787083683 0.787083683 1.574167366 0.000000000
py 0 0.786938366 0.786938366 1.573876731 0.000000000
pz 0 0.779721516 0.779721516 1.559443032 0.000000000
sum over m 2.353743565 2.353743565 4.707487129 0.000000000
px 1 -0.008739175 -0.008739175 -0.017478349 0.000000000
py 1 -0.008738389 -0.008738389 -0.017476778 0.000000000
pz 1 -0.006462094 -0.006462094 -0.012924187 0.000000000
sum over m -0.023939657 -0.023939657 -0.047879315 0.000000000
sum over m+mul 2.329803907 2.329803907 4.659607815 0.000000000
d3z^2-r^2 0 -0.006390665 -0.006390665 -0.012781330 0.000000000
dx^2-y^2 0 -0.005055239 -0.005055239 -0.010110477 0.000000000
dxy 0 -0.005434586 -0.005434586 -0.010869173 0.000000000
dxz 0 -0.006926101 -0.006926101 -0.013852202 0.000000000
dyz 0 -0.006927242 -0.006927242 -0.013854483 0.000000000
sum over m -0.030733833 -0.030733833 -0.061467665 0.000000000
sum over m+mul -0.030733833 -0.030733833 -0.061467665 0.000000000
433 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779758 1.000779758 2.001559517 0.000000000
sum over m 1.000779758 1.000779758 2.001559517 0.000000000
s 1 0.207398342 0.207398342 0.414796684 0.000000000
sum over m 0.207398342 0.207398342 0.414796684 0.000000000
s 2 0.014720594 0.014720594 0.029441188 0.000000000
sum over m 0.014720594 0.014720594 0.029441188 0.000000000
sum over m+mul 1.222898694 1.222898694 2.445797389 0.000000000
px 0 1.006387973 1.006387973 2.012775946 0.000000000
py 0 1.006400421 1.006400421 2.012800841 0.000000000
pz 0 1.006194818 1.006194818 2.012389636 0.000000000
sum over m 3.018983211 3.018983211 6.037966423 0.000000000
px 1 0.065427752 0.065427752 0.130855505 0.000000000
py 1 0.065430720 0.065430720 0.130861440 0.000000000
pz 1 0.040362129 0.040362129 0.080724258 0.000000000
sum over m 0.171220602 0.171220602 0.342441203 0.000000000
sum over m+mul 3.190203813 3.190203813 6.380407626 0.000000000
d3z^2-r^2 0 0.196297199 0.196297199 0.392594398 0.000000000
dx^2-y^2 0 0.201534012 0.201534012 0.403068025 0.000000000
dxy 0 0.250918262 0.250918262 0.501836525 0.000000000
dxz 0 0.268505878 0.268505878 0.537011755 0.000000000
dyz 0 0.268497934 0.268497934 0.536995869 0.000000000
sum over m 1.185753286 1.185753286 2.371506572 0.000000000
d3z^2-r^2 1 0.003469582 0.003469582 0.006939165 0.000000000
dx^2-y^2 1 -0.004482525 -0.004482525 -0.008965050 0.000000000
dxy 1 0.015342841 0.015342841 0.030685682 0.000000000
dxz 1 0.003485057 0.003485057 0.006970114 0.000000000
dyz 1 0.003484969 0.003484969 0.006969937 0.000000000
sum over m 0.021299924 0.021299924 0.042599849 0.000000000
sum over m+mul 1.207053210 1.207053210 2.414106420 0.000000000
434 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000786629 1.000786629 2.001573258 0.000000000
sum over m 1.000786629 1.000786629 2.001573258 0.000000000
s 1 0.207412251 0.207412251 0.414824501 0.000000000
sum over m 0.207412251 0.207412251 0.414824501 0.000000000
s 2 0.014723217 0.014723217 0.029446435 0.000000000
sum over m 0.014723217 0.014723217 0.029446435 0.000000000
sum over m+mul 1.222922097 1.222922097 2.445844194 0.000000000
px 0 1.006362926 1.006362926 2.012725851 0.000000000
py 0 1.006379604 1.006379604 2.012759208 0.000000000
pz 0 1.006207568 1.006207568 2.012415136 0.000000000
sum over m 3.018950098 3.018950098 6.037900196 0.000000000
px 1 0.065449661 0.065449661 0.130899321 0.000000000
py 1 0.065424391 0.065424391 0.130848782 0.000000000
pz 1 0.040363083 0.040363083 0.080726166 0.000000000
sum over m 0.171237135 0.171237135 0.342474269 0.000000000
sum over m+mul 3.190187232 3.190187232 6.380374465 0.000000000
d3z^2-r^2 0 0.196314102 0.196314102 0.392628205 0.000000000
dx^2-y^2 0 0.201515300 0.201515300 0.403030600 0.000000000
dxy 0 0.250946196 0.250946196 0.501892393 0.000000000
dxz 0 0.268502100 0.268502100 0.537004199 0.000000000
dyz 0 0.268479092 0.268479092 0.536958185 0.000000000
sum over m 1.185756791 1.185756791 2.371513582 0.000000000
d3z^2-r^2 1 0.003472794 0.003472794 0.006945587 0.000000000
dx^2-y^2 1 -0.004480490 -0.004480490 -0.008960980 0.000000000
dxy 1 0.015341851 0.015341851 0.030683703 0.000000000
dxz 1 0.003492223 0.003492223 0.006984446 0.000000000
dyz 1 0.003489723 0.003489723 0.006979446 0.000000000
sum over m 0.021316101 0.021316101 0.042632202 0.000000000
sum over m+mul 1.207072892 1.207072892 2.414145784 0.000000000
435 O Up spin Down spin Sum Diff
multiple
s 0 0.893895651 0.893895651 1.787791302 0.000000000
sum over m 0.893895651 0.893895651 1.787791302 0.000000000
s 1 -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m+mul 0.890854063 0.890854063 1.781708126 0.000000000
px 0 0.786850013 0.786850013 1.573700026 0.000000000
py 0 0.787109858 0.787109858 1.574219716 0.000000000
pz 0 0.779796895 0.779796895 1.559593789 0.000000000
sum over m 2.353756766 2.353756766 4.707513531 0.000000000
px 1 -0.008731747 -0.008731747 -0.017463493 0.000000000
py 1 -0.008747356 -0.008747356 -0.017494712 0.000000000
pz 1 -0.006464716 -0.006464716 -0.012929431 0.000000000
sum over m -0.023943818 -0.023943818 -0.047887637 0.000000000
sum over m+mul 2.329812947 2.329812947 4.659625894 0.000000000
d3z^2-r^2 0 -0.006391488 -0.006391488 -0.012782975 0.000000000
dx^2-y^2 0 -0.005058784 -0.005058784 -0.010117568 0.000000000
dxy 0 -0.005434639 -0.005434639 -0.010869278 0.000000000
dxz 0 -0.006933227 -0.006933227 -0.013866455 0.000000000
dyz 0 -0.006927417 -0.006927417 -0.013854833 0.000000000
sum over m -0.030745555 -0.030745555 -0.061491109 0.000000000
sum over m+mul -0.030745555 -0.030745555 -0.061491109 0.000000000
436 O Up spin Down spin Sum Diff
multiple
s 0 0.893891025 0.893891025 1.787782050 0.000000000
sum over m 0.893891025 0.893891025 1.787782050 0.000000000
s 1 -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m+mul 0.890848335 0.890848335 1.781696669 0.000000000
px 0 0.787044161 0.787044161 1.574088321 0.000000000
py 0 0.786953979 0.786953979 1.573907958 0.000000000
pz 0 0.779742007 0.779742007 1.559484015 0.000000000
sum over m 2.353740147 2.353740147 4.707480294 0.000000000
px 1 -0.008733766 -0.008733766 -0.017467533 0.000000000
py 1 -0.008738783 -0.008738783 -0.017477566 0.000000000
pz 1 -0.006460365 -0.006460365 -0.012920731 0.000000000
sum over m -0.023932915 -0.023932915 -0.047865830 0.000000000
sum over m+mul 2.329807232 2.329807232 4.659614463 0.000000000
d3z^2-r^2 0 -0.006389838 -0.006389838 -0.012779676 0.000000000
dx^2-y^2 0 -0.005056265 -0.005056265 -0.010112529 0.000000000
dxy 0 -0.005433964 -0.005433964 -0.010867928 0.000000000
dxz 0 -0.006927781 -0.006927781 -0.013855563 0.000000000
dyz 0 -0.006927405 -0.006927405 -0.013854811 0.000000000
sum over m -0.030735253 -0.030735253 -0.061470507 0.000000000
sum over m+mul -0.030735253 -0.030735253 -0.061470507 0.000000000
437 O Up spin Down spin Sum Diff
multiple
s 0 0.893859606 0.893859606 1.787719211 0.000000000
sum over m 0.893859606 0.893859606 1.787719211 0.000000000
s 1 -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m+mul 0.890817400 0.890817400 1.781634799 0.000000000
px 0 0.786920290 0.786920290 1.573840580 0.000000000
py 0 0.786920140 0.786920140 1.573840280 0.000000000
pz 0 0.779851140 0.779851140 1.559702279 0.000000000
sum over m 2.353691569 2.353691569 4.707383139 0.000000000
px 1 -0.008726755 -0.008726755 -0.017453510 0.000000000
py 1 -0.008734849 -0.008734849 -0.017469697 0.000000000
pz 1 -0.006464764 -0.006464764 -0.012929529 0.000000000
sum over m -0.023926368 -0.023926368 -0.047852736 0.000000000
sum over m+mul 2.329765201 2.329765201 4.659530403 0.000000000
d3z^2-r^2 0 -0.006389399 -0.006389399 -0.012778797 0.000000000
dx^2-y^2 0 -0.005060127 -0.005060127 -0.010120254 0.000000000
dxy 0 -0.005433050 -0.005433050 -0.010866099 0.000000000
dxz 0 -0.006932951 -0.006932951 -0.013865902 0.000000000
dyz 0 -0.006931581 -0.006931581 -0.013863162 0.000000000
sum over m -0.030747107 -0.030747107 -0.061494214 0.000000000
sum over m+mul -0.030747107 -0.030747107 -0.061494214 0.000000000
438 O Up spin Down spin Sum Diff
multiple
s 0 0.893902429 0.893902429 1.787804857 0.000000000
sum over m 0.893902429 0.893902429 1.787804857 0.000000000
s 1 -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m+mul 0.890860132 0.890860132 1.781720263 0.000000000
px 0 0.787083683 0.787083683 1.574167366 0.000000000
py 0 0.786938366 0.786938366 1.573876732 0.000000000
pz 0 0.779721516 0.779721516 1.559443032 0.000000000
sum over m 2.353743565 2.353743565 4.707487130 0.000000000
px 1 -0.008739175 -0.008739175 -0.017478349 0.000000000
py 1 -0.008738389 -0.008738389 -0.017476778 0.000000000
pz 1 -0.006462094 -0.006462094 -0.012924187 0.000000000
sum over m -0.023939657 -0.023939657 -0.047879315 0.000000000
sum over m+mul 2.329803908 2.329803908 4.659607815 0.000000000
d3z^2-r^2 0 -0.006390665 -0.006390665 -0.012781330 0.000000000
dx^2-y^2 0 -0.005055239 -0.005055239 -0.010110477 0.000000000
dxy 0 -0.005434586 -0.005434586 -0.010869173 0.000000000
dxz 0 -0.006926101 -0.006926101 -0.013852202 0.000000000
dyz 0 -0.006927242 -0.006927242 -0.013854483 0.000000000
sum over m -0.030733833 -0.030733833 -0.061467665 0.000000000
sum over m+mul -0.030733833 -0.030733833 -0.061467665 0.000000000
439 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779759 1.000779759 2.001559517 0.000000000
sum over m 1.000779759 1.000779759 2.001559517 0.000000000
s 1 0.207398342 0.207398342 0.414796684 0.000000000
sum over m 0.207398342 0.207398342 0.414796684 0.000000000
s 2 0.014720594 0.014720594 0.029441188 0.000000000
sum over m 0.014720594 0.014720594 0.029441188 0.000000000
sum over m+mul 1.222898695 1.222898695 2.445797389 0.000000000
px 0 1.006387973 1.006387973 2.012775946 0.000000000
py 0 1.006400421 1.006400421 2.012800841 0.000000000
pz 0 1.006194818 1.006194818 2.012389636 0.000000000
sum over m 3.018983212 3.018983212 6.037966423 0.000000000
px 1 0.065427752 0.065427752 0.130855505 0.000000000
py 1 0.065430720 0.065430720 0.130861440 0.000000000
pz 1 0.040362129 0.040362129 0.080724259 0.000000000
sum over m 0.171220602 0.171220602 0.342441203 0.000000000
sum over m+mul 3.190203813 3.190203813 6.380407627 0.000000000
d3z^2-r^2 0 0.196297199 0.196297199 0.392594399 0.000000000
dx^2-y^2 0 0.201534012 0.201534012 0.403068025 0.000000000
dxy 0 0.250918262 0.250918262 0.501836524 0.000000000
dxz 0 0.268505878 0.268505878 0.537011755 0.000000000
dyz 0 0.268497934 0.268497934 0.536995869 0.000000000
sum over m 1.185753286 1.185753286 2.371506572 0.000000000
d3z^2-r^2 1 0.003469582 0.003469582 0.006939165 0.000000000
dx^2-y^2 1 -0.004482525 -0.004482525 -0.008965050 0.000000000
dxy 1 0.015342841 0.015342841 0.030685682 0.000000000
dxz 1 0.003485057 0.003485057 0.006970114 0.000000000
dyz 1 0.003484969 0.003484969 0.006969937 0.000000000
sum over m 0.021299924 0.021299924 0.042599849 0.000000000
sum over m+mul 1.207053210 1.207053210 2.414106421 0.000000000
440 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000786629 1.000786629 2.001573258 0.000000000
sum over m 1.000786629 1.000786629 2.001573258 0.000000000
s 1 0.207412251 0.207412251 0.414824501 0.000000000
sum over m 0.207412251 0.207412251 0.414824501 0.000000000
s 2 0.014723217 0.014723217 0.029446434 0.000000000
sum over m 0.014723217 0.014723217 0.029446434 0.000000000
sum over m+mul 1.222922097 1.222922097 2.445844194 0.000000000
px 0 1.006362926 1.006362926 2.012725851 0.000000000
py 0 1.006379604 1.006379604 2.012759208 0.000000000
pz 0 1.006207568 1.006207568 2.012415136 0.000000000
sum over m 3.018950098 3.018950098 6.037900196 0.000000000
px 1 0.065449661 0.065449661 0.130899321 0.000000000
py 1 0.065424391 0.065424391 0.130848782 0.000000000
pz 1 0.040363083 0.040363083 0.080726165 0.000000000
sum over m 0.171237134 0.171237134 0.342474269 0.000000000
sum over m+mul 3.190187232 3.190187232 6.380374464 0.000000000
d3z^2-r^2 0 0.196314103 0.196314103 0.392628205 0.000000000
dx^2-y^2 0 0.201515300 0.201515300 0.403030601 0.000000000
dxy 0 0.250946196 0.250946196 0.501892392 0.000000000
dxz 0 0.268502100 0.268502100 0.537004199 0.000000000
dyz 0 0.268479092 0.268479092 0.536958184 0.000000000
sum over m 1.185756791 1.185756791 2.371513582 0.000000000
d3z^2-r^2 1 0.003472794 0.003472794 0.006945587 0.000000000
dx^2-y^2 1 -0.004480490 -0.004480490 -0.008960980 0.000000000
dxy 1 0.015341851 0.015341851 0.030683703 0.000000000
dxz 1 0.003492223 0.003492223 0.006984446 0.000000000
dyz 1 0.003489723 0.003489723 0.006979446 0.000000000
sum over m 0.021316101 0.021316101 0.042632201 0.000000000
sum over m+mul 1.207072892 1.207072892 2.414145783 0.000000000
441 O Up spin Down spin Sum Diff
multiple
s 0 0.893895651 0.893895651 1.787791303 0.000000000
sum over m 0.893895651 0.893895651 1.787791303 0.000000000
s 1 -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m+mul 0.890854063 0.890854063 1.781708126 0.000000000
px 0 0.786850013 0.786850013 1.573700026 0.000000000
py 0 0.787109858 0.787109858 1.574219715 0.000000000
pz 0 0.779796894 0.779796894 1.559593789 0.000000000
sum over m 2.353756765 2.353756765 4.707513530 0.000000000
px 1 -0.008731747 -0.008731747 -0.017463493 0.000000000
py 1 -0.008747356 -0.008747356 -0.017494712 0.000000000
pz 1 -0.006464716 -0.006464716 -0.012929431 0.000000000
sum over m -0.023943818 -0.023943818 -0.047887637 0.000000000
sum over m+mul 2.329812947 2.329812947 4.659625893 0.000000000
d3z^2-r^2 0 -0.006391488 -0.006391488 -0.012782975 0.000000000
dx^2-y^2 0 -0.005058784 -0.005058784 -0.010117568 0.000000000
dxy 0 -0.005434639 -0.005434639 -0.010869278 0.000000000
dxz 0 -0.006933227 -0.006933227 -0.013866455 0.000000000
dyz 0 -0.006927417 -0.006927417 -0.013854833 0.000000000
sum over m -0.030745555 -0.030745555 -0.061491109 0.000000000
sum over m+mul -0.030745555 -0.030745555 -0.061491109 0.000000000
442 O Up spin Down spin Sum Diff
multiple
s 0 0.893891025 0.893891025 1.787782050 0.000000000
sum over m 0.893891025 0.893891025 1.787782050 0.000000000
s 1 -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m+mul 0.890848335 0.890848335 1.781696669 0.000000000
px 0 0.787044161 0.787044161 1.574088321 0.000000000
py 0 0.786953979 0.786953979 1.573907958 0.000000000
pz 0 0.779742007 0.779742007 1.559484015 0.000000000
sum over m 2.353740147 2.353740147 4.707480294 0.000000000
px 1 -0.008733766 -0.008733766 -0.017467533 0.000000000
py 1 -0.008738783 -0.008738783 -0.017477566 0.000000000
pz 1 -0.006460365 -0.006460365 -0.012920731 0.000000000
sum over m -0.023932915 -0.023932915 -0.047865830 0.000000000
sum over m+mul 2.329807232 2.329807232 4.659614464 0.000000000
d3z^2-r^2 0 -0.006389838 -0.006389838 -0.012779676 0.000000000
dx^2-y^2 0 -0.005056265 -0.005056265 -0.010112529 0.000000000
dxy 0 -0.005433964 -0.005433964 -0.010867928 0.000000000
dxz 0 -0.006927781 -0.006927781 -0.013855563 0.000000000
dyz 0 -0.006927405 -0.006927405 -0.013854811 0.000000000
sum over m -0.030735253 -0.030735253 -0.061470507 0.000000000
sum over m+mul -0.030735253 -0.030735253 -0.061470507 0.000000000
443 O Up spin Down spin Sum Diff
multiple
s 0 0.893859606 0.893859606 1.787719211 0.000000000
sum over m 0.893859606 0.893859606 1.787719211 0.000000000
s 1 -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m+mul 0.890817400 0.890817400 1.781634799 0.000000000
px 0 0.786920290 0.786920290 1.573840580 0.000000000
py 0 0.786920140 0.786920140 1.573840280 0.000000000
pz 0 0.779851140 0.779851140 1.559702279 0.000000000
sum over m 2.353691570 2.353691570 4.707383139 0.000000000
px 1 -0.008726755 -0.008726755 -0.017453510 0.000000000
py 1 -0.008734849 -0.008734849 -0.017469697 0.000000000
pz 1 -0.006464764 -0.006464764 -0.012929529 0.000000000
sum over m -0.023926368 -0.023926368 -0.047852736 0.000000000
sum over m+mul 2.329765201 2.329765201 4.659530403 0.000000000
d3z^2-r^2 0 -0.006389399 -0.006389399 -0.012778798 0.000000000
dx^2-y^2 0 -0.005060127 -0.005060127 -0.010120254 0.000000000
dxy 0 -0.005433050 -0.005433050 -0.010866099 0.000000000
dxz 0 -0.006932951 -0.006932951 -0.013865902 0.000000000
dyz 0 -0.006931581 -0.006931581 -0.013863162 0.000000000
sum over m -0.030747107 -0.030747107 -0.061494214 0.000000000
sum over m+mul -0.030747107 -0.030747107 -0.061494214 0.000000000
444 O Up spin Down spin Sum Diff
multiple
s 0 0.893902429 0.893902429 1.787804858 0.000000000
sum over m 0.893902429 0.893902429 1.787804858 0.000000000
s 1 -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m+mul 0.890860132 0.890860132 1.781720264 0.000000000
px 0 0.787083683 0.787083683 1.574167366 0.000000000
py 0 0.786938366 0.786938366 1.573876732 0.000000000
pz 0 0.779721516 0.779721516 1.559443032 0.000000000
sum over m 2.353743565 2.353743565 4.707487130 0.000000000
px 1 -0.008739175 -0.008739175 -0.017478349 0.000000000
py 1 -0.008738389 -0.008738389 -0.017476778 0.000000000
pz 1 -0.006462094 -0.006462094 -0.012924187 0.000000000
sum over m -0.023939657 -0.023939657 -0.047879315 0.000000000
sum over m+mul 2.329803908 2.329803908 4.659607815 0.000000000
d3z^2-r^2 0 -0.006390665 -0.006390665 -0.012781330 0.000000000
dx^2-y^2 0 -0.005055239 -0.005055239 -0.010110477 0.000000000
dxy 0 -0.005434586 -0.005434586 -0.010869173 0.000000000
dxz 0 -0.006926101 -0.006926101 -0.013852202 0.000000000
dyz 0 -0.006927242 -0.006927242 -0.013854483 0.000000000
sum over m -0.030733833 -0.030733833 -0.061467665 0.000000000
sum over m+mul -0.030733833 -0.030733833 -0.061467665 0.000000000
445 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779758 1.000779758 2.001559517 0.000000000
sum over m 1.000779758 1.000779758 2.001559517 0.000000000
s 1 0.207398342 0.207398342 0.414796684 0.000000000
sum over m 0.207398342 0.207398342 0.414796684 0.000000000
s 2 0.014720594 0.014720594 0.029441188 0.000000000
sum over m 0.014720594 0.014720594 0.029441188 0.000000000
sum over m+mul 1.222898694 1.222898694 2.445797389 0.000000000
px 0 1.006387973 1.006387973 2.012775946 0.000000000
py 0 1.006400421 1.006400421 2.012800841 0.000000000
pz 0 1.006194818 1.006194818 2.012389636 0.000000000
sum over m 3.018983212 3.018983212 6.037966423 0.000000000
px 1 0.065427752 0.065427752 0.130855505 0.000000000
py 1 0.065430720 0.065430720 0.130861440 0.000000000
pz 1 0.040362129 0.040362129 0.080724259 0.000000000
sum over m 0.171220602 0.171220602 0.342441203 0.000000000
sum over m+mul 3.190203813 3.190203813 6.380407626 0.000000000
d3z^2-r^2 0 0.196297199 0.196297199 0.392594399 0.000000000
dx^2-y^2 0 0.201534013 0.201534013 0.403068025 0.000000000
dxy 0 0.250918262 0.250918262 0.501836525 0.000000000
dxz 0 0.268505878 0.268505878 0.537011756 0.000000000
dyz 0 0.268497935 0.268497935 0.536995869 0.000000000
sum over m 1.185753286 1.185753286 2.371506573 0.000000000
d3z^2-r^2 1 0.003469582 0.003469582 0.006939165 0.000000000
dx^2-y^2 1 -0.004482525 -0.004482525 -0.008965050 0.000000000
dxy 1 0.015342841 0.015342841 0.030685682 0.000000000
dxz 1 0.003485057 0.003485057 0.006970114 0.000000000
dyz 1 0.003484969 0.003484969 0.006969937 0.000000000
sum over m 0.021299924 0.021299924 0.042599849 0.000000000
sum over m+mul 1.207053211 1.207053211 2.414106422 0.000000000
446 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000786629 1.000786629 2.001573258 0.000000000
sum over m 1.000786629 1.000786629 2.001573258 0.000000000
s 1 0.207412251 0.207412251 0.414824501 0.000000000
sum over m 0.207412251 0.207412251 0.414824501 0.000000000
s 2 0.014723217 0.014723217 0.029446435 0.000000000
sum over m 0.014723217 0.014723217 0.029446435 0.000000000
sum over m+mul 1.222922097 1.222922097 2.445844194 0.000000000
px 0 1.006362926 1.006362926 2.012725851 0.000000000
py 0 1.006379604 1.006379604 2.012759208 0.000000000
pz 0 1.006207568 1.006207568 2.012415136 0.000000000
sum over m 3.018950098 3.018950098 6.037900196 0.000000000
px 1 0.065449661 0.065449661 0.130899321 0.000000000
py 1 0.065424391 0.065424391 0.130848782 0.000000000
pz 1 0.040363083 0.040363083 0.080726166 0.000000000
sum over m 0.171237135 0.171237135 0.342474269 0.000000000
sum over m+mul 3.190187233 3.190187233 6.380374465 0.000000000
d3z^2-r^2 0 0.196314103 0.196314103 0.392628205 0.000000000
dx^2-y^2 0 0.201515300 0.201515300 0.403030601 0.000000000
dxy 0 0.250946197 0.250946197 0.501892393 0.000000000
dxz 0 0.268502100 0.268502100 0.537004199 0.000000000
dyz 0 0.268479092 0.268479092 0.536958185 0.000000000
sum over m 1.185756792 1.185756792 2.371513583 0.000000000
d3z^2-r^2 1 0.003472794 0.003472794 0.006945587 0.000000000
dx^2-y^2 1 -0.004480490 -0.004480490 -0.008960980 0.000000000
dxy 1 0.015341851 0.015341851 0.030683703 0.000000000
dxz 1 0.003492223 0.003492223 0.006984446 0.000000000
dyz 1 0.003489723 0.003489723 0.006979446 0.000000000
sum over m 0.021316101 0.021316101 0.042632201 0.000000000
sum over m+mul 1.207072892 1.207072892 2.414145784 0.000000000
447 O Up spin Down spin Sum Diff
multiple
s 0 0.893895651 0.893895651 1.787791303 0.000000000
sum over m 0.893895651 0.893895651 1.787791303 0.000000000
s 1 -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m+mul 0.890854063 0.890854063 1.781708126 0.000000000
px 0 0.786850013 0.786850013 1.573700026 0.000000000
py 0 0.787109858 0.787109858 1.574219715 0.000000000
pz 0 0.779796894 0.779796894 1.559593789 0.000000000
sum over m 2.353756765 2.353756765 4.707513530 0.000000000
px 1 -0.008731747 -0.008731747 -0.017463493 0.000000000
py 1 -0.008747356 -0.008747356 -0.017494712 0.000000000
pz 1 -0.006464716 -0.006464716 -0.012929431 0.000000000
sum over m -0.023943818 -0.023943818 -0.047887637 0.000000000
sum over m+mul 2.329812946 2.329812946 4.659625893 0.000000000
d3z^2-r^2 0 -0.006391488 -0.006391488 -0.012782975 0.000000000
dx^2-y^2 0 -0.005058784 -0.005058784 -0.010117568 0.000000000
dxy 0 -0.005434639 -0.005434639 -0.010869278 0.000000000
dxz 0 -0.006933227 -0.006933227 -0.013866455 0.000000000
dyz 0 -0.006927417 -0.006927417 -0.013854833 0.000000000
sum over m -0.030745555 -0.030745555 -0.061491109 0.000000000
sum over m+mul -0.030745555 -0.030745555 -0.061491109 0.000000000
448 O Up spin Down spin Sum Diff
multiple
s 0 0.893891025 0.893891025 1.787782050 0.000000000
sum over m 0.893891025 0.893891025 1.787782050 0.000000000
s 1 -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m+mul 0.890848335 0.890848335 1.781696669 0.000000000
px 0 0.787044160 0.787044160 1.574088321 0.000000000
py 0 0.786953979 0.786953979 1.573907957 0.000000000
pz 0 0.779742007 0.779742007 1.559484015 0.000000000
sum over m 2.353740147 2.353740147 4.707480293 0.000000000
px 1 -0.008733767 -0.008733767 -0.017467533 0.000000000
py 1 -0.008738783 -0.008738783 -0.017477567 0.000000000
pz 1 -0.006460366 -0.006460366 -0.012920731 0.000000000
sum over m -0.023932915 -0.023932915 -0.047865831 0.000000000
sum over m+mul 2.329807231 2.329807231 4.659614463 0.000000000
d3z^2-r^2 0 -0.006389838 -0.006389838 -0.012779676 0.000000000
dx^2-y^2 0 -0.005056265 -0.005056265 -0.010112529 0.000000000
dxy 0 -0.005433964 -0.005433964 -0.010867928 0.000000000
dxz 0 -0.006927781 -0.006927781 -0.013855563 0.000000000
dyz 0 -0.006927405 -0.006927405 -0.013854811 0.000000000
sum over m -0.030735254 -0.030735254 -0.061470507 0.000000000
sum over m+mul -0.030735254 -0.030735254 -0.061470507 0.000000000
449 O Up spin Down spin Sum Diff
multiple
s 0 0.893859606 0.893859606 1.787719211 0.000000000
sum over m 0.893859606 0.893859606 1.787719211 0.000000000
s 1 -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m+mul 0.890817400 0.890817400 1.781634799 0.000000000
px 0 0.786920290 0.786920290 1.573840580 0.000000000
py 0 0.786920140 0.786920140 1.573840279 0.000000000
pz 0 0.779851139 0.779851139 1.559702279 0.000000000
sum over m 2.353691569 2.353691569 4.707383138 0.000000000
px 1 -0.008726755 -0.008726755 -0.017453510 0.000000000
py 1 -0.008734849 -0.008734849 -0.017469697 0.000000000
pz 1 -0.006464764 -0.006464764 -0.012929529 0.000000000
sum over m -0.023926368 -0.023926368 -0.047852736 0.000000000
sum over m+mul 2.329765201 2.329765201 4.659530402 0.000000000
d3z^2-r^2 0 -0.006389399 -0.006389399 -0.012778798 0.000000000
dx^2-y^2 0 -0.005060127 -0.005060127 -0.010120254 0.000000000
dxy 0 -0.005433050 -0.005433050 -0.010866099 0.000000000
dxz 0 -0.006932951 -0.006932951 -0.013865902 0.000000000
dyz 0 -0.006931581 -0.006931581 -0.013863162 0.000000000
sum over m -0.030747107 -0.030747107 -0.061494214 0.000000000
sum over m+mul -0.030747107 -0.030747107 -0.061494214 0.000000000
450 O Up spin Down spin Sum Diff
multiple
s 0 0.893902429 0.893902429 1.787804857 0.000000000
sum over m 0.893902429 0.893902429 1.787804857 0.000000000
s 1 -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m+mul 0.890860132 0.890860132 1.781720263 0.000000000
px 0 0.787083683 0.787083683 1.574167366 0.000000000
py 0 0.786938366 0.786938366 1.573876732 0.000000000
pz 0 0.779721516 0.779721516 1.559443032 0.000000000
sum over m 2.353743565 2.353743565 4.707487129 0.000000000
px 1 -0.008739175 -0.008739175 -0.017478349 0.000000000
py 1 -0.008738389 -0.008738389 -0.017476778 0.000000000
pz 1 -0.006462094 -0.006462094 -0.012924187 0.000000000
sum over m -0.023939657 -0.023939657 -0.047879315 0.000000000
sum over m+mul 2.329803907 2.329803907 4.659607814 0.000000000
d3z^2-r^2 0 -0.006390665 -0.006390665 -0.012781330 0.000000000
dx^2-y^2 0 -0.005055239 -0.005055239 -0.010110477 0.000000000
dxy 0 -0.005434586 -0.005434586 -0.010869173 0.000000000
dxz 0 -0.006926101 -0.006926101 -0.013852202 0.000000000
dyz 0 -0.006927242 -0.006927242 -0.013854483 0.000000000
sum over m -0.030733833 -0.030733833 -0.061467665 0.000000000
sum over m+mul -0.030733833 -0.030733833 -0.061467665 0.000000000
451 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779759 1.000779759 2.001559517 0.000000000
sum over m 1.000779759 1.000779759 2.001559517 0.000000000
s 1 0.207398342 0.207398342 0.414796684 0.000000000
sum over m 0.207398342 0.207398342 0.414796684 0.000000000
s 2 0.014720594 0.014720594 0.029441188 0.000000000
sum over m 0.014720594 0.014720594 0.029441188 0.000000000
sum over m+mul 1.222898695 1.222898695 2.445797389 0.000000000
px 0 1.006387973 1.006387973 2.012775946 0.000000000
py 0 1.006400421 1.006400421 2.012800841 0.000000000
pz 0 1.006194818 1.006194818 2.012389636 0.000000000
sum over m 3.018983212 3.018983212 6.037966423 0.000000000
px 1 0.065427752 0.065427752 0.130855505 0.000000000
py 1 0.065430720 0.065430720 0.130861440 0.000000000
pz 1 0.040362129 0.040362129 0.080724258 0.000000000
sum over m 0.171220601 0.171220601 0.342441203 0.000000000
sum over m+mul 3.190203813 3.190203813 6.380407626 0.000000000
d3z^2-r^2 0 0.196297199 0.196297199 0.392594399 0.000000000
dx^2-y^2 0 0.201534012 0.201534012 0.403068025 0.000000000
dxy 0 0.250918263 0.250918263 0.501836525 0.000000000
dxz 0 0.268505878 0.268505878 0.537011756 0.000000000
dyz 0 0.268497934 0.268497934 0.536995869 0.000000000
sum over m 1.185753286 1.185753286 2.371506573 0.000000000
d3z^2-r^2 1 0.003469582 0.003469582 0.006939165 0.000000000
dx^2-y^2 1 -0.004482525 -0.004482525 -0.008965050 0.000000000
dxy 1 0.015342841 0.015342841 0.030685682 0.000000000
dxz 1 0.003485057 0.003485057 0.006970114 0.000000000
dyz 1 0.003484969 0.003484969 0.006969937 0.000000000
sum over m 0.021299924 0.021299924 0.042599849 0.000000000
sum over m+mul 1.207053211 1.207053211 2.414106421 0.000000000
452 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000786629 1.000786629 2.001573258 0.000000000
sum over m 1.000786629 1.000786629 2.001573258 0.000000000
s 1 0.207412251 0.207412251 0.414824502 0.000000000
sum over m 0.207412251 0.207412251 0.414824502 0.000000000
s 2 0.014723217 0.014723217 0.029446434 0.000000000
sum over m 0.014723217 0.014723217 0.029446434 0.000000000
sum over m+mul 1.222922097 1.222922097 2.445844194 0.000000000
px 0 1.006362926 1.006362926 2.012725851 0.000000000
py 0 1.006379604 1.006379604 2.012759208 0.000000000
pz 0 1.006207568 1.006207568 2.012415137 0.000000000
sum over m 3.018950098 3.018950098 6.037900196 0.000000000
px 1 0.065449661 0.065449661 0.130899321 0.000000000
py 1 0.065424391 0.065424391 0.130848783 0.000000000
pz 1 0.040363083 0.040363083 0.080726166 0.000000000
sum over m 0.171237135 0.171237135 0.342474270 0.000000000
sum over m+mul 3.190187233 3.190187233 6.380374466 0.000000000
d3z^2-r^2 0 0.196314103 0.196314103 0.392628205 0.000000000
dx^2-y^2 0 0.201515301 0.201515301 0.403030601 0.000000000
dxy 0 0.250946197 0.250946197 0.501892393 0.000000000
dxz 0 0.268502099 0.268502099 0.537004199 0.000000000
dyz 0 0.268479092 0.268479092 0.536958184 0.000000000
sum over m 1.185756791 1.185756791 2.371513583 0.000000000
d3z^2-r^2 1 0.003472794 0.003472794 0.006945587 0.000000000
dx^2-y^2 1 -0.004480490 -0.004480490 -0.008960980 0.000000000
dxy 1 0.015341851 0.015341851 0.030683703 0.000000000
dxz 1 0.003492223 0.003492223 0.006984446 0.000000000
dyz 1 0.003489723 0.003489723 0.006979446 0.000000000
sum over m 0.021316101 0.021316101 0.042632201 0.000000000
sum over m+mul 1.207072892 1.207072892 2.414145784 0.000000000
453 O Up spin Down spin Sum Diff
multiple
s 0 0.893895651 0.893895651 1.787791303 0.000000000
sum over m 0.893895651 0.893895651 1.787791303 0.000000000
s 1 -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m+mul 0.890854063 0.890854063 1.781708126 0.000000000
px 0 0.786850013 0.786850013 1.573700025 0.000000000
py 0 0.787109858 0.787109858 1.574219715 0.000000000
pz 0 0.779796894 0.779796894 1.559593789 0.000000000
sum over m 2.353756764 2.353756764 4.707513529 0.000000000
px 1 -0.008731747 -0.008731747 -0.017463493 0.000000000
py 1 -0.008747356 -0.008747356 -0.017494712 0.000000000
pz 1 -0.006464716 -0.006464716 -0.012929431 0.000000000
sum over m -0.023943818 -0.023943818 -0.047887637 0.000000000
sum over m+mul 2.329812946 2.329812946 4.659625892 0.000000000
d3z^2-r^2 0 -0.006391488 -0.006391488 -0.012782975 0.000000000
dx^2-y^2 0 -0.005058784 -0.005058784 -0.010117568 0.000000000
dxy 0 -0.005434639 -0.005434639 -0.010869278 0.000000000
dxz 0 -0.006933227 -0.006933227 -0.013866455 0.000000000
dyz 0 -0.006927417 -0.006927417 -0.013854833 0.000000000
sum over m -0.030745555 -0.030745555 -0.061491109 0.000000000
sum over m+mul -0.030745555 -0.030745555 -0.061491109 0.000000000
454 O Up spin Down spin Sum Diff
multiple
s 0 0.893891025 0.893891025 1.787782050 0.000000000
sum over m 0.893891025 0.893891025 1.787782050 0.000000000
s 1 -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m+mul 0.890848335 0.890848335 1.781696669 0.000000000
px 0 0.787044160 0.787044160 1.574088321 0.000000000
py 0 0.786953979 0.786953979 1.573907958 0.000000000
pz 0 0.779742007 0.779742007 1.559484014 0.000000000
sum over m 2.353740146 2.353740146 4.707480293 0.000000000
px 1 -0.008733767 -0.008733767 -0.017467533 0.000000000
py 1 -0.008738783 -0.008738783 -0.017477566 0.000000000
pz 1 -0.006460366 -0.006460366 -0.012920731 0.000000000
sum over m -0.023932915 -0.023932915 -0.047865831 0.000000000
sum over m+mul 2.329807231 2.329807231 4.659614462 0.000000000
d3z^2-r^2 0 -0.006389838 -0.006389838 -0.012779676 0.000000000
dx^2-y^2 0 -0.005056265 -0.005056265 -0.010112529 0.000000000
dxy 0 -0.005433964 -0.005433964 -0.010867928 0.000000000
dxz 0 -0.006927781 -0.006927781 -0.013855563 0.000000000
dyz 0 -0.006927405 -0.006927405 -0.013854811 0.000000000
sum over m -0.030735253 -0.030735253 -0.061470507 0.000000000
sum over m+mul -0.030735253 -0.030735253 -0.061470507 0.000000000
455 O Up spin Down spin Sum Diff
multiple
s 0 0.893859606 0.893859606 1.787719211 0.000000000
sum over m 0.893859606 0.893859606 1.787719211 0.000000000
s 1 -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m+mul 0.890817400 0.890817400 1.781634799 0.000000000
px 0 0.786920290 0.786920290 1.573840580 0.000000000
py 0 0.786920140 0.786920140 1.573840280 0.000000000
pz 0 0.779851139 0.779851139 1.559702279 0.000000000
sum over m 2.353691570 2.353691570 4.707383139 0.000000000
px 1 -0.008726755 -0.008726755 -0.017453510 0.000000000
py 1 -0.008734849 -0.008734849 -0.017469698 0.000000000
pz 1 -0.006464764 -0.006464764 -0.012929529 0.000000000
sum over m -0.023926368 -0.023926368 -0.047852736 0.000000000
sum over m+mul 2.329765201 2.329765201 4.659530403 0.000000000
d3z^2-r^2 0 -0.006389399 -0.006389399 -0.012778798 0.000000000
dx^2-y^2 0 -0.005060127 -0.005060127 -0.010120254 0.000000000
dxy 0 -0.005433050 -0.005433050 -0.010866099 0.000000000
dxz 0 -0.006932951 -0.006932951 -0.013865902 0.000000000
dyz 0 -0.006931581 -0.006931581 -0.013863162 0.000000000
sum over m -0.030747107 -0.030747107 -0.061494214 0.000000000
sum over m+mul -0.030747107 -0.030747107 -0.061494214 0.000000000
456 O Up spin Down spin Sum Diff
multiple
s 0 0.893902429 0.893902429 1.787804857 0.000000000
sum over m 0.893902429 0.893902429 1.787804857 0.000000000
s 1 -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m+mul 0.890860132 0.890860132 1.781720264 0.000000000
px 0 0.787083683 0.787083683 1.574167366 0.000000000
py 0 0.786938366 0.786938366 1.573876732 0.000000000
pz 0 0.779721516 0.779721516 1.559443032 0.000000000
sum over m 2.353743565 2.353743565 4.707487129 0.000000000
px 1 -0.008739175 -0.008739175 -0.017478349 0.000000000
py 1 -0.008738389 -0.008738389 -0.017476778 0.000000000
pz 1 -0.006462094 -0.006462094 -0.012924187 0.000000000
sum over m -0.023939657 -0.023939657 -0.047879315 0.000000000
sum over m+mul 2.329803907 2.329803907 4.659607815 0.000000000
d3z^2-r^2 0 -0.006390665 -0.006390665 -0.012781330 0.000000000
dx^2-y^2 0 -0.005055239 -0.005055239 -0.010110477 0.000000000
dxy 0 -0.005434586 -0.005434586 -0.010869173 0.000000000
dxz 0 -0.006926101 -0.006926101 -0.013852202 0.000000000
dyz 0 -0.006927242 -0.006927242 -0.013854483 0.000000000
sum over m -0.030733833 -0.030733833 -0.061467665 0.000000000
sum over m+mul -0.030733833 -0.030733833 -0.061467665 0.000000000
457 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779758 1.000779758 2.001559517 0.000000000
sum over m 1.000779758 1.000779758 2.001559517 0.000000000
s 1 0.207398342 0.207398342 0.414796684 0.000000000
sum over m 0.207398342 0.207398342 0.414796684 0.000000000
s 2 0.014720594 0.014720594 0.029441188 0.000000000
sum over m 0.014720594 0.014720594 0.029441188 0.000000000
sum over m+mul 1.222898694 1.222898694 2.445797389 0.000000000
px 0 1.006387973 1.006387973 2.012775946 0.000000000
py 0 1.006400421 1.006400421 2.012800841 0.000000000
pz 0 1.006194818 1.006194818 2.012389636 0.000000000
sum over m 3.018983211 3.018983211 6.037966423 0.000000000
px 1 0.065427752 0.065427752 0.130855505 0.000000000
py 1 0.065430720 0.065430720 0.130861440 0.000000000
pz 1 0.040362129 0.040362129 0.080724258 0.000000000
sum over m 0.171220601 0.171220601 0.342441203 0.000000000
sum over m+mul 3.190203813 3.190203813 6.380407625 0.000000000
d3z^2-r^2 0 0.196297199 0.196297199 0.392594399 0.000000000
dx^2-y^2 0 0.201534012 0.201534012 0.403068025 0.000000000
dxy 0 0.250918262 0.250918262 0.501836525 0.000000000
dxz 0 0.268505877 0.268505877 0.537011755 0.000000000
dyz 0 0.268497934 0.268497934 0.536995868 0.000000000
sum over m 1.185753286 1.185753286 2.371506571 0.000000000
d3z^2-r^2 1 0.003469582 0.003469582 0.006939165 0.000000000
dx^2-y^2 1 -0.004482525 -0.004482525 -0.008965050 0.000000000
dxy 1 0.015342841 0.015342841 0.030685682 0.000000000
dxz 1 0.003485057 0.003485057 0.006970114 0.000000000
dyz 1 0.003484969 0.003484969 0.006969937 0.000000000
sum over m 0.021299924 0.021299924 0.042599849 0.000000000
sum over m+mul 1.207053210 1.207053210 2.414106420 0.000000000
458 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000786629 1.000786629 2.001573258 0.000000000
sum over m 1.000786629 1.000786629 2.001573258 0.000000000
s 1 0.207412251 0.207412251 0.414824502 0.000000000
sum over m 0.207412251 0.207412251 0.414824502 0.000000000
s 2 0.014723217 0.014723217 0.029446435 0.000000000
sum over m 0.014723217 0.014723217 0.029446435 0.000000000
sum over m+mul 1.222922097 1.222922097 2.445844194 0.000000000
px 0 1.006362926 1.006362926 2.012725851 0.000000000
py 0 1.006379604 1.006379604 2.012759208 0.000000000
pz 0 1.006207568 1.006207568 2.012415137 0.000000000
sum over m 3.018950098 3.018950098 6.037900196 0.000000000
px 1 0.065449661 0.065449661 0.130899321 0.000000000
py 1 0.065424391 0.065424391 0.130848782 0.000000000
pz 1 0.040363083 0.040363083 0.080726166 0.000000000
sum over m 0.171237135 0.171237135 0.342474270 0.000000000
sum over m+mul 3.190187233 3.190187233 6.380374466 0.000000000
d3z^2-r^2 0 0.196314103 0.196314103 0.392628205 0.000000000
dx^2-y^2 0 0.201515300 0.201515300 0.403030601 0.000000000
dxy 0 0.250946196 0.250946196 0.501892393 0.000000000
dxz 0 0.268502099 0.268502099 0.537004199 0.000000000
dyz 0 0.268479092 0.268479092 0.536958185 0.000000000
sum over m 1.185756791 1.185756791 2.371513582 0.000000000
d3z^2-r^2 1 0.003472794 0.003472794 0.006945587 0.000000000
dx^2-y^2 1 -0.004480490 -0.004480490 -0.008960980 0.000000000
dxy 1 0.015341851 0.015341851 0.030683703 0.000000000
dxz 1 0.003492223 0.003492223 0.006984446 0.000000000
dyz 1 0.003489723 0.003489723 0.006979446 0.000000000
sum over m 0.021316101 0.021316101 0.042632202 0.000000000
sum over m+mul 1.207072892 1.207072892 2.414145784 0.000000000
459 O Up spin Down spin Sum Diff
multiple
s 0 0.893895651 0.893895651 1.787791303 0.000000000
sum over m 0.893895651 0.893895651 1.787791303 0.000000000
s 1 -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m -0.003041588 -0.003041588 -0.006083176 0.000000000
sum over m+mul 0.890854063 0.890854063 1.781708126 0.000000000
px 0 0.786850013 0.786850013 1.573700026 0.000000000
py 0 0.787109857 0.787109857 1.574219715 0.000000000
pz 0 0.779796894 0.779796894 1.559593789 0.000000000
sum over m 2.353756765 2.353756765 4.707513529 0.000000000
px 1 -0.008731747 -0.008731747 -0.017463493 0.000000000
py 1 -0.008747356 -0.008747356 -0.017494712 0.000000000
pz 1 -0.006464716 -0.006464716 -0.012929431 0.000000000
sum over m -0.023943818 -0.023943818 -0.047887637 0.000000000
sum over m+mul 2.329812946 2.329812946 4.659625893 0.000000000
d3z^2-r^2 0 -0.006391488 -0.006391488 -0.012782975 0.000000000
dx^2-y^2 0 -0.005058784 -0.005058784 -0.010117568 0.000000000
dxy 0 -0.005434639 -0.005434639 -0.010869278 0.000000000
dxz 0 -0.006933227 -0.006933227 -0.013866455 0.000000000
dyz 0 -0.006927417 -0.006927417 -0.013854833 0.000000000
sum over m -0.030745555 -0.030745555 -0.061491109 0.000000000
sum over m+mul -0.030745555 -0.030745555 -0.061491109 0.000000000
460 O Up spin Down spin Sum Diff
multiple
s 0 0.893891025 0.893891025 1.787782051 0.000000000
sum over m 0.893891025 0.893891025 1.787782051 0.000000000
s 1 -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m -0.003042691 -0.003042691 -0.006085381 0.000000000
sum over m+mul 0.890848335 0.890848335 1.781696669 0.000000000
px 0 0.787044160 0.787044160 1.574088321 0.000000000
py 0 0.786953979 0.786953979 1.573907958 0.000000000
pz 0 0.779742007 0.779742007 1.559484015 0.000000000
sum over m 2.353740147 2.353740147 4.707480293 0.000000000
px 1 -0.008733766 -0.008733766 -0.017467533 0.000000000
py 1 -0.008738783 -0.008738783 -0.017477566 0.000000000
pz 1 -0.006460366 -0.006460366 -0.012920731 0.000000000
sum over m -0.023932915 -0.023932915 -0.047865830 0.000000000
sum over m+mul 2.329807231 2.329807231 4.659614463 0.000000000
d3z^2-r^2 0 -0.006389838 -0.006389838 -0.012779676 0.000000000
dx^2-y^2 0 -0.005056265 -0.005056265 -0.010112529 0.000000000
dxy 0 -0.005433964 -0.005433964 -0.010867928 0.000000000
dxz 0 -0.006927781 -0.006927781 -0.013855563 0.000000000
dyz 0 -0.006927405 -0.006927405 -0.013854811 0.000000000
sum over m -0.030735254 -0.030735254 -0.061470507 0.000000000
sum over m+mul -0.030735254 -0.030735254 -0.061470507 0.000000000
461 O Up spin Down spin Sum Diff
multiple
s 0 0.893859606 0.893859606 1.787719211 0.000000000
sum over m 0.893859606 0.893859606 1.787719211 0.000000000
s 1 -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m -0.003042206 -0.003042206 -0.006084412 0.000000000
sum over m+mul 0.890817400 0.890817400 1.781634799 0.000000000
px 0 0.786920290 0.786920290 1.573840580 0.000000000
py 0 0.786920140 0.786920140 1.573840280 0.000000000
pz 0 0.779851139 0.779851139 1.559702279 0.000000000
sum over m 2.353691569 2.353691569 4.707383138 0.000000000
px 1 -0.008726755 -0.008726755 -0.017453510 0.000000000
py 1 -0.008734849 -0.008734849 -0.017469698 0.000000000
pz 1 -0.006464764 -0.006464764 -0.012929529 0.000000000
sum over m -0.023926368 -0.023926368 -0.047852736 0.000000000
sum over m+mul 2.329765201 2.329765201 4.659530402 0.000000000
d3z^2-r^2 0 -0.006389399 -0.006389399 -0.012778798 0.000000000
dx^2-y^2 0 -0.005060127 -0.005060127 -0.010120254 0.000000000
dxy 0 -0.005433050 -0.005433050 -0.010866099 0.000000000
dxz 0 -0.006932951 -0.006932951 -0.013865902 0.000000000
dyz 0 -0.006931581 -0.006931581 -0.013863162 0.000000000
sum over m -0.030747107 -0.030747107 -0.061494214 0.000000000
sum over m+mul -0.030747107 -0.030747107 -0.061494214 0.000000000
462 O Up spin Down spin Sum Diff
multiple
s 0 0.893902429 0.893902429 1.787804857 0.000000000
sum over m 0.893902429 0.893902429 1.787804857 0.000000000
s 1 -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m -0.003042297 -0.003042297 -0.006084594 0.000000000
sum over m+mul 0.890860132 0.890860132 1.781720264 0.000000000
px 0 0.787083683 0.787083683 1.574167366 0.000000000
py 0 0.786938366 0.786938366 1.573876731 0.000000000
pz 0 0.779721516 0.779721516 1.559443032 0.000000000
sum over m 2.353743565 2.353743565 4.707487129 0.000000000
px 1 -0.008739175 -0.008739175 -0.017478349 0.000000000
py 1 -0.008738389 -0.008738389 -0.017476778 0.000000000
pz 1 -0.006462094 -0.006462094 -0.012924187 0.000000000
sum over m -0.023939657 -0.023939657 -0.047879315 0.000000000
sum over m+mul 2.329803907 2.329803907 4.659607815 0.000000000
d3z^2-r^2 0 -0.006390665 -0.006390665 -0.012781330 0.000000000
dx^2-y^2 0 -0.005055239 -0.005055239 -0.010110477 0.000000000
dxy 0 -0.005434586 -0.005434586 -0.010869173 0.000000000
dxz 0 -0.006926101 -0.006926101 -0.013852202 0.000000000
dyz 0 -0.006927242 -0.006927242 -0.013854483 0.000000000
sum over m -0.030733833 -0.030733833 -0.061467665 0.000000000
sum over m+mul -0.030733833 -0.030733833 -0.061467665 0.000000000
463 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000794346 1.000794346 2.001588692 0.000000000
sum over m 1.000794346 1.000794346 2.001588692 0.000000000
s 1 0.207399176 0.207399176 0.414798352 0.000000000
sum over m 0.207399176 0.207399176 0.414798352 0.000000000
s 2 0.014720923 0.014720923 0.029441846 0.000000000
sum over m 0.014720923 0.014720923 0.029441846 0.000000000
sum over m+mul 1.222914444 1.222914444 2.445828889 0.000000000
px 0 1.006370005 1.006370005 2.012740010 0.000000000
py 0 1.006381344 1.006381344 2.012762688 0.000000000
pz 0 1.006214474 1.006214474 2.012428949 0.000000000
sum over m 3.018965824 3.018965824 6.037931647 0.000000000
px 1 0.065452018 0.065452018 0.130904035 0.000000000
py 1 0.065434731 0.065434731 0.130869461 0.000000000
pz 1 0.040359774 0.040359774 0.080719548 0.000000000
sum over m 0.171246522 0.171246522 0.342493045 0.000000000
sum over m+mul 3.190212346 3.190212346 6.380424692 0.000000000
d3z^2-r^2 0 0.196317000 0.196317000 0.392634000 0.000000000
dx^2-y^2 0 0.201535059 0.201535059 0.403070119 0.000000000
dxy 0 0.250932486 0.250932486 0.501864972 0.000000000
dxz 0 0.268493958 0.268493958 0.536987917 0.000000000
dyz 0 0.268481712 0.268481712 0.536963424 0.000000000
sum over m 1.185760216 1.185760216 2.371520432 0.000000000
d3z^2-r^2 1 0.003471608 0.003471608 0.006943216 0.000000000
dx^2-y^2 1 -0.004483514 -0.004483514 -0.008967027 0.000000000
dxy 1 0.015345845 0.015345845 0.030691691 0.000000000
dxz 1 0.003490453 0.003490453 0.006980907 0.000000000
dyz 1 0.003488639 0.003488639 0.006977279 0.000000000
sum over m 0.021313033 0.021313033 0.042626066 0.000000000
sum over m+mul 1.207073249 1.207073249 2.414146498 0.000000000
464 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000774711 1.000774711 2.001549422 0.000000000
sum over m 1.000774711 1.000774711 2.001549422 0.000000000
s 1 0.207407309 0.207407309 0.414814618 0.000000000
sum over m 0.207407309 0.207407309 0.414814618 0.000000000
s 2 0.014723324 0.014723324 0.029446649 0.000000000
sum over m 0.014723324 0.014723324 0.029446649 0.000000000
sum over m+mul 1.222905344 1.222905344 2.445810689 0.000000000
px 0 1.006372285 1.006372285 2.012744570 0.000000000
py 0 1.006382809 1.006382809 2.012765618 0.000000000
pz 0 1.006198612 1.006198612 2.012397224 0.000000000
sum over m 3.018953706 3.018953706 6.037907412 0.000000000
px 1 0.065429039 0.065429039 0.130858078 0.000000000
py 1 0.065431480 0.065431480 0.130862960 0.000000000
pz 1 0.040374926 0.040374926 0.080749851 0.000000000
sum over m 0.171235445 0.171235445 0.342470890 0.000000000
sum over m+mul 3.190189151 3.190189151 6.380378302 0.000000000
d3z^2-r^2 0 0.196296472 0.196296472 0.392592943 0.000000000
dx^2-y^2 0 0.201520043 0.201520043 0.403040087 0.000000000
dxy 0 0.250928325 0.250928325 0.501856650 0.000000000
dxz 0 0.268513479 0.268513479 0.537026958 0.000000000
dyz 0 0.268492796 0.268492796 0.536985593 0.000000000
sum over m 1.185751115 1.185751115 2.371502230 0.000000000
d3z^2-r^2 1 0.003473219 0.003473219 0.006946439 0.000000000
dx^2-y^2 1 -0.004478692 -0.004478692 -0.008957385 0.000000000
dxy 1 0.015341024 0.015341024 0.030682047 0.000000000
dxz 1 0.003487435 0.003487435 0.006974871 0.000000000
dyz 1 0.003485600 0.003485600 0.006971200 0.000000000
sum over m 0.021308586 0.021308586 0.042617172 0.000000000
sum over m+mul 1.207059701 1.207059701 2.414119402 0.000000000
465 O Up spin Down spin Sum Diff
multiple
s 0 0.893859098 0.893859098 1.787718196 0.000000000
sum over m 0.893859098 0.893859098 1.787718196 0.000000000
s 1 -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m+mul 0.890817569 0.890817569 1.781635137 0.000000000
px 0 0.786877142 0.786877142 1.573754284 0.000000000
py 0 0.786939499 0.786939499 1.573878997 0.000000000
pz 0 0.779871227 0.779871227 1.559742455 0.000000000
sum over m 2.353687868 2.353687868 4.707375736 0.000000000
px 1 -0.008725152 -0.008725152 -0.017450305 0.000000000
py 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
pz 1 -0.006467431 -0.006467431 -0.012934861 0.000000000
sum over m -0.023928314 -0.023928314 -0.047856627 0.000000000
sum over m+mul 2.329759554 2.329759554 4.659519109 0.000000000
d3z^2-r^2 0 -0.006389921 -0.006389921 -0.012779843 0.000000000
dx^2-y^2 0 -0.005060831 -0.005060831 -0.010121663 0.000000000
dxy 0 -0.005433558 -0.005433558 -0.010867116 0.000000000
dxz 0 -0.006934055 -0.006934055 -0.013868111 0.000000000
dyz 0 -0.006932408 -0.006932408 -0.013864816 0.000000000
sum over m -0.030750774 -0.030750774 -0.061501548 0.000000000
sum over m+mul -0.030750774 -0.030750774 -0.061501548 0.000000000
466 O Up spin Down spin Sum Diff
multiple
s 0 0.893906943 0.893906943 1.787813886 0.000000000
sum over m 0.893906943 0.893906943 1.787813886 0.000000000
s 1 -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m+mul 0.890864367 0.890864367 1.781728733 0.000000000
px 0 0.787020216 0.787020216 1.574040431 0.000000000
py 0 0.787068705 0.787068705 1.574137410 0.000000000
pz 0 0.779696226 0.779696226 1.559392453 0.000000000
sum over m 2.353785147 2.353785147 4.707570294 0.000000000
px 1 -0.008731428 -0.008731428 -0.017462857 0.000000000
py 1 -0.008736847 -0.008736847 -0.017473695 0.000000000
pz 1 -0.006454271 -0.006454271 -0.012908542 0.000000000
sum over m -0.023922547 -0.023922547 -0.047845094 0.000000000
sum over m+mul 2.329862600 2.329862600 4.659725201 0.000000000
d3z^2-r^2 0 -0.006390048 -0.006390048 -0.012780096 0.000000000
dx^2-y^2 0 -0.005053782 -0.005053782 -0.010107564 0.000000000
dxy 0 -0.005435831 -0.005435831 -0.010871662 0.000000000
dxz 0 -0.006926865 -0.006926865 -0.013853730 0.000000000
dyz 0 -0.006923376 -0.006923376 -0.013846752 0.000000000
sum over m -0.030729902 -0.030729902 -0.061459804 0.000000000
sum over m+mul -0.030729902 -0.030729902 -0.061459804 0.000000000
467 O Up spin Down spin Sum Diff
multiple
s 0 0.893893710 0.893893710 1.787787419 0.000000000
sum over m 0.893893710 0.893893710 1.787787419 0.000000000
s 1 -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m+mul 0.890851876 0.890851876 1.781703752 0.000000000
px 0 0.786895588 0.786895588 1.573791175 0.000000000
py 0 0.787091794 0.787091794 1.574183588 0.000000000
pz 0 0.779775435 0.779775435 1.559550870 0.000000000
sum over m 2.353762817 2.353762817 4.707525633 0.000000000
px 1 -0.008729916 -0.008729916 -0.017459831 0.000000000
py 1 -0.008743439 -0.008743439 -0.017486877 0.000000000
pz 1 -0.006461929 -0.006461929 -0.012923858 0.000000000
sum over m -0.023935283 -0.023935283 -0.047870567 0.000000000
sum over m+mul 2.329827533 2.329827533 4.659655067 0.000000000
d3z^2-r^2 0 -0.006390598 -0.006390598 -0.012781196 0.000000000
dx^2-y^2 0 -0.005058057 -0.005058057 -0.010116115 0.000000000
dxy 0 -0.005434854 -0.005434854 -0.010869708 0.000000000
dxz 0 -0.006932221 -0.006932221 -0.013864442 0.000000000
dyz 0 -0.006926194 -0.006926194 -0.013852388 0.000000000
sum over m -0.030741924 -0.030741924 -0.061483848 0.000000000
sum over m+mul -0.030741924 -0.030741924 -0.061483848 0.000000000
468 O Up spin Down spin Sum Diff
multiple
s 0 0.893902753 0.893902753 1.787805505 0.000000000
sum over m 0.893902753 0.893902753 1.787805505 0.000000000
s 1 -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m+mul 0.890860725 0.890860725 1.781721450 0.000000000
px 0 0.787139398 0.787139398 1.574278797 0.000000000
py 0 0.786819648 0.786819648 1.573639297 0.000000000
pz 0 0.779778741 0.779778741 1.559557481 0.000000000
sum over m 2.353737787 2.353737787 4.707475575 0.000000000
px 1 -0.008745736 -0.008745736 -0.017491472 0.000000000
py 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
pz 1 -0.006462867 -0.006462867 -0.012925734 0.000000000
sum over m -0.023944334 -0.023944334 -0.047888668 0.000000000
sum over m+mul 2.329793454 2.329793454 4.659586907 0.000000000
d3z^2-r^2 0 -0.006391160 -0.006391160 -0.012782321 0.000000000
dx^2-y^2 0 -0.005058206 -0.005058206 -0.010116413 0.000000000
dxy 0 -0.005434582 -0.005434582 -0.010869165 0.000000000
dxz 0 -0.006927117 -0.006927117 -0.013854234 0.000000000
dyz 0 -0.006932318 -0.006932318 -0.013864636 0.000000000
sum over m -0.030743384 -0.030743384 -0.061486768 0.000000000
sum over m+mul -0.030743384 -0.030743384 -0.061486768 0.000000000
469 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000794346 1.000794346 2.001588691 0.000000000
sum over m 1.000794346 1.000794346 2.001588691 0.000000000
s 1 0.207399176 0.207399176 0.414798352 0.000000000
sum over m 0.207399176 0.207399176 0.414798352 0.000000000
s 2 0.014720923 0.014720923 0.029441845 0.000000000
sum over m 0.014720923 0.014720923 0.029441845 0.000000000
sum over m+mul 1.222914444 1.222914444 2.445828889 0.000000000
px 0 1.006370005 1.006370005 2.012740010 0.000000000
py 0 1.006381344 1.006381344 2.012762688 0.000000000
pz 0 1.006214475 1.006214475 2.012428949 0.000000000
sum over m 3.018965824 3.018965824 6.037931648 0.000000000
px 1 0.065452017 0.065452017 0.130904035 0.000000000
py 1 0.065434731 0.065434731 0.130869461 0.000000000
pz 1 0.040359775 0.040359775 0.080719549 0.000000000
sum over m 0.171246523 0.171246523 0.342493045 0.000000000
sum over m+mul 3.190212346 3.190212346 6.380424693 0.000000000
d3z^2-r^2 0 0.196317000 0.196317000 0.392634000 0.000000000
dx^2-y^2 0 0.201535059 0.201535059 0.403070119 0.000000000
dxy 0 0.250932486 0.250932486 0.501864973 0.000000000
dxz 0 0.268493958 0.268493958 0.536987917 0.000000000
dyz 0 0.268481712 0.268481712 0.536963424 0.000000000
sum over m 1.185760216 1.185760216 2.371520432 0.000000000
d3z^2-r^2 1 0.003471608 0.003471608 0.006943216 0.000000000
dx^2-y^2 1 -0.004483514 -0.004483514 -0.008967027 0.000000000
dxy 1 0.015345845 0.015345845 0.030691691 0.000000000
dxz 1 0.003490453 0.003490453 0.006980907 0.000000000
dyz 1 0.003488639 0.003488639 0.006977279 0.000000000
sum over m 0.021313033 0.021313033 0.042626066 0.000000000
sum over m+mul 1.207073249 1.207073249 2.414146498 0.000000000
470 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000774711 1.000774711 2.001549422 0.000000000
sum over m 1.000774711 1.000774711 2.001549422 0.000000000
s 1 0.207407309 0.207407309 0.414814618 0.000000000
sum over m 0.207407309 0.207407309 0.414814618 0.000000000
s 2 0.014723324 0.014723324 0.029446649 0.000000000
sum over m 0.014723324 0.014723324 0.029446649 0.000000000
sum over m+mul 1.222905344 1.222905344 2.445810689 0.000000000
px 0 1.006372285 1.006372285 2.012744570 0.000000000
py 0 1.006382809 1.006382809 2.012765618 0.000000000
pz 0 1.006198612 1.006198612 2.012397224 0.000000000
sum over m 3.018953706 3.018953706 6.037907412 0.000000000
px 1 0.065429039 0.065429039 0.130858078 0.000000000
py 1 0.065431480 0.065431480 0.130862960 0.000000000
pz 1 0.040374926 0.040374926 0.080749852 0.000000000
sum over m 0.171235445 0.171235445 0.342470890 0.000000000
sum over m+mul 3.190189151 3.190189151 6.380378302 0.000000000
d3z^2-r^2 0 0.196296472 0.196296472 0.392592943 0.000000000
dx^2-y^2 0 0.201520043 0.201520043 0.403040086 0.000000000
dxy 0 0.250928325 0.250928325 0.501856650 0.000000000
dxz 0 0.268513479 0.268513479 0.537026958 0.000000000
dyz 0 0.268492797 0.268492797 0.536985593 0.000000000
sum over m 1.185751115 1.185751115 2.371502231 0.000000000
d3z^2-r^2 1 0.003473219 0.003473219 0.006946439 0.000000000
dx^2-y^2 1 -0.004478692 -0.004478692 -0.008957384 0.000000000
dxy 1 0.015341023 0.015341023 0.030682047 0.000000000
dxz 1 0.003487435 0.003487435 0.006974871 0.000000000
dyz 1 0.003485600 0.003485600 0.006971200 0.000000000
sum over m 0.021308586 0.021308586 0.042617172 0.000000000
sum over m+mul 1.207059701 1.207059701 2.414119403 0.000000000
471 O Up spin Down spin Sum Diff
multiple
s 0 0.893859098 0.893859098 1.787718196 0.000000000
sum over m 0.893859098 0.893859098 1.787718196 0.000000000
s 1 -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m+mul 0.890817568 0.890817568 1.781635137 0.000000000
px 0 0.786877143 0.786877143 1.573754285 0.000000000
py 0 0.786939499 0.786939499 1.573878997 0.000000000
pz 0 0.779871227 0.779871227 1.559742455 0.000000000
sum over m 2.353687868 2.353687868 4.707375737 0.000000000
px 1 -0.008725153 -0.008725153 -0.017450305 0.000000000
py 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
pz 1 -0.006467431 -0.006467431 -0.012934861 0.000000000
sum over m -0.023928314 -0.023928314 -0.047856627 0.000000000
sum over m+mul 2.329759555 2.329759555 4.659519109 0.000000000
d3z^2-r^2 0 -0.006389921 -0.006389921 -0.012779843 0.000000000
dx^2-y^2 0 -0.005060831 -0.005060831 -0.010121663 0.000000000
dxy 0 -0.005433558 -0.005433558 -0.010867116 0.000000000
dxz 0 -0.006934055 -0.006934055 -0.013868111 0.000000000
dyz 0 -0.006932408 -0.006932408 -0.013864816 0.000000000
sum over m -0.030750774 -0.030750774 -0.061501548 0.000000000
sum over m+mul -0.030750774 -0.030750774 -0.061501548 0.000000000
472 O Up spin Down spin Sum Diff
multiple
s 0 0.893906943 0.893906943 1.787813886 0.000000000
sum over m 0.893906943 0.893906943 1.787813886 0.000000000
s 1 -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m+mul 0.890864367 0.890864367 1.781728734 0.000000000
px 0 0.787020216 0.787020216 1.574040431 0.000000000
py 0 0.787068705 0.787068705 1.574137410 0.000000000
pz 0 0.779696226 0.779696226 1.559392452 0.000000000
sum over m 2.353785147 2.353785147 4.707570294 0.000000000
px 1 -0.008731428 -0.008731428 -0.017462857 0.000000000
py 1 -0.008736848 -0.008736848 -0.017473695 0.000000000
pz 1 -0.006454271 -0.006454271 -0.012908542 0.000000000
sum over m -0.023922547 -0.023922547 -0.047845094 0.000000000
sum over m+mul 2.329862600 2.329862600 4.659725200 0.000000000
d3z^2-r^2 0 -0.006390048 -0.006390048 -0.012780096 0.000000000
dx^2-y^2 0 -0.005053782 -0.005053782 -0.010107564 0.000000000
dxy 0 -0.005435831 -0.005435831 -0.010871662 0.000000000
dxz 0 -0.006926865 -0.006926865 -0.013853730 0.000000000
dyz 0 -0.006923376 -0.006923376 -0.013846752 0.000000000
sum over m -0.030729902 -0.030729902 -0.061459804 0.000000000
sum over m+mul -0.030729902 -0.030729902 -0.061459804 0.000000000
473 O Up spin Down spin Sum Diff
multiple
s 0 0.893893710 0.893893710 1.787787419 0.000000000
sum over m 0.893893710 0.893893710 1.787787419 0.000000000
s 1 -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m+mul 0.890851876 0.890851876 1.781703752 0.000000000
px 0 0.786895587 0.786895587 1.573791175 0.000000000
py 0 0.787091794 0.787091794 1.574183588 0.000000000
pz 0 0.779775435 0.779775435 1.559550870 0.000000000
sum over m 2.353762816 2.353762816 4.707525633 0.000000000
px 1 -0.008729916 -0.008729916 -0.017459831 0.000000000
py 1 -0.008743439 -0.008743439 -0.017486877 0.000000000
pz 1 -0.006461929 -0.006461929 -0.012923858 0.000000000
sum over m -0.023935283 -0.023935283 -0.047870567 0.000000000
sum over m+mul 2.329827533 2.329827533 4.659655066 0.000000000
d3z^2-r^2 0 -0.006390598 -0.006390598 -0.012781196 0.000000000
dx^2-y^2 0 -0.005058057 -0.005058057 -0.010116115 0.000000000
dxy 0 -0.005434854 -0.005434854 -0.010869708 0.000000000
dxz 0 -0.006932221 -0.006932221 -0.013864442 0.000000000
dyz 0 -0.006926194 -0.006926194 -0.013852388 0.000000000
sum over m -0.030741924 -0.030741924 -0.061483848 0.000000000
sum over m+mul -0.030741924 -0.030741924 -0.061483848 0.000000000
474 O Up spin Down spin Sum Diff
multiple
s 0 0.893902753 0.893902753 1.787805505 0.000000000
sum over m 0.893902753 0.893902753 1.787805505 0.000000000
s 1 -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m+mul 0.890860725 0.890860725 1.781721450 0.000000000
px 0 0.787139398 0.787139398 1.574278796 0.000000000
py 0 0.786819648 0.786819648 1.573639297 0.000000000
pz 0 0.779778741 0.779778741 1.559557481 0.000000000
sum over m 2.353737787 2.353737787 4.707475575 0.000000000
px 1 -0.008745736 -0.008745736 -0.017491472 0.000000000
py 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
pz 1 -0.006462867 -0.006462867 -0.012925734 0.000000000
sum over m -0.023944334 -0.023944334 -0.047888668 0.000000000
sum over m+mul 2.329793453 2.329793453 4.659586907 0.000000000
d3z^2-r^2 0 -0.006391160 -0.006391160 -0.012782321 0.000000000
dx^2-y^2 0 -0.005058206 -0.005058206 -0.010116413 0.000000000
dxy 0 -0.005434582 -0.005434582 -0.010869165 0.000000000
dxz 0 -0.006927117 -0.006927117 -0.013854234 0.000000000
dyz 0 -0.006932318 -0.006932318 -0.013864636 0.000000000
sum over m -0.030743384 -0.030743384 -0.061486768 0.000000000
sum over m+mul -0.030743384 -0.030743384 -0.061486768 0.000000000
475 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000794346 1.000794346 2.001588692 0.000000000
sum over m 1.000794346 1.000794346 2.001588692 0.000000000
s 1 0.207399176 0.207399176 0.414798352 0.000000000
sum over m 0.207399176 0.207399176 0.414798352 0.000000000
s 2 0.014720923 0.014720923 0.029441846 0.000000000
sum over m 0.014720923 0.014720923 0.029441846 0.000000000
sum over m+mul 1.222914444 1.222914444 2.445828889 0.000000000
px 0 1.006370005 1.006370005 2.012740010 0.000000000
py 0 1.006381344 1.006381344 2.012762688 0.000000000
pz 0 1.006214474 1.006214474 2.012428949 0.000000000
sum over m 3.018965824 3.018965824 6.037931648 0.000000000
px 1 0.065452017 0.065452017 0.130904035 0.000000000
py 1 0.065434730 0.065434730 0.130869461 0.000000000
pz 1 0.040359775 0.040359775 0.080719549 0.000000000
sum over m 0.171246522 0.171246522 0.342493045 0.000000000
sum over m+mul 3.190212346 3.190212346 6.380424693 0.000000000
d3z^2-r^2 0 0.196317000 0.196317000 0.392634000 0.000000000
dx^2-y^2 0 0.201535060 0.201535060 0.403070119 0.000000000
dxy 0 0.250932486 0.250932486 0.501864973 0.000000000
dxz 0 0.268493958 0.268493958 0.536987917 0.000000000
dyz 0 0.268481712 0.268481712 0.536963425 0.000000000
sum over m 1.185760217 1.185760217 2.371520433 0.000000000
d3z^2-r^2 1 0.003471608 0.003471608 0.006943216 0.000000000
dx^2-y^2 1 -0.004483514 -0.004483514 -0.008967027 0.000000000
dxy 1 0.015345845 0.015345845 0.030691691 0.000000000
dxz 1 0.003490453 0.003490453 0.006980907 0.000000000
dyz 1 0.003488639 0.003488639 0.006977279 0.000000000
sum over m 0.021313033 0.021313033 0.042626066 0.000000000
sum over m+mul 1.207073249 1.207073249 2.414146499 0.000000000
476 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000774711 1.000774711 2.001549422 0.000000000
sum over m 1.000774711 1.000774711 2.001549422 0.000000000
s 1 0.207407309 0.207407309 0.414814618 0.000000000
sum over m 0.207407309 0.207407309 0.414814618 0.000000000
s 2 0.014723324 0.014723324 0.029446649 0.000000000
sum over m 0.014723324 0.014723324 0.029446649 0.000000000
sum over m+mul 1.222905344 1.222905344 2.445810689 0.000000000
px 0 1.006372285 1.006372285 2.012744570 0.000000000
py 0 1.006382809 1.006382809 2.012765618 0.000000000
pz 0 1.006198612 1.006198612 2.012397224 0.000000000
sum over m 3.018953706 3.018953706 6.037907412 0.000000000
px 1 0.065429039 0.065429039 0.130858078 0.000000000
py 1 0.065431480 0.065431480 0.130862961 0.000000000
pz 1 0.040374926 0.040374926 0.080749852 0.000000000
sum over m 0.171235445 0.171235445 0.342470890 0.000000000
sum over m+mul 3.190189151 3.190189151 6.380378302 0.000000000
d3z^2-r^2 0 0.196296472 0.196296472 0.392592943 0.000000000
dx^2-y^2 0 0.201520043 0.201520043 0.403040087 0.000000000
dxy 0 0.250928325 0.250928325 0.501856650 0.000000000
dxz 0 0.268513479 0.268513479 0.537026958 0.000000000
dyz 0 0.268492796 0.268492796 0.536985593 0.000000000
sum over m 1.185751115 1.185751115 2.371502230 0.000000000
d3z^2-r^2 1 0.003473219 0.003473219 0.006946439 0.000000000
dx^2-y^2 1 -0.004478692 -0.004478692 -0.008957384 0.000000000
dxy 1 0.015341024 0.015341024 0.030682047 0.000000000
dxz 1 0.003487435 0.003487435 0.006974871 0.000000000
dyz 1 0.003485600 0.003485600 0.006971200 0.000000000
sum over m 0.021308586 0.021308586 0.042617172 0.000000000
sum over m+mul 1.207059701 1.207059701 2.414119402 0.000000000
477 O Up spin Down spin Sum Diff
multiple
s 0 0.893859098 0.893859098 1.787718196 0.000000000
sum over m 0.893859098 0.893859098 1.787718196 0.000000000
s 1 -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m+mul 0.890817568 0.890817568 1.781635137 0.000000000
px 0 0.786877142 0.786877142 1.573754285 0.000000000
py 0 0.786939499 0.786939499 1.573878997 0.000000000
pz 0 0.779871227 0.779871227 1.559742454 0.000000000
sum over m 2.353687868 2.353687868 4.707375737 0.000000000
px 1 -0.008725153 -0.008725153 -0.017450305 0.000000000
py 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
pz 1 -0.006467431 -0.006467431 -0.012934861 0.000000000
sum over m -0.023928314 -0.023928314 -0.047856628 0.000000000
sum over m+mul 2.329759555 2.329759555 4.659519109 0.000000000
d3z^2-r^2 0 -0.006389921 -0.006389921 -0.012779843 0.000000000
dx^2-y^2 0 -0.005060831 -0.005060831 -0.010121663 0.000000000
dxy 0 -0.005433558 -0.005433558 -0.010867116 0.000000000
dxz 0 -0.006934055 -0.006934055 -0.013868111 0.000000000
dyz 0 -0.006932408 -0.006932408 -0.013864816 0.000000000
sum over m -0.030750774 -0.030750774 -0.061501548 0.000000000
sum over m+mul -0.030750774 -0.030750774 -0.061501548 0.000000000
478 O Up spin Down spin Sum Diff
multiple
s 0 0.893906943 0.893906943 1.787813886 0.000000000
sum over m 0.893906943 0.893906943 1.787813886 0.000000000
s 1 -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m+mul 0.890864367 0.890864367 1.781728733 0.000000000
px 0 0.787020216 0.787020216 1.574040431 0.000000000
py 0 0.787068705 0.787068705 1.574137410 0.000000000
pz 0 0.779696226 0.779696226 1.559392452 0.000000000
sum over m 2.353785147 2.353785147 4.707570294 0.000000000
px 1 -0.008731428 -0.008731428 -0.017462857 0.000000000
py 1 -0.008736848 -0.008736848 -0.017473695 0.000000000
pz 1 -0.006454271 -0.006454271 -0.012908542 0.000000000
sum over m -0.023922547 -0.023922547 -0.047845094 0.000000000
sum over m+mul 2.329862600 2.329862600 4.659725200 0.000000000
d3z^2-r^2 0 -0.006390048 -0.006390048 -0.012780096 0.000000000
dx^2-y^2 0 -0.005053782 -0.005053782 -0.010107564 0.000000000
dxy 0 -0.005435831 -0.005435831 -0.010871662 0.000000000
dxz 0 -0.006926865 -0.006926865 -0.013853730 0.000000000
dyz 0 -0.006923376 -0.006923376 -0.013846752 0.000000000
sum over m -0.030729902 -0.030729902 -0.061459804 0.000000000
sum over m+mul -0.030729902 -0.030729902 -0.061459804 0.000000000
479 O Up spin Down spin Sum Diff
multiple
s 0 0.893893710 0.893893710 1.787787419 0.000000000
sum over m 0.893893710 0.893893710 1.787787419 0.000000000
s 1 -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m+mul 0.890851876 0.890851876 1.781703751 0.000000000
px 0 0.786895587 0.786895587 1.573791175 0.000000000
py 0 0.787091794 0.787091794 1.574183588 0.000000000
pz 0 0.779775435 0.779775435 1.559550870 0.000000000
sum over m 2.353762816 2.353762816 4.707525633 0.000000000
px 1 -0.008729916 -0.008729916 -0.017459831 0.000000000
py 1 -0.008743439 -0.008743439 -0.017486877 0.000000000
pz 1 -0.006461929 -0.006461929 -0.012923858 0.000000000
sum over m -0.023935283 -0.023935283 -0.047870567 0.000000000
sum over m+mul 2.329827533 2.329827533 4.659655066 0.000000000
d3z^2-r^2 0 -0.006390598 -0.006390598 -0.012781196 0.000000000
dx^2-y^2 0 -0.005058057 -0.005058057 -0.010116115 0.000000000
dxy 0 -0.005434854 -0.005434854 -0.010869707 0.000000000
dxz 0 -0.006932221 -0.006932221 -0.013864442 0.000000000
dyz 0 -0.006926194 -0.006926194 -0.013852388 0.000000000
sum over m -0.030741924 -0.030741924 -0.061483848 0.000000000
sum over m+mul -0.030741924 -0.030741924 -0.061483848 0.000000000
480 O Up spin Down spin Sum Diff
multiple
s 0 0.893902753 0.893902753 1.787805505 0.000000000
sum over m 0.893902753 0.893902753 1.787805505 0.000000000
s 1 -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m+mul 0.890860725 0.890860725 1.781721450 0.000000000
px 0 0.787139398 0.787139398 1.574278797 0.000000000
py 0 0.786819648 0.786819648 1.573639297 0.000000000
pz 0 0.779778741 0.779778741 1.559557482 0.000000000
sum over m 2.353737788 2.353737788 4.707475575 0.000000000
px 1 -0.008745736 -0.008745736 -0.017491472 0.000000000
py 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
pz 1 -0.006462867 -0.006462867 -0.012925734 0.000000000
sum over m -0.023944334 -0.023944334 -0.047888668 0.000000000
sum over m+mul 2.329793454 2.329793454 4.659586908 0.000000000
d3z^2-r^2 0 -0.006391160 -0.006391160 -0.012782321 0.000000000
dx^2-y^2 0 -0.005058206 -0.005058206 -0.010116413 0.000000000
dxy 0 -0.005434582 -0.005434582 -0.010869165 0.000000000
dxz 0 -0.006927117 -0.006927117 -0.013854234 0.000000000
dyz 0 -0.006932318 -0.006932318 -0.013864636 0.000000000
sum over m -0.030743384 -0.030743384 -0.061486768 0.000000000
sum over m+mul -0.030743384 -0.030743384 -0.061486768 0.000000000
481 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000794346 1.000794346 2.001588692 0.000000000
sum over m 1.000794346 1.000794346 2.001588692 0.000000000
s 1 0.207399176 0.207399176 0.414798352 0.000000000
sum over m 0.207399176 0.207399176 0.414798352 0.000000000
s 2 0.014720923 0.014720923 0.029441845 0.000000000
sum over m 0.014720923 0.014720923 0.029441845 0.000000000
sum over m+mul 1.222914444 1.222914444 2.445828889 0.000000000
px 0 1.006370005 1.006370005 2.012740010 0.000000000
py 0 1.006381344 1.006381344 2.012762688 0.000000000
pz 0 1.006214474 1.006214474 2.012428949 0.000000000
sum over m 3.018965824 3.018965824 6.037931648 0.000000000
px 1 0.065452018 0.065452018 0.130904035 0.000000000
py 1 0.065434730 0.065434730 0.130869461 0.000000000
pz 1 0.040359774 0.040359774 0.080719549 0.000000000
sum over m 0.171246523 0.171246523 0.342493045 0.000000000
sum over m+mul 3.190212346 3.190212346 6.380424693 0.000000000
d3z^2-r^2 0 0.196317000 0.196317000 0.392634000 0.000000000
dx^2-y^2 0 0.201535059 0.201535059 0.403070119 0.000000000
dxy 0 0.250932486 0.250932486 0.501864972 0.000000000
dxz 0 0.268493958 0.268493958 0.536987916 0.000000000
dyz 0 0.268481712 0.268481712 0.536963425 0.000000000
sum over m 1.185760216 1.185760216 2.371520433 0.000000000
d3z^2-r^2 1 0.003471608 0.003471608 0.006943216 0.000000000
dx^2-y^2 1 -0.004483514 -0.004483514 -0.008967027 0.000000000
dxy 1 0.015345845 0.015345845 0.030691691 0.000000000
dxz 1 0.003490453 0.003490453 0.006980907 0.000000000
dyz 1 0.003488639 0.003488639 0.006977279 0.000000000
sum over m 0.021313033 0.021313033 0.042626066 0.000000000
sum over m+mul 1.207073249 1.207073249 2.414146498 0.000000000
482 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000774711 1.000774711 2.001549422 0.000000000
sum over m 1.000774711 1.000774711 2.001549422 0.000000000
s 1 0.207407309 0.207407309 0.414814618 0.000000000
sum over m 0.207407309 0.207407309 0.414814618 0.000000000
s 2 0.014723324 0.014723324 0.029446649 0.000000000
sum over m 0.014723324 0.014723324 0.029446649 0.000000000
sum over m+mul 1.222905345 1.222905345 2.445810689 0.000000000
px 0 1.006372285 1.006372285 2.012744570 0.000000000
py 0 1.006382809 1.006382809 2.012765618 0.000000000
pz 0 1.006198612 1.006198612 2.012397224 0.000000000
sum over m 3.018953706 3.018953706 6.037907412 0.000000000
px 1 0.065429039 0.065429039 0.130858078 0.000000000
py 1 0.065431480 0.065431480 0.130862960 0.000000000
pz 1 0.040374926 0.040374926 0.080749851 0.000000000
sum over m 0.171235445 0.171235445 0.342470890 0.000000000
sum over m+mul 3.190189151 3.190189151 6.380378302 0.000000000
d3z^2-r^2 0 0.196296471 0.196296471 0.392592943 0.000000000
dx^2-y^2 0 0.201520043 0.201520043 0.403040086 0.000000000
dxy 0 0.250928325 0.250928325 0.501856650 0.000000000
dxz 0 0.268513479 0.268513479 0.537026958 0.000000000
dyz 0 0.268492796 0.268492796 0.536985593 0.000000000
sum over m 1.185751115 1.185751115 2.371502230 0.000000000
d3z^2-r^2 1 0.003473219 0.003473219 0.006946439 0.000000000
dx^2-y^2 1 -0.004478692 -0.004478692 -0.008957385 0.000000000
dxy 1 0.015341024 0.015341024 0.030682047 0.000000000
dxz 1 0.003487435 0.003487435 0.006974871 0.000000000
dyz 1 0.003485600 0.003485600 0.006971200 0.000000000
sum over m 0.021308586 0.021308586 0.042617172 0.000000000
sum over m+mul 1.207059701 1.207059701 2.414119402 0.000000000
483 O Up spin Down spin Sum Diff
multiple
s 0 0.893859098 0.893859098 1.787718196 0.000000000
sum over m 0.893859098 0.893859098 1.787718196 0.000000000
s 1 -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m+mul 0.890817568 0.890817568 1.781635137 0.000000000
px 0 0.786877142 0.786877142 1.573754284 0.000000000
py 0 0.786939499 0.786939499 1.573878997 0.000000000
pz 0 0.779871227 0.779871227 1.559742454 0.000000000
sum over m 2.353687868 2.353687868 4.707375736 0.000000000
px 1 -0.008725152 -0.008725152 -0.017450305 0.000000000
py 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
pz 1 -0.006467431 -0.006467431 -0.012934861 0.000000000
sum over m -0.023928314 -0.023928314 -0.047856627 0.000000000
sum over m+mul 2.329759554 2.329759554 4.659519108 0.000000000
d3z^2-r^2 0 -0.006389921 -0.006389921 -0.012779843 0.000000000
dx^2-y^2 0 -0.005060831 -0.005060831 -0.010121663 0.000000000
dxy 0 -0.005433558 -0.005433558 -0.010867116 0.000000000
dxz 0 -0.006934055 -0.006934055 -0.013868111 0.000000000
dyz 0 -0.006932408 -0.006932408 -0.013864816 0.000000000
sum over m -0.030750774 -0.030750774 -0.061501548 0.000000000
sum over m+mul -0.030750774 -0.030750774 -0.061501548 0.000000000
484 O Up spin Down spin Sum Diff
multiple
s 0 0.893906943 0.893906943 1.787813886 0.000000000
sum over m 0.893906943 0.893906943 1.787813886 0.000000000
s 1 -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m+mul 0.890864367 0.890864367 1.781728733 0.000000000
px 0 0.787020216 0.787020216 1.574040431 0.000000000
py 0 0.787068705 0.787068705 1.574137410 0.000000000
pz 0 0.779696226 0.779696226 1.559392452 0.000000000
sum over m 2.353785147 2.353785147 4.707570294 0.000000000
px 1 -0.008731428 -0.008731428 -0.017462857 0.000000000
py 1 -0.008736847 -0.008736847 -0.017473695 0.000000000
pz 1 -0.006454271 -0.006454271 -0.012908542 0.000000000
sum over m -0.023922547 -0.023922547 -0.047845094 0.000000000
sum over m+mul 2.329862600 2.329862600 4.659725200 0.000000000
d3z^2-r^2 0 -0.006390048 -0.006390048 -0.012780096 0.000000000
dx^2-y^2 0 -0.005053782 -0.005053782 -0.010107564 0.000000000
dxy 0 -0.005435831 -0.005435831 -0.010871662 0.000000000
dxz 0 -0.006926865 -0.006926865 -0.013853730 0.000000000
dyz 0 -0.006923376 -0.006923376 -0.013846752 0.000000000
sum over m -0.030729902 -0.030729902 -0.061459804 0.000000000
sum over m+mul -0.030729902 -0.030729902 -0.061459804 0.000000000
485 O Up spin Down spin Sum Diff
multiple
s 0 0.893893710 0.893893710 1.787787420 0.000000000
sum over m 0.893893710 0.893893710 1.787787420 0.000000000
s 1 -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m+mul 0.890851876 0.890851876 1.781703752 0.000000000
px 0 0.786895587 0.786895587 1.573791175 0.000000000
py 0 0.787091794 0.787091794 1.574183588 0.000000000
pz 0 0.779775435 0.779775435 1.559550870 0.000000000
sum over m 2.353762816 2.353762816 4.707525633 0.000000000
px 1 -0.008729916 -0.008729916 -0.017459831 0.000000000
py 1 -0.008743439 -0.008743439 -0.017486877 0.000000000
pz 1 -0.006461929 -0.006461929 -0.012923858 0.000000000
sum over m -0.023935283 -0.023935283 -0.047870567 0.000000000
sum over m+mul 2.329827533 2.329827533 4.659655066 0.000000000
d3z^2-r^2 0 -0.006390598 -0.006390598 -0.012781196 0.000000000
dx^2-y^2 0 -0.005058057 -0.005058057 -0.010116115 0.000000000
dxy 0 -0.005434854 -0.005434854 -0.010869708 0.000000000
dxz 0 -0.006932221 -0.006932221 -0.013864442 0.000000000
dyz 0 -0.006926194 -0.006926194 -0.013852388 0.000000000
sum over m -0.030741924 -0.030741924 -0.061483848 0.000000000
sum over m+mul -0.030741924 -0.030741924 -0.061483848 0.000000000
486 O Up spin Down spin Sum Diff
multiple
s 0 0.893902753 0.893902753 1.787805505 0.000000000
sum over m 0.893902753 0.893902753 1.787805505 0.000000000
s 1 -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m+mul 0.890860725 0.890860725 1.781721450 0.000000000
px 0 0.787139398 0.787139398 1.574278797 0.000000000
py 0 0.786819648 0.786819648 1.573639297 0.000000000
pz 0 0.779778741 0.779778741 1.559557482 0.000000000
sum over m 2.353737788 2.353737788 4.707475575 0.000000000
px 1 -0.008745736 -0.008745736 -0.017491472 0.000000000
py 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
pz 1 -0.006462867 -0.006462867 -0.012925734 0.000000000
sum over m -0.023944334 -0.023944334 -0.047888668 0.000000000
sum over m+mul 2.329793454 2.329793454 4.659586908 0.000000000
d3z^2-r^2 0 -0.006391160 -0.006391160 -0.012782321 0.000000000
dx^2-y^2 0 -0.005058206 -0.005058206 -0.010116413 0.000000000
dxy 0 -0.005434582 -0.005434582 -0.010869165 0.000000000
dxz 0 -0.006927117 -0.006927117 -0.013854234 0.000000000
dyz 0 -0.006932318 -0.006932318 -0.013864636 0.000000000
sum over m -0.030743384 -0.030743384 -0.061486768 0.000000000
sum over m+mul -0.030743384 -0.030743384 -0.061486768 0.000000000
487 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000794346 1.000794346 2.001588692 0.000000000
sum over m 1.000794346 1.000794346 2.001588692 0.000000000
s 1 0.207399176 0.207399176 0.414798351 0.000000000
sum over m 0.207399176 0.207399176 0.414798351 0.000000000
s 2 0.014720923 0.014720923 0.029441845 0.000000000
sum over m 0.014720923 0.014720923 0.029441845 0.000000000
sum over m+mul 1.222914444 1.222914444 2.445828889 0.000000000
px 0 1.006370005 1.006370005 2.012740010 0.000000000
py 0 1.006381344 1.006381344 2.012762689 0.000000000
pz 0 1.006214474 1.006214474 2.012428949 0.000000000
sum over m 3.018965824 3.018965824 6.037931648 0.000000000
px 1 0.065452017 0.065452017 0.130904035 0.000000000
py 1 0.065434730 0.065434730 0.130869461 0.000000000
pz 1 0.040359775 0.040359775 0.080719549 0.000000000
sum over m 0.171246523 0.171246523 0.342493045 0.000000000
sum over m+mul 3.190212346 3.190212346 6.380424693 0.000000000
d3z^2-r^2 0 0.196317000 0.196317000 0.392634000 0.000000000
dx^2-y^2 0 0.201535060 0.201535060 0.403070120 0.000000000
dxy 0 0.250932486 0.250932486 0.501864973 0.000000000
dxz 0 0.268493958 0.268493958 0.536987917 0.000000000
dyz 0 0.268481712 0.268481712 0.536963425 0.000000000
sum over m 1.185760217 1.185760217 2.371520433 0.000000000
d3z^2-r^2 1 0.003471608 0.003471608 0.006943216 0.000000000
dx^2-y^2 1 -0.004483514 -0.004483514 -0.008967027 0.000000000
dxy 1 0.015345845 0.015345845 0.030691691 0.000000000
dxz 1 0.003490453 0.003490453 0.006980907 0.000000000
dyz 1 0.003488639 0.003488639 0.006977279 0.000000000
sum over m 0.021313033 0.021313033 0.042626066 0.000000000
sum over m+mul 1.207073249 1.207073249 2.414146499 0.000000000
488 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000774711 1.000774711 2.001549422 0.000000000
sum over m 1.000774711 1.000774711 2.001549422 0.000000000
s 1 0.207407309 0.207407309 0.414814618 0.000000000
sum over m 0.207407309 0.207407309 0.414814618 0.000000000
s 2 0.014723324 0.014723324 0.029446649 0.000000000
sum over m 0.014723324 0.014723324 0.029446649 0.000000000
sum over m+mul 1.222905345 1.222905345 2.445810689 0.000000000
px 0 1.006372285 1.006372285 2.012744570 0.000000000
py 0 1.006382809 1.006382809 2.012765618 0.000000000
pz 0 1.006198612 1.006198612 2.012397224 0.000000000
sum over m 3.018953706 3.018953706 6.037907412 0.000000000
px 1 0.065429039 0.065429039 0.130858078 0.000000000
py 1 0.065431480 0.065431480 0.130862960 0.000000000
pz 1 0.040374926 0.040374926 0.080749852 0.000000000
sum over m 0.171235445 0.171235445 0.342470890 0.000000000
sum over m+mul 3.190189151 3.190189151 6.380378302 0.000000000
d3z^2-r^2 0 0.196296472 0.196296472 0.392592943 0.000000000
dx^2-y^2 0 0.201520043 0.201520043 0.403040086 0.000000000
dxy 0 0.250928325 0.250928325 0.501856650 0.000000000
dxz 0 0.268513479 0.268513479 0.537026958 0.000000000
dyz 0 0.268492796 0.268492796 0.536985593 0.000000000
sum over m 1.185751115 1.185751115 2.371502230 0.000000000
d3z^2-r^2 1 0.003473219 0.003473219 0.006946439 0.000000000
dx^2-y^2 1 -0.004478692 -0.004478692 -0.008957384 0.000000000
dxy 1 0.015341024 0.015341024 0.030682047 0.000000000
dxz 1 0.003487435 0.003487435 0.006974871 0.000000000
dyz 1 0.003485600 0.003485600 0.006971200 0.000000000
sum over m 0.021308586 0.021308586 0.042617172 0.000000000
sum over m+mul 1.207059701 1.207059701 2.414119402 0.000000000
489 O Up spin Down spin Sum Diff
multiple
s 0 0.893859098 0.893859098 1.787718196 0.000000000
sum over m 0.893859098 0.893859098 1.787718196 0.000000000
s 1 -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m+mul 0.890817568 0.890817568 1.781635137 0.000000000
px 0 0.786877142 0.786877142 1.573754285 0.000000000
py 0 0.786939499 0.786939499 1.573878997 0.000000000
pz 0 0.779871227 0.779871227 1.559742455 0.000000000
sum over m 2.353687868 2.353687868 4.707375737 0.000000000
px 1 -0.008725152 -0.008725152 -0.017450305 0.000000000
py 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
pz 1 -0.006467431 -0.006467431 -0.012934861 0.000000000
sum over m -0.023928314 -0.023928314 -0.047856627 0.000000000
sum over m+mul 2.329759555 2.329759555 4.659519109 0.000000000
d3z^2-r^2 0 -0.006389921 -0.006389921 -0.012779843 0.000000000
dx^2-y^2 0 -0.005060831 -0.005060831 -0.010121663 0.000000000
dxy 0 -0.005433558 -0.005433558 -0.010867116 0.000000000
dxz 0 -0.006934055 -0.006934055 -0.013868111 0.000000000
dyz 0 -0.006932408 -0.006932408 -0.013864816 0.000000000
sum over m -0.030750774 -0.030750774 -0.061501548 0.000000000
sum over m+mul -0.030750774 -0.030750774 -0.061501548 0.000000000
490 O Up spin Down spin Sum Diff
multiple
s 0 0.893906943 0.893906943 1.787813886 0.000000000
sum over m 0.893906943 0.893906943 1.787813886 0.000000000
s 1 -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m+mul 0.890864367 0.890864367 1.781728733 0.000000000
px 0 0.787020216 0.787020216 1.574040431 0.000000000
py 0 0.787068705 0.787068705 1.574137410 0.000000000
pz 0 0.779696226 0.779696226 1.559392452 0.000000000
sum over m 2.353785147 2.353785147 4.707570294 0.000000000
px 1 -0.008731428 -0.008731428 -0.017462857 0.000000000
py 1 -0.008736847 -0.008736847 -0.017473695 0.000000000
pz 1 -0.006454271 -0.006454271 -0.012908542 0.000000000
sum over m -0.023922547 -0.023922547 -0.047845094 0.000000000
sum over m+mul 2.329862600 2.329862600 4.659725200 0.000000000
d3z^2-r^2 0 -0.006390048 -0.006390048 -0.012780096 0.000000000
dx^2-y^2 0 -0.005053782 -0.005053782 -0.010107564 0.000000000
dxy 0 -0.005435831 -0.005435831 -0.010871662 0.000000000
dxz 0 -0.006926865 -0.006926865 -0.013853730 0.000000000
dyz 0 -0.006923376 -0.006923376 -0.013846752 0.000000000
sum over m -0.030729902 -0.030729902 -0.061459804 0.000000000
sum over m+mul -0.030729902 -0.030729902 -0.061459804 0.000000000
491 O Up spin Down spin Sum Diff
multiple
s 0 0.893893710 0.893893710 1.787787419 0.000000000
sum over m 0.893893710 0.893893710 1.787787419 0.000000000
s 1 -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m+mul 0.890851876 0.890851876 1.781703752 0.000000000
px 0 0.786895587 0.786895587 1.573791175 0.000000000
py 0 0.787091794 0.787091794 1.574183589 0.000000000
pz 0 0.779775435 0.779775435 1.559550870 0.000000000
sum over m 2.353762816 2.353762816 4.707525633 0.000000000
px 1 -0.008729916 -0.008729916 -0.017459831 0.000000000
py 1 -0.008743439 -0.008743439 -0.017486877 0.000000000
pz 1 -0.006461929 -0.006461929 -0.012923858 0.000000000
sum over m -0.023935283 -0.023935283 -0.047870567 0.000000000
sum over m+mul 2.329827533 2.329827533 4.659655066 0.000000000
d3z^2-r^2 0 -0.006390598 -0.006390598 -0.012781196 0.000000000
dx^2-y^2 0 -0.005058057 -0.005058057 -0.010116115 0.000000000
dxy 0 -0.005434854 -0.005434854 -0.010869707 0.000000000
dxz 0 -0.006932221 -0.006932221 -0.013864442 0.000000000
dyz 0 -0.006926194 -0.006926194 -0.013852388 0.000000000
sum over m -0.030741924 -0.030741924 -0.061483848 0.000000000
sum over m+mul -0.030741924 -0.030741924 -0.061483848 0.000000000
492 O Up spin Down spin Sum Diff
multiple
s 0 0.893902753 0.893902753 1.787805505 0.000000000
sum over m 0.893902753 0.893902753 1.787805505 0.000000000
s 1 -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m+mul 0.890860725 0.890860725 1.781721450 0.000000000
px 0 0.787139398 0.787139398 1.574278797 0.000000000
py 0 0.786819648 0.786819648 1.573639297 0.000000000
pz 0 0.779778741 0.779778741 1.559557482 0.000000000
sum over m 2.353737787 2.353737787 4.707475575 0.000000000
px 1 -0.008745736 -0.008745736 -0.017491472 0.000000000
py 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
pz 1 -0.006462867 -0.006462867 -0.012925734 0.000000000
sum over m -0.023944334 -0.023944334 -0.047888668 0.000000000
sum over m+mul 2.329793454 2.329793454 4.659586907 0.000000000
d3z^2-r^2 0 -0.006391160 -0.006391160 -0.012782321 0.000000000
dx^2-y^2 0 -0.005058206 -0.005058206 -0.010116413 0.000000000
dxy 0 -0.005434582 -0.005434582 -0.010869165 0.000000000
dxz 0 -0.006927117 -0.006927117 -0.013854234 0.000000000
dyz 0 -0.006932318 -0.006932318 -0.013864636 0.000000000
sum over m -0.030743384 -0.030743384 -0.061486768 0.000000000
sum over m+mul -0.030743384 -0.030743384 -0.061486768 0.000000000
493 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000794346 1.000794346 2.001588691 0.000000000
sum over m 1.000794346 1.000794346 2.001588691 0.000000000
s 1 0.207399176 0.207399176 0.414798352 0.000000000
sum over m 0.207399176 0.207399176 0.414798352 0.000000000
s 2 0.014720923 0.014720923 0.029441846 0.000000000
sum over m 0.014720923 0.014720923 0.029441846 0.000000000
sum over m+mul 1.222914444 1.222914444 2.445828888 0.000000000
px 0 1.006370005 1.006370005 2.012740010 0.000000000
py 0 1.006381344 1.006381344 2.012762688 0.000000000
pz 0 1.006214474 1.006214474 2.012428949 0.000000000
sum over m 3.018965824 3.018965824 6.037931647 0.000000000
px 1 0.065452018 0.065452018 0.130904035 0.000000000
py 1 0.065434731 0.065434731 0.130869461 0.000000000
pz 1 0.040359775 0.040359775 0.080719550 0.000000000
sum over m 0.171246523 0.171246523 0.342493046 0.000000000
sum over m+mul 3.190212347 3.190212347 6.380424693 0.000000000
d3z^2-r^2 0 0.196317000 0.196317000 0.392634000 0.000000000
dx^2-y^2 0 0.201535060 0.201535060 0.403070119 0.000000000
dxy 0 0.250932486 0.250932486 0.501864973 0.000000000
dxz 0 0.268493958 0.268493958 0.536987916 0.000000000
dyz 0 0.268481712 0.268481712 0.536963424 0.000000000
sum over m 1.185760216 1.185760216 2.371520433 0.000000000
d3z^2-r^2 1 0.003471608 0.003471608 0.006943216 0.000000000
dx^2-y^2 1 -0.004483514 -0.004483514 -0.008967027 0.000000000
dxy 1 0.015345845 0.015345845 0.030691691 0.000000000
dxz 1 0.003490453 0.003490453 0.006980907 0.000000000
dyz 1 0.003488639 0.003488639 0.006977279 0.000000000
sum over m 0.021313033 0.021313033 0.042626066 0.000000000
sum over m+mul 1.207073249 1.207073249 2.414146498 0.000000000
494 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000774711 1.000774711 2.001549422 0.000000000
sum over m 1.000774711 1.000774711 2.001549422 0.000000000
s 1 0.207407309 0.207407309 0.414814618 0.000000000
sum over m 0.207407309 0.207407309 0.414814618 0.000000000
s 2 0.014723324 0.014723324 0.029446649 0.000000000
sum over m 0.014723324 0.014723324 0.029446649 0.000000000
sum over m+mul 1.222905344 1.222905344 2.445810689 0.000000000
px 0 1.006372285 1.006372285 2.012744570 0.000000000
py 0 1.006382809 1.006382809 2.012765618 0.000000000
pz 0 1.006198612 1.006198612 2.012397224 0.000000000
sum over m 3.018953706 3.018953706 6.037907412 0.000000000
px 1 0.065429039 0.065429039 0.130858078 0.000000000
py 1 0.065431480 0.065431480 0.130862960 0.000000000
pz 1 0.040374926 0.040374926 0.080749852 0.000000000
sum over m 0.171235445 0.171235445 0.342470890 0.000000000
sum over m+mul 3.190189151 3.190189151 6.380378302 0.000000000
d3z^2-r^2 0 0.196296472 0.196296472 0.392592943 0.000000000
dx^2-y^2 0 0.201520043 0.201520043 0.403040087 0.000000000
dxy 0 0.250928325 0.250928325 0.501856650 0.000000000
dxz 0 0.268513479 0.268513479 0.537026958 0.000000000
dyz 0 0.268492796 0.268492796 0.536985592 0.000000000
sum over m 1.185751115 1.185751115 2.371502230 0.000000000
d3z^2-r^2 1 0.003473219 0.003473219 0.006946439 0.000000000
dx^2-y^2 1 -0.004478692 -0.004478692 -0.008957385 0.000000000
dxy 1 0.015341024 0.015341024 0.030682047 0.000000000
dxz 1 0.003487435 0.003487435 0.006974871 0.000000000
dyz 1 0.003485600 0.003485600 0.006971200 0.000000000
sum over m 0.021308586 0.021308586 0.042617172 0.000000000
sum over m+mul 1.207059701 1.207059701 2.414119402 0.000000000
495 O Up spin Down spin Sum Diff
multiple
s 0 0.893859098 0.893859098 1.787718196 0.000000000
sum over m 0.893859098 0.893859098 1.787718196 0.000000000
s 1 -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m+mul 0.890817568 0.890817568 1.781635137 0.000000000
px 0 0.786877142 0.786877142 1.573754285 0.000000000
py 0 0.786939498 0.786939498 1.573878997 0.000000000
pz 0 0.779871227 0.779871227 1.559742455 0.000000000
sum over m 2.353687868 2.353687868 4.707375736 0.000000000
px 1 -0.008725152 -0.008725152 -0.017450305 0.000000000
py 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
pz 1 -0.006467431 -0.006467431 -0.012934861 0.000000000
sum over m -0.023928314 -0.023928314 -0.047856627 0.000000000
sum over m+mul 2.329759554 2.329759554 4.659519109 0.000000000
d3z^2-r^2 0 -0.006389921 -0.006389921 -0.012779843 0.000000000
dx^2-y^2 0 -0.005060831 -0.005060831 -0.010121663 0.000000000
dxy 0 -0.005433558 -0.005433558 -0.010867116 0.000000000
dxz 0 -0.006934055 -0.006934055 -0.013868111 0.000000000
dyz 0 -0.006932408 -0.006932408 -0.013864816 0.000000000
sum over m -0.030750774 -0.030750774 -0.061501548 0.000000000
sum over m+mul -0.030750774 -0.030750774 -0.061501548 0.000000000
496 O Up spin Down spin Sum Diff
multiple
s 0 0.893906943 0.893906943 1.787813886 0.000000000
sum over m 0.893906943 0.893906943 1.787813886 0.000000000
s 1 -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m+mul 0.890864367 0.890864367 1.781728733 0.000000000
px 0 0.787020216 0.787020216 1.574040431 0.000000000
py 0 0.787068705 0.787068705 1.574137410 0.000000000
pz 0 0.779696226 0.779696226 1.559392453 0.000000000
sum over m 2.353785147 2.353785147 4.707570294 0.000000000
px 1 -0.008731428 -0.008731428 -0.017462857 0.000000000
py 1 -0.008736847 -0.008736847 -0.017473695 0.000000000
pz 1 -0.006454271 -0.006454271 -0.012908542 0.000000000
sum over m -0.023922547 -0.023922547 -0.047845094 0.000000000
sum over m+mul 2.329862600 2.329862600 4.659725200 0.000000000
d3z^2-r^2 0 -0.006390048 -0.006390048 -0.012780096 0.000000000
dx^2-y^2 0 -0.005053782 -0.005053782 -0.010107564 0.000000000
dxy 0 -0.005435831 -0.005435831 -0.010871662 0.000000000
dxz 0 -0.006926865 -0.006926865 -0.013853730 0.000000000
dyz 0 -0.006923376 -0.006923376 -0.013846752 0.000000000
sum over m -0.030729902 -0.030729902 -0.061459804 0.000000000
sum over m+mul -0.030729902 -0.030729902 -0.061459804 0.000000000
497 O Up spin Down spin Sum Diff
multiple
s 0 0.893893710 0.893893710 1.787787419 0.000000000
sum over m 0.893893710 0.893893710 1.787787419 0.000000000
s 1 -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m+mul 0.890851876 0.890851876 1.781703752 0.000000000
px 0 0.786895587 0.786895587 1.573791175 0.000000000
py 0 0.787091794 0.787091794 1.574183588 0.000000000
pz 0 0.779775435 0.779775435 1.559550870 0.000000000
sum over m 2.353762817 2.353762817 4.707525633 0.000000000
px 1 -0.008729916 -0.008729916 -0.017459831 0.000000000
py 1 -0.008743439 -0.008743439 -0.017486877 0.000000000
pz 1 -0.006461929 -0.006461929 -0.012923858 0.000000000
sum over m -0.023935283 -0.023935283 -0.047870567 0.000000000
sum over m+mul 2.329827533 2.329827533 4.659655066 0.000000000
d3z^2-r^2 0 -0.006390598 -0.006390598 -0.012781196 0.000000000
dx^2-y^2 0 -0.005058057 -0.005058057 -0.010116115 0.000000000
dxy 0 -0.005434854 -0.005434854 -0.010869708 0.000000000
dxz 0 -0.006932221 -0.006932221 -0.013864442 0.000000000
dyz 0 -0.006926194 -0.006926194 -0.013852388 0.000000000
sum over m -0.030741924 -0.030741924 -0.061483848 0.000000000
sum over m+mul -0.030741924 -0.030741924 -0.061483848 0.000000000
498 O Up spin Down spin Sum Diff
multiple
s 0 0.893902752 0.893902752 1.787805505 0.000000000
sum over m 0.893902752 0.893902752 1.787805505 0.000000000
s 1 -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m+mul 0.890860725 0.890860725 1.781721450 0.000000000
px 0 0.787139398 0.787139398 1.574278796 0.000000000
py 0 0.786819648 0.786819648 1.573639297 0.000000000
pz 0 0.779778741 0.779778741 1.559557482 0.000000000
sum over m 2.353737788 2.353737788 4.707475575 0.000000000
px 1 -0.008745736 -0.008745736 -0.017491472 0.000000000
py 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
pz 1 -0.006462867 -0.006462867 -0.012925734 0.000000000
sum over m -0.023944334 -0.023944334 -0.047888668 0.000000000
sum over m+mul 2.329793454 2.329793454 4.659586908 0.000000000
d3z^2-r^2 0 -0.006391160 -0.006391160 -0.012782321 0.000000000
dx^2-y^2 0 -0.005058206 -0.005058206 -0.010116413 0.000000000
dxy 0 -0.005434582 -0.005434582 -0.010869165 0.000000000
dxz 0 -0.006927117 -0.006927117 -0.013854234 0.000000000
dyz 0 -0.006932318 -0.006932318 -0.013864636 0.000000000
sum over m -0.030743384 -0.030743384 -0.061486768 0.000000000
sum over m+mul -0.030743384 -0.030743384 -0.061486768 0.000000000
499 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000794346 1.000794346 2.001588692 0.000000000
sum over m 1.000794346 1.000794346 2.001588692 0.000000000
s 1 0.207399176 0.207399176 0.414798351 0.000000000
sum over m 0.207399176 0.207399176 0.414798351 0.000000000
s 2 0.014720923 0.014720923 0.029441846 0.000000000
sum over m 0.014720923 0.014720923 0.029441846 0.000000000
sum over m+mul 1.222914444 1.222914444 2.445828889 0.000000000
px 0 1.006370005 1.006370005 2.012740010 0.000000000
py 0 1.006381344 1.006381344 2.012762688 0.000000000
pz 0 1.006214475 1.006214475 2.012428949 0.000000000
sum over m 3.018965824 3.018965824 6.037931648 0.000000000
px 1 0.065452018 0.065452018 0.130904035 0.000000000
py 1 0.065434730 0.065434730 0.130869461 0.000000000
pz 1 0.040359774 0.040359774 0.080719549 0.000000000
sum over m 0.171246522 0.171246522 0.342493044 0.000000000
sum over m+mul 3.190212346 3.190212346 6.380424692 0.000000000
d3z^2-r^2 0 0.196317000 0.196317000 0.392634000 0.000000000
dx^2-y^2 0 0.201535060 0.201535060 0.403070119 0.000000000
dxy 0 0.250932486 0.250932486 0.501864973 0.000000000
dxz 0 0.268493958 0.268493958 0.536987917 0.000000000
dyz 0 0.268481712 0.268481712 0.536963424 0.000000000
sum over m 1.185760217 1.185760217 2.371520433 0.000000000
d3z^2-r^2 1 0.003471608 0.003471608 0.006943216 0.000000000
dx^2-y^2 1 -0.004483514 -0.004483514 -0.008967027 0.000000000
dxy 1 0.015345845 0.015345845 0.030691691 0.000000000
dxz 1 0.003490453 0.003490453 0.006980907 0.000000000
dyz 1 0.003488639 0.003488639 0.006977279 0.000000000
sum over m 0.021313033 0.021313033 0.042626066 0.000000000
sum over m+mul 1.207073249 1.207073249 2.414146499 0.000000000
500 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000774711 1.000774711 2.001549422 0.000000000
sum over m 1.000774711 1.000774711 2.001549422 0.000000000
s 1 0.207407309 0.207407309 0.414814618 0.000000000
sum over m 0.207407309 0.207407309 0.414814618 0.000000000
s 2 0.014723324 0.014723324 0.029446649 0.000000000
sum over m 0.014723324 0.014723324 0.029446649 0.000000000
sum over m+mul 1.222905344 1.222905344 2.445810689 0.000000000
px 0 1.006372285 1.006372285 2.012744570 0.000000000
py 0 1.006382809 1.006382809 2.012765618 0.000000000
pz 0 1.006198612 1.006198612 2.012397224 0.000000000
sum over m 3.018953706 3.018953706 6.037907412 0.000000000
px 1 0.065429039 0.065429039 0.130858078 0.000000000
py 1 0.065431480 0.065431480 0.130862961 0.000000000
pz 1 0.040374926 0.040374926 0.080749852 0.000000000
sum over m 0.171235445 0.171235445 0.342470891 0.000000000
sum over m+mul 3.190189151 3.190189151 6.380378302 0.000000000
d3z^2-r^2 0 0.196296472 0.196296472 0.392592943 0.000000000
dx^2-y^2 0 0.201520043 0.201520043 0.403040086 0.000000000
dxy 0 0.250928325 0.250928325 0.501856650 0.000000000
dxz 0 0.268513479 0.268513479 0.537026958 0.000000000
dyz 0 0.268492796 0.268492796 0.536985593 0.000000000
sum over m 1.185751115 1.185751115 2.371502230 0.000000000
d3z^2-r^2 1 0.003473219 0.003473219 0.006946439 0.000000000
dx^2-y^2 1 -0.004478692 -0.004478692 -0.008957384 0.000000000
dxy 1 0.015341024 0.015341024 0.030682047 0.000000000
dxz 1 0.003487435 0.003487435 0.006974871 0.000000000
dyz 1 0.003485600 0.003485600 0.006971200 0.000000000
sum over m 0.021308586 0.021308586 0.042617172 0.000000000
sum over m+mul 1.207059701 1.207059701 2.414119402 0.000000000
501 O Up spin Down spin Sum Diff
multiple
s 0 0.893859098 0.893859098 1.787718196 0.000000000
sum over m 0.893859098 0.893859098 1.787718196 0.000000000
s 1 -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m -0.003041530 -0.003041530 -0.006083059 0.000000000
sum over m+mul 0.890817568 0.890817568 1.781635137 0.000000000
px 0 0.786877142 0.786877142 1.573754285 0.000000000
py 0 0.786939499 0.786939499 1.573878997 0.000000000
pz 0 0.779871227 0.779871227 1.559742455 0.000000000
sum over m 2.353687868 2.353687868 4.707375737 0.000000000
px 1 -0.008725153 -0.008725153 -0.017450305 0.000000000
py 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
pz 1 -0.006467431 -0.006467431 -0.012934861 0.000000000
sum over m -0.023928314 -0.023928314 -0.047856628 0.000000000
sum over m+mul 2.329759555 2.329759555 4.659519109 0.000000000
d3z^2-r^2 0 -0.006389921 -0.006389921 -0.012779843 0.000000000
dx^2-y^2 0 -0.005060831 -0.005060831 -0.010121663 0.000000000
dxy 0 -0.005433558 -0.005433558 -0.010867116 0.000000000
dxz 0 -0.006934055 -0.006934055 -0.013868111 0.000000000
dyz 0 -0.006932408 -0.006932408 -0.013864816 0.000000000
sum over m -0.030750774 -0.030750774 -0.061501548 0.000000000
sum over m+mul -0.030750774 -0.030750774 -0.061501548 0.000000000
502 O Up spin Down spin Sum Diff
multiple
s 0 0.893906943 0.893906943 1.787813886 0.000000000
sum over m 0.893906943 0.893906943 1.787813886 0.000000000
s 1 -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m -0.003042576 -0.003042576 -0.006085153 0.000000000
sum over m+mul 0.890864367 0.890864367 1.781728733 0.000000000
px 0 0.787020216 0.787020216 1.574040431 0.000000000
py 0 0.787068705 0.787068705 1.574137410 0.000000000
pz 0 0.779696226 0.779696226 1.559392453 0.000000000
sum over m 2.353785147 2.353785147 4.707570294 0.000000000
px 1 -0.008731428 -0.008731428 -0.017462857 0.000000000
py 1 -0.008736847 -0.008736847 -0.017473695 0.000000000
pz 1 -0.006454271 -0.006454271 -0.012908542 0.000000000
sum over m -0.023922547 -0.023922547 -0.047845094 0.000000000
sum over m+mul 2.329862600 2.329862600 4.659725200 0.000000000
d3z^2-r^2 0 -0.006390048 -0.006390048 -0.012780096 0.000000000
dx^2-y^2 0 -0.005053782 -0.005053782 -0.010107564 0.000000000
dxy 0 -0.005435831 -0.005435831 -0.010871662 0.000000000
dxz 0 -0.006926865 -0.006926865 -0.013853730 0.000000000
dyz 0 -0.006923376 -0.006923376 -0.013846752 0.000000000
sum over m -0.030729902 -0.030729902 -0.061459804 0.000000000
sum over m+mul -0.030729902 -0.030729902 -0.061459804 0.000000000
503 O Up spin Down spin Sum Diff
multiple
s 0 0.893893710 0.893893710 1.787787419 0.000000000
sum over m 0.893893710 0.893893710 1.787787419 0.000000000
s 1 -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m -0.003041834 -0.003041834 -0.006083668 0.000000000
sum over m+mul 0.890851876 0.890851876 1.781703752 0.000000000
px 0 0.786895587 0.786895587 1.573791175 0.000000000
py 0 0.787091794 0.787091794 1.574183589 0.000000000
pz 0 0.779775435 0.779775435 1.559550870 0.000000000
sum over m 2.353762817 2.353762817 4.707525633 0.000000000
px 1 -0.008729916 -0.008729916 -0.017459831 0.000000000
py 1 -0.008743439 -0.008743439 -0.017486877 0.000000000
pz 1 -0.006461929 -0.006461929 -0.012923858 0.000000000
sum over m -0.023935283 -0.023935283 -0.047870567 0.000000000
sum over m+mul 2.329827533 2.329827533 4.659655066 0.000000000
d3z^2-r^2 0 -0.006390598 -0.006390598 -0.012781196 0.000000000
dx^2-y^2 0 -0.005058057 -0.005058057 -0.010116115 0.000000000
dxy 0 -0.005434854 -0.005434854 -0.010869707 0.000000000
dxz 0 -0.006932221 -0.006932221 -0.013864442 0.000000000
dyz 0 -0.006926194 -0.006926194 -0.013852388 0.000000000
sum over m -0.030741924 -0.030741924 -0.061483848 0.000000000
sum over m+mul -0.030741924 -0.030741924 -0.061483848 0.000000000
504 O Up spin Down spin Sum Diff
multiple
s 0 0.893902753 0.893902753 1.787805505 0.000000000
sum over m 0.893902753 0.893902753 1.787805505 0.000000000
s 1 -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m -0.003042027 -0.003042027 -0.006084055 0.000000000
sum over m+mul 0.890860725 0.890860725 1.781721450 0.000000000
px 0 0.787139398 0.787139398 1.574278797 0.000000000
py 0 0.786819648 0.786819648 1.573639297 0.000000000
pz 0 0.779778741 0.779778741 1.559557482 0.000000000
sum over m 2.353737788 2.353737788 4.707475575 0.000000000
px 1 -0.008745736 -0.008745736 -0.017491472 0.000000000
py 1 -0.008735731 -0.008735731 -0.017471461 0.000000000
pz 1 -0.006462867 -0.006462867 -0.012925734 0.000000000
sum over m -0.023944334 -0.023944334 -0.047888668 0.000000000
sum over m+mul 2.329793454 2.329793454 4.659586908 0.000000000
d3z^2-r^2 0 -0.006391160 -0.006391160 -0.012782321 0.000000000
dx^2-y^2 0 -0.005058206 -0.005058206 -0.010116413 0.000000000
dxy 0 -0.005434582 -0.005434582 -0.010869165 0.000000000
dxz 0 -0.006927117 -0.006927117 -0.013854234 0.000000000
dyz 0 -0.006932318 -0.006932318 -0.013864636 0.000000000
sum over m -0.030743384 -0.030743384 -0.061486768 0.000000000
sum over m+mul -0.030743384 -0.030743384 -0.061486768 0.000000000
505 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000771124 1.000771124 2.001542247 0.000000000
sum over m 1.000771124 1.000771124 2.001542247 0.000000000
s 1 0.207404835 0.207404835 0.414809670 0.000000000
sum over m 0.207404835 0.207404835 0.414809670 0.000000000
s 2 0.014723645 0.014723645 0.029447291 0.000000000
sum over m 0.014723645 0.014723645 0.029447291 0.000000000
sum over m+mul 1.222899604 1.222899604 2.445799208 0.000000000
px 0 1.006375680 1.006375680 2.012751359 0.000000000
py 0 1.006375680 1.006375680 2.012751359 0.000000000
pz 0 1.006201032 1.006201032 2.012402063 0.000000000
sum over m 3.018952391 3.018952391 6.037904782 0.000000000
px 1 0.065432025 0.065432025 0.130864050 0.000000000
py 1 0.065432025 0.065432025 0.130864050 0.000000000
pz 1 0.040373518 0.040373518 0.080747037 0.000000000
sum over m 0.171237569 0.171237569 0.342475137 0.000000000
sum over m+mul 3.190189960 3.190189960 6.380379919 0.000000000
d3z^2-r^2 0 0.196325657 0.196325657 0.392651313 0.000000000
dx^2-y^2 0 0.201528394 0.201528394 0.403056789 0.000000000
dxy 0 0.250938521 0.250938521 0.501877041 0.000000000
dxz 0 0.268491876 0.268491876 0.536983753 0.000000000
dyz 0 0.268491877 0.268491877 0.536983753 0.000000000
sum over m 1.185776324 1.185776324 2.371552649 0.000000000
d3z^2-r^2 1 0.003475853 0.003475853 0.006951707 0.000000000
dx^2-y^2 1 -0.004477967 -0.004477967 -0.008955935 0.000000000
dxy 1 0.015344177 0.015344177 0.030688354 0.000000000
dxz 1 0.003496792 0.003496792 0.006993583 0.000000000
dyz 1 0.003496792 0.003496792 0.006993583 0.000000000
sum over m 0.021335647 0.021335647 0.042671293 0.000000000
sum over m+mul 1.207111971 1.207111971 2.414223942 0.000000000
506 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000745930 1.000745930 2.001491861 0.000000000
sum over m 1.000745930 1.000745930 2.001491861 0.000000000
s 1 0.207418648 0.207418648 0.414837295 0.000000000
sum over m 0.207418648 0.207418648 0.414837295 0.000000000
s 2 0.014725569 0.014725569 0.029451137 0.000000000
sum over m 0.014725569 0.014725569 0.029451137 0.000000000
sum over m+mul 1.222890147 1.222890147 2.445780293 0.000000000
px 0 1.006388133 1.006388133 2.012776265 0.000000000
py 0 1.006388132 1.006388132 2.012776265 0.000000000
pz 0 1.006212111 1.006212111 2.012424222 0.000000000
sum over m 3.018988376 3.018988376 6.037976752 0.000000000
px 1 0.065410627 0.065410627 0.130821254 0.000000000
py 1 0.065410627 0.065410627 0.130821254 0.000000000
pz 1 0.040391458 0.040391458 0.080782915 0.000000000
sum over m 0.171212712 0.171212712 0.342425424 0.000000000
sum over m+mul 3.190201088 3.190201088 6.380402176 0.000000000
d3z^2-r^2 0 0.196287122 0.196287122 0.392574244 0.000000000
dx^2-y^2 0 0.201527539 0.201527539 0.403055078 0.000000000
dxy 0 0.250904239 0.250904239 0.501808479 0.000000000
dxz 0 0.268518766 0.268518766 0.537037532 0.000000000
dyz 0 0.268518766 0.268518766 0.537037532 0.000000000
sum over m 1.185756432 1.185756432 2.371512865 0.000000000
d3z^2-r^2 1 0.003478853 0.003478853 0.006957706 0.000000000
dx^2-y^2 1 -0.004471089 -0.004471089 -0.008942179 0.000000000
dxy 1 0.015339360 0.015339360 0.030678719 0.000000000
dxz 1 0.003488242 0.003488242 0.006976485 0.000000000
dyz 1 0.003488242 0.003488242 0.006976485 0.000000000
sum over m 0.021323608 0.021323608 0.042647216 0.000000000
sum over m+mul 1.207080041 1.207080041 2.414160081 0.000000000
507 O Up spin Down spin Sum Diff
multiple
s 0 0.893844755 0.893844755 1.787689510 0.000000000
sum over m 0.893844755 0.893844755 1.787689510 0.000000000
s 1 -0.003042247 -0.003042247 -0.006084494 0.000000000
sum over m -0.003042247 -0.003042247 -0.006084494 0.000000000
sum over m+mul 0.890802508 0.890802508 1.781605016 0.000000000
px 0 0.786875351 0.786875351 1.573750701 0.000000000
py 0 0.786875351 0.786875351 1.573750701 0.000000000
pz 0 0.779893593 0.779893593 1.559787185 0.000000000
sum over m 2.353644294 2.353644294 4.707288588 0.000000000
px 1 -0.008733176 -0.008733176 -0.017466353 0.000000000
py 1 -0.008733176 -0.008733176 -0.017466353 0.000000000
pz 1 -0.006466755 -0.006466755 -0.012933509 0.000000000
sum over m -0.023933108 -0.023933108 -0.047866215 0.000000000
sum over m+mul 2.329711186 2.329711186 4.659422373 0.000000000
d3z^2-r^2 0 -0.006389262 -0.006389262 -0.012778524 0.000000000
dx^2-y^2 0 -0.005061423 -0.005061423 -0.010122847 0.000000000
dxy 0 -0.005431671 -0.005431671 -0.010863342 0.000000000
dxz 0 -0.006935209 -0.006935209 -0.013870418 0.000000000
dyz 0 -0.006935209 -0.006935209 -0.013870418 0.000000000
sum over m -0.030752774 -0.030752774 -0.061505549 0.000000000
sum over m+mul -0.030752774 -0.030752774 -0.061505549 0.000000000
508 O Up spin Down spin Sum Diff
multiple
s 0 0.893912763 0.893912763 1.787825526 0.000000000
sum over m 0.893912763 0.893912763 1.787825526 0.000000000
s 1 -0.003042849 -0.003042849 -0.006085698 0.000000000
sum over m -0.003042849 -0.003042849 -0.006085698 0.000000000
sum over m+mul 0.890869914 0.890869914 1.781739827 0.000000000
px 0 0.787030361 0.787030361 1.574060721 0.000000000
py 0 0.787030360 0.787030360 1.574060721 0.000000000
pz 0 0.779715762 0.779715762 1.559431525 0.000000000
sum over m 2.353776483 2.353776483 4.707552967 0.000000000
px 1 -0.008738709 -0.008738709 -0.017477417 0.000000000
py 1 -0.008738709 -0.008738709 -0.017477417 0.000000000
pz 1 -0.006459030 -0.006459030 -0.012918061 0.000000000
sum over m -0.023936448 -0.023936448 -0.047872895 0.000000000
sum over m+mul 2.329840036 2.329840036 4.659680071 0.000000000
d3z^2-r^2 0 -0.006390607 -0.006390607 -0.012781214 0.000000000
dx^2-y^2 0 -0.005054867 -0.005054867 -0.010109734 0.000000000
dxy 0 -0.005435887 -0.005435887 -0.010871774 0.000000000
dxz 0 -0.006927842 -0.006927842 -0.013855685 0.000000000
dyz 0 -0.006927842 -0.006927842 -0.013855685 0.000000000
sum over m -0.030737045 -0.030737045 -0.061474091 0.000000000
sum over m+mul -0.030737045 -0.030737045 -0.061474091 0.000000000
509 O Up spin Down spin Sum Diff
multiple
s 0 0.893911080 0.893911080 1.787822159 0.000000000
sum over m 0.893911080 0.893911080 1.787822159 0.000000000
s 1 -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m+mul 0.890868718 0.890868718 1.781737435 0.000000000
px 0 0.786877548 0.786877548 1.573755096 0.000000000
py 0 0.787128937 0.787128937 1.574257875 0.000000000
pz 0 0.779760124 0.779760124 1.559520248 0.000000000
sum over m 2.353766609 2.353766609 4.707533219 0.000000000
px 1 -0.008737351 -0.008737351 -0.017474701 0.000000000
py 1 -0.008746473 -0.008746473 -0.017492946 0.000000000
pz 1 -0.006461545 -0.006461545 -0.012923089 0.000000000
sum over m -0.023945368 -0.023945368 -0.047890736 0.000000000
sum over m+mul 2.329821241 2.329821241 4.659642482 0.000000000
d3z^2-r^2 0 -0.006390862 -0.006390862 -0.012781724 0.000000000
dx^2-y^2 0 -0.005057552 -0.005057552 -0.010115104 0.000000000
dxy 0 -0.005435549 -0.005435549 -0.010871099 0.000000000
dxz 0 -0.006932912 -0.006932912 -0.013865825 0.000000000
dyz 0 -0.006926386 -0.006926386 -0.013852773 0.000000000
sum over m -0.030743262 -0.030743262 -0.061486525 0.000000000
sum over m+mul -0.030743262 -0.030743262 -0.061486525 0.000000000
510 O Up spin Down spin Sum Diff
multiple
s 0 0.893911079 0.893911079 1.787822159 0.000000000
sum over m 0.893911079 0.893911079 1.787822159 0.000000000
s 1 -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m+mul 0.890868718 0.890868718 1.781737435 0.000000000
px 0 0.787128937 0.787128937 1.574257875 0.000000000
py 0 0.786877548 0.786877548 1.573755096 0.000000000
pz 0 0.779760124 0.779760124 1.559520248 0.000000000
sum over m 2.353766609 2.353766609 4.707533218 0.000000000
px 1 -0.008746473 -0.008746473 -0.017492946 0.000000000
py 1 -0.008737351 -0.008737351 -0.017474701 0.000000000
pz 1 -0.006461545 -0.006461545 -0.012923090 0.000000000
sum over m -0.023945368 -0.023945368 -0.047890736 0.000000000
sum over m+mul 2.329821241 2.329821241 4.659642482 0.000000000
d3z^2-r^2 0 -0.006390862 -0.006390862 -0.012781724 0.000000000
dx^2-y^2 0 -0.005057552 -0.005057552 -0.010115104 0.000000000
dxy 0 -0.005435549 -0.005435549 -0.010871099 0.000000000
dxz 0 -0.006926386 -0.006926386 -0.013852773 0.000000000
dyz 0 -0.006932912 -0.006932912 -0.013865825 0.000000000
sum over m -0.030743262 -0.030743262 -0.061486525 0.000000000
sum over m+mul -0.030743262 -0.030743262 -0.061486525 0.000000000
511 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000771124 1.000771124 2.001542247 0.000000000
sum over m 1.000771124 1.000771124 2.001542247 0.000000000
s 1 0.207404835 0.207404835 0.414809670 0.000000000
sum over m 0.207404835 0.207404835 0.414809670 0.000000000
s 2 0.014723645 0.014723645 0.029447291 0.000000000
sum over m 0.014723645 0.014723645 0.029447291 0.000000000
sum over m+mul 1.222899604 1.222899604 2.445799208 0.000000000
px 0 1.006375680 1.006375680 2.012751360 0.000000000
py 0 1.006375680 1.006375680 2.012751360 0.000000000
pz 0 1.006201032 1.006201032 2.012402063 0.000000000
sum over m 3.018952391 3.018952391 6.037904783 0.000000000
px 1 0.065432025 0.065432025 0.130864050 0.000000000
py 1 0.065432025 0.065432025 0.130864050 0.000000000
pz 1 0.040373518 0.040373518 0.080747037 0.000000000
sum over m 0.171237568 0.171237568 0.342475137 0.000000000
sum over m+mul 3.190189960 3.190189960 6.380379919 0.000000000
d3z^2-r^2 0 0.196325657 0.196325657 0.392651313 0.000000000
dx^2-y^2 0 0.201528394 0.201528394 0.403056788 0.000000000
dxy 0 0.250938520 0.250938520 0.501877041 0.000000000
dxz 0 0.268491876 0.268491876 0.536983753 0.000000000
dyz 0 0.268491876 0.268491876 0.536983753 0.000000000
sum over m 1.185776324 1.185776324 2.371552648 0.000000000
d3z^2-r^2 1 0.003475853 0.003475853 0.006951707 0.000000000
dx^2-y^2 1 -0.004477967 -0.004477967 -0.008955935 0.000000000
dxy 1 0.015344177 0.015344177 0.030688354 0.000000000
dxz 1 0.003496792 0.003496792 0.006993583 0.000000000
dyz 1 0.003496792 0.003496792 0.006993583 0.000000000
sum over m 0.021335646 0.021335646 0.042671293 0.000000000
sum over m+mul 1.207111970 1.207111970 2.414223941 0.000000000
512 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000745930 1.000745930 2.001491861 0.000000000
sum over m 1.000745930 1.000745930 2.001491861 0.000000000
s 1 0.207418648 0.207418648 0.414837296 0.000000000
sum over m 0.207418648 0.207418648 0.414837296 0.000000000
s 2 0.014725569 0.014725569 0.029451137 0.000000000
sum over m 0.014725569 0.014725569 0.029451137 0.000000000
sum over m+mul 1.222890147 1.222890147 2.445780293 0.000000000
px 0 1.006388133 1.006388133 2.012776265 0.000000000
py 0 1.006388133 1.006388133 2.012776265 0.000000000
pz 0 1.006212111 1.006212111 2.012424222 0.000000000
sum over m 3.018988376 3.018988376 6.037976753 0.000000000
px 1 0.065410627 0.065410627 0.130821254 0.000000000
py 1 0.065410627 0.065410627 0.130821254 0.000000000
pz 1 0.040391458 0.040391458 0.080782916 0.000000000
sum over m 0.171212712 0.171212712 0.342425424 0.000000000
sum over m+mul 3.190201088 3.190201088 6.380402176 0.000000000
d3z^2-r^2 0 0.196287122 0.196287122 0.392574244 0.000000000
dx^2-y^2 0 0.201527539 0.201527539 0.403055078 0.000000000
dxy 0 0.250904239 0.250904239 0.501808479 0.000000000
dxz 0 0.268518766 0.268518766 0.537037532 0.000000000
dyz 0 0.268518766 0.268518766 0.537037532 0.000000000
sum over m 1.185756432 1.185756432 2.371512864 0.000000000
d3z^2-r^2 1 0.003478853 0.003478853 0.006957706 0.000000000
dx^2-y^2 1 -0.004471089 -0.004471089 -0.008942179 0.000000000
dxy 1 0.015339360 0.015339360 0.030678719 0.000000000
dxz 1 0.003488242 0.003488242 0.006976485 0.000000000
dyz 1 0.003488242 0.003488242 0.006976485 0.000000000
sum over m 0.021323608 0.021323608 0.042647216 0.000000000
sum over m+mul 1.207080040 1.207080040 2.414160080 0.000000000
513 O Up spin Down spin Sum Diff
multiple
s 0 0.893844755 0.893844755 1.787689510 0.000000000
sum over m 0.893844755 0.893844755 1.787689510 0.000000000
s 1 -0.003042247 -0.003042247 -0.006084494 0.000000000
sum over m -0.003042247 -0.003042247 -0.006084494 0.000000000
sum over m+mul 0.890802508 0.890802508 1.781605016 0.000000000
px 0 0.786875351 0.786875351 1.573750701 0.000000000
py 0 0.786875351 0.786875351 1.573750701 0.000000000
pz 0 0.779893592 0.779893592 1.559787185 0.000000000
sum over m 2.353644294 2.353644294 4.707288588 0.000000000
px 1 -0.008733176 -0.008733176 -0.017466353 0.000000000
py 1 -0.008733176 -0.008733176 -0.017466353 0.000000000
pz 1 -0.006466755 -0.006466755 -0.012933509 0.000000000
sum over m -0.023933108 -0.023933108 -0.047866215 0.000000000
sum over m+mul 2.329711186 2.329711186 4.659422372 0.000000000
d3z^2-r^2 0 -0.006389262 -0.006389262 -0.012778524 0.000000000
dx^2-y^2 0 -0.005061423 -0.005061423 -0.010122847 0.000000000
dxy 0 -0.005431671 -0.005431671 -0.010863342 0.000000000
dxz 0 -0.006935209 -0.006935209 -0.013870418 0.000000000
dyz 0 -0.006935209 -0.006935209 -0.013870418 0.000000000
sum over m -0.030752774 -0.030752774 -0.061505548 0.000000000
sum over m+mul -0.030752774 -0.030752774 -0.061505548 0.000000000
514 O Up spin Down spin Sum Diff
multiple
s 0 0.893912763 0.893912763 1.787825525 0.000000000
sum over m 0.893912763 0.893912763 1.787825525 0.000000000
s 1 -0.003042849 -0.003042849 -0.006085698 0.000000000
sum over m -0.003042849 -0.003042849 -0.006085698 0.000000000
sum over m+mul 0.890869914 0.890869914 1.781739827 0.000000000
px 0 0.787030361 0.787030361 1.574060721 0.000000000
py 0 0.787030360 0.787030360 1.574060721 0.000000000
pz 0 0.779715762 0.779715762 1.559431524 0.000000000
sum over m 2.353776483 2.353776483 4.707552966 0.000000000
px 1 -0.008738709 -0.008738709 -0.017477417 0.000000000
py 1 -0.008738709 -0.008738709 -0.017477417 0.000000000
pz 1 -0.006459030 -0.006459030 -0.012918061 0.000000000
sum over m -0.023936448 -0.023936448 -0.047872895 0.000000000
sum over m+mul 2.329840035 2.329840035 4.659680071 0.000000000
d3z^2-r^2 0 -0.006390607 -0.006390607 -0.012781214 0.000000000
dx^2-y^2 0 -0.005054867 -0.005054867 -0.010109734 0.000000000
dxy 0 -0.005435887 -0.005435887 -0.010871774 0.000000000
dxz 0 -0.006927842 -0.006927842 -0.013855685 0.000000000
dyz 0 -0.006927842 -0.006927842 -0.013855685 0.000000000
sum over m -0.030737045 -0.030737045 -0.061474091 0.000000000
sum over m+mul -0.030737045 -0.030737045 -0.061474091 0.000000000
515 O Up spin Down spin Sum Diff
multiple
s 0 0.893911080 0.893911080 1.787822159 0.000000000
sum over m 0.893911080 0.893911080 1.787822159 0.000000000
s 1 -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m+mul 0.890868718 0.890868718 1.781737435 0.000000000
px 0 0.786877548 0.786877548 1.573755096 0.000000000
py 0 0.787128938 0.787128938 1.574257875 0.000000000
pz 0 0.779760124 0.779760124 1.559520248 0.000000000
sum over m 2.353766610 2.353766610 4.707533219 0.000000000
px 1 -0.008737351 -0.008737351 -0.017474701 0.000000000
py 1 -0.008746473 -0.008746473 -0.017492946 0.000000000
pz 1 -0.006461545 -0.006461545 -0.012923089 0.000000000
sum over m -0.023945368 -0.023945368 -0.047890736 0.000000000
sum over m+mul 2.329821242 2.329821242 4.659642483 0.000000000
d3z^2-r^2 0 -0.006390862 -0.006390862 -0.012781724 0.000000000
dx^2-y^2 0 -0.005057552 -0.005057552 -0.010115104 0.000000000
dxy 0 -0.005435549 -0.005435549 -0.010871099 0.000000000
dxz 0 -0.006932912 -0.006932912 -0.013865825 0.000000000
dyz 0 -0.006926386 -0.006926386 -0.013852773 0.000000000
sum over m -0.030743262 -0.030743262 -0.061486525 0.000000000
sum over m+mul -0.030743262 -0.030743262 -0.061486525 0.000000000
516 O Up spin Down spin Sum Diff
multiple
s 0 0.893911080 0.893911080 1.787822159 0.000000000
sum over m 0.893911080 0.893911080 1.787822159 0.000000000
s 1 -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m+mul 0.890868718 0.890868718 1.781737435 0.000000000
px 0 0.787128937 0.787128937 1.574257875 0.000000000
py 0 0.786877548 0.786877548 1.573755096 0.000000000
pz 0 0.779760124 0.779760124 1.559520248 0.000000000
sum over m 2.353766609 2.353766609 4.707533219 0.000000000
px 1 -0.008746473 -0.008746473 -0.017492946 0.000000000
py 1 -0.008737351 -0.008737351 -0.017474701 0.000000000
pz 1 -0.006461545 -0.006461545 -0.012923090 0.000000000
sum over m -0.023945368 -0.023945368 -0.047890737 0.000000000
sum over m+mul 2.329821241 2.329821241 4.659642482 0.000000000
d3z^2-r^2 0 -0.006390862 -0.006390862 -0.012781724 0.000000000
dx^2-y^2 0 -0.005057552 -0.005057552 -0.010115104 0.000000000
dxy 0 -0.005435549 -0.005435549 -0.010871099 0.000000000
dxz 0 -0.006926386 -0.006926386 -0.013852773 0.000000000
dyz 0 -0.006932912 -0.006932912 -0.013865825 0.000000000
sum over m -0.030743262 -0.030743262 -0.061486525 0.000000000
sum over m+mul -0.030743262 -0.030743262 -0.061486525 0.000000000
517 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000771123 1.000771123 2.001542247 0.000000000
sum over m 1.000771123 1.000771123 2.001542247 0.000000000
s 1 0.207404835 0.207404835 0.414809670 0.000000000
sum over m 0.207404835 0.207404835 0.414809670 0.000000000
s 2 0.014723645 0.014723645 0.029447291 0.000000000
sum over m 0.014723645 0.014723645 0.029447291 0.000000000
sum over m+mul 1.222899604 1.222899604 2.445799208 0.000000000
px 0 1.006375680 1.006375680 2.012751360 0.000000000
py 0 1.006375680 1.006375680 2.012751360 0.000000000
pz 0 1.006201032 1.006201032 2.012402063 0.000000000
sum over m 3.018952391 3.018952391 6.037904782 0.000000000
px 1 0.065432025 0.065432025 0.130864050 0.000000000
py 1 0.065432025 0.065432025 0.130864050 0.000000000
pz 1 0.040373519 0.040373519 0.080747037 0.000000000
sum over m 0.171237569 0.171237569 0.342475137 0.000000000
sum over m+mul 3.190189960 3.190189960 6.380379920 0.000000000
d3z^2-r^2 0 0.196325657 0.196325657 0.392651313 0.000000000
dx^2-y^2 0 0.201528394 0.201528394 0.403056788 0.000000000
dxy 0 0.250938521 0.250938521 0.501877041 0.000000000
dxz 0 0.268491877 0.268491877 0.536983753 0.000000000
dyz 0 0.268491877 0.268491877 0.536983753 0.000000000
sum over m 1.185776324 1.185776324 2.371552649 0.000000000
d3z^2-r^2 1 0.003475853 0.003475853 0.006951707 0.000000000
dx^2-y^2 1 -0.004477967 -0.004477967 -0.008955935 0.000000000
dxy 1 0.015344177 0.015344177 0.030688354 0.000000000
dxz 1 0.003496792 0.003496792 0.006993583 0.000000000
dyz 1 0.003496792 0.003496792 0.006993583 0.000000000
sum over m 0.021335647 0.021335647 0.042671293 0.000000000
sum over m+mul 1.207111971 1.207111971 2.414223942 0.000000000
518 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000745930 1.000745930 2.001491861 0.000000000
sum over m 1.000745930 1.000745930 2.001491861 0.000000000
s 1 0.207418648 0.207418648 0.414837296 0.000000000
sum over m 0.207418648 0.207418648 0.414837296 0.000000000
s 2 0.014725569 0.014725569 0.029451137 0.000000000
sum over m 0.014725569 0.014725569 0.029451137 0.000000000
sum over m+mul 1.222890147 1.222890147 2.445780294 0.000000000
px 0 1.006388133 1.006388133 2.012776265 0.000000000
py 0 1.006388133 1.006388133 2.012776265 0.000000000
pz 0 1.006212111 1.006212111 2.012424222 0.000000000
sum over m 3.018988376 3.018988376 6.037976753 0.000000000
px 1 0.065410627 0.065410627 0.130821254 0.000000000
py 1 0.065410627 0.065410627 0.130821254 0.000000000
pz 1 0.040391458 0.040391458 0.080782916 0.000000000
sum over m 0.171212712 0.171212712 0.342425423 0.000000000
sum over m+mul 3.190201088 3.190201088 6.380402176 0.000000000
d3z^2-r^2 0 0.196287122 0.196287122 0.392574244 0.000000000
dx^2-y^2 0 0.201527539 0.201527539 0.403055079 0.000000000
dxy 0 0.250904239 0.250904239 0.501808478 0.000000000
dxz 0 0.268518766 0.268518766 0.537037532 0.000000000
dyz 0 0.268518766 0.268518766 0.537037532 0.000000000
sum over m 1.185756432 1.185756432 2.371512865 0.000000000
d3z^2-r^2 1 0.003478853 0.003478853 0.006957706 0.000000000
dx^2-y^2 1 -0.004471089 -0.004471089 -0.008942179 0.000000000
dxy 1 0.015339360 0.015339360 0.030678719 0.000000000
dxz 1 0.003488242 0.003488242 0.006976485 0.000000000
dyz 1 0.003488242 0.003488242 0.006976485 0.000000000
sum over m 0.021323608 0.021323608 0.042647216 0.000000000
sum over m+mul 1.207080040 1.207080040 2.414160081 0.000000000
519 O Up spin Down spin Sum Diff
multiple
s 0 0.893844755 0.893844755 1.787689510 0.000000000
sum over m 0.893844755 0.893844755 1.787689510 0.000000000
s 1 -0.003042247 -0.003042247 -0.006084494 0.000000000
sum over m -0.003042247 -0.003042247 -0.006084494 0.000000000
sum over m+mul 0.890802508 0.890802508 1.781605016 0.000000000
px 0 0.786875351 0.786875351 1.573750702 0.000000000
py 0 0.786875351 0.786875351 1.573750702 0.000000000
pz 0 0.779893593 0.779893593 1.559787185 0.000000000
sum over m 2.353644294 2.353644294 4.707288589 0.000000000
px 1 -0.008733177 -0.008733177 -0.017466353 0.000000000
py 1 -0.008733176 -0.008733176 -0.017466353 0.000000000
pz 1 -0.006466755 -0.006466755 -0.012933510 0.000000000
sum over m -0.023933108 -0.023933108 -0.047866215 0.000000000
sum over m+mul 2.329711187 2.329711187 4.659422373 0.000000000
d3z^2-r^2 0 -0.006389262 -0.006389262 -0.012778524 0.000000000
dx^2-y^2 0 -0.005061423 -0.005061423 -0.010122847 0.000000000
dxy 0 -0.005431671 -0.005431671 -0.010863342 0.000000000
dxz 0 -0.006935209 -0.006935209 -0.013870418 0.000000000
dyz 0 -0.006935209 -0.006935209 -0.013870418 0.000000000
sum over m -0.030752774 -0.030752774 -0.061505548 0.000000000
sum over m+mul -0.030752774 -0.030752774 -0.061505548 0.000000000
520 O Up spin Down spin Sum Diff
multiple
s 0 0.893912763 0.893912763 1.787825525 0.000000000
sum over m 0.893912763 0.893912763 1.787825525 0.000000000
s 1 -0.003042849 -0.003042849 -0.006085698 0.000000000
sum over m -0.003042849 -0.003042849 -0.006085698 0.000000000
sum over m+mul 0.890869914 0.890869914 1.781739827 0.000000000
px 0 0.787030361 0.787030361 1.574060721 0.000000000
py 0 0.787030361 0.787030361 1.574060721 0.000000000
pz 0 0.779715762 0.779715762 1.559431525 0.000000000
sum over m 2.353776483 2.353776483 4.707552967 0.000000000
px 1 -0.008738709 -0.008738709 -0.017477417 0.000000000
py 1 -0.008738709 -0.008738709 -0.017477417 0.000000000
pz 1 -0.006459030 -0.006459030 -0.012918061 0.000000000
sum over m -0.023936448 -0.023936448 -0.047872896 0.000000000
sum over m+mul 2.329840036 2.329840036 4.659680071 0.000000000
d3z^2-r^2 0 -0.006390607 -0.006390607 -0.012781214 0.000000000
dx^2-y^2 0 -0.005054867 -0.005054867 -0.010109734 0.000000000
dxy 0 -0.005435887 -0.005435887 -0.010871774 0.000000000
dxz 0 -0.006927842 -0.006927842 -0.013855685 0.000000000
dyz 0 -0.006927842 -0.006927842 -0.013855685 0.000000000
sum over m -0.030737045 -0.030737045 -0.061474091 0.000000000
sum over m+mul -0.030737045 -0.030737045 -0.061474091 0.000000000
521 O Up spin Down spin Sum Diff
multiple
s 0 0.893911080 0.893911080 1.787822159 0.000000000
sum over m 0.893911080 0.893911080 1.787822159 0.000000000
s 1 -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m+mul 0.890868718 0.890868718 1.781737435 0.000000000
px 0 0.786877548 0.786877548 1.573755096 0.000000000
py 0 0.787128937 0.787128937 1.574257875 0.000000000
pz 0 0.779760124 0.779760124 1.559520248 0.000000000
sum over m 2.353766610 2.353766610 4.707533220 0.000000000
px 1 -0.008737351 -0.008737351 -0.017474701 0.000000000
py 1 -0.008746473 -0.008746473 -0.017492946 0.000000000
pz 1 -0.006461545 -0.006461545 -0.012923089 0.000000000
sum over m -0.023945368 -0.023945368 -0.047890736 0.000000000
sum over m+mul 2.329821242 2.329821242 4.659642483 0.000000000
d3z^2-r^2 0 -0.006390862 -0.006390862 -0.012781724 0.000000000
dx^2-y^2 0 -0.005057552 -0.005057552 -0.010115104 0.000000000
dxy 0 -0.005435549 -0.005435549 -0.010871099 0.000000000
dxz 0 -0.006932912 -0.006932912 -0.013865825 0.000000000
dyz 0 -0.006926386 -0.006926386 -0.013852773 0.000000000
sum over m -0.030743262 -0.030743262 -0.061486525 0.000000000
sum over m+mul -0.030743262 -0.030743262 -0.061486525 0.000000000
522 O Up spin Down spin Sum Diff
multiple
s 0 0.893911080 0.893911080 1.787822159 0.000000000
sum over m 0.893911080 0.893911080 1.787822159 0.000000000
s 1 -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m+mul 0.890868718 0.890868718 1.781737435 0.000000000
px 0 0.787128937 0.787128937 1.574257875 0.000000000
py 0 0.786877548 0.786877548 1.573755096 0.000000000
pz 0 0.779760124 0.779760124 1.559520248 0.000000000
sum over m 2.353766609 2.353766609 4.707533218 0.000000000
px 1 -0.008746473 -0.008746473 -0.017492946 0.000000000
py 1 -0.008737351 -0.008737351 -0.017474701 0.000000000
pz 1 -0.006461545 -0.006461545 -0.012923090 0.000000000
sum over m -0.023945368 -0.023945368 -0.047890737 0.000000000
sum over m+mul 2.329821241 2.329821241 4.659642482 0.000000000
d3z^2-r^2 0 -0.006390862 -0.006390862 -0.012781724 0.000000000
dx^2-y^2 0 -0.005057552 -0.005057552 -0.010115104 0.000000000
dxy 0 -0.005435549 -0.005435549 -0.010871099 0.000000000
dxz 0 -0.006926386 -0.006926386 -0.013852773 0.000000000
dyz 0 -0.006932912 -0.006932912 -0.013865825 0.000000000
sum over m -0.030743262 -0.030743262 -0.061486525 0.000000000
sum over m+mul -0.030743262 -0.030743262 -0.061486525 0.000000000
523 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000771124 1.000771124 2.001542247 0.000000000
sum over m 1.000771124 1.000771124 2.001542247 0.000000000
s 1 0.207404835 0.207404835 0.414809670 0.000000000
sum over m 0.207404835 0.207404835 0.414809670 0.000000000
s 2 0.014723645 0.014723645 0.029447291 0.000000000
sum over m 0.014723645 0.014723645 0.029447291 0.000000000
sum over m+mul 1.222899604 1.222899604 2.445799208 0.000000000
px 0 1.006375680 1.006375680 2.012751360 0.000000000
py 0 1.006375680 1.006375680 2.012751360 0.000000000
pz 0 1.006201032 1.006201032 2.012402063 0.000000000
sum over m 3.018952391 3.018952391 6.037904782 0.000000000
px 1 0.065432025 0.065432025 0.130864050 0.000000000
py 1 0.065432025 0.065432025 0.130864050 0.000000000
pz 1 0.040373518 0.040373518 0.080747037 0.000000000
sum over m 0.171237569 0.171237569 0.342475137 0.000000000
sum over m+mul 3.190189960 3.190189960 6.380379920 0.000000000
d3z^2-r^2 0 0.196325657 0.196325657 0.392651313 0.000000000
dx^2-y^2 0 0.201528394 0.201528394 0.403056788 0.000000000
dxy 0 0.250938521 0.250938521 0.501877041 0.000000000
dxz 0 0.268491876 0.268491876 0.536983753 0.000000000
dyz 0 0.268491877 0.268491877 0.536983753 0.000000000
sum over m 1.185776324 1.185776324 2.371552648 0.000000000
d3z^2-r^2 1 0.003475853 0.003475853 0.006951707 0.000000000
dx^2-y^2 1 -0.004477967 -0.004477967 -0.008955935 0.000000000
dxy 1 0.015344177 0.015344177 0.030688354 0.000000000
dxz 1 0.003496792 0.003496792 0.006993583 0.000000000
dyz 1 0.003496792 0.003496792 0.006993583 0.000000000
sum over m 0.021335647 0.021335647 0.042671293 0.000000000
sum over m+mul 1.207111971 1.207111971 2.414223941 0.000000000
524 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000745930 1.000745930 2.001491861 0.000000000
sum over m 1.000745930 1.000745930 2.001491861 0.000000000
s 1 0.207418648 0.207418648 0.414837296 0.000000000
sum over m 0.207418648 0.207418648 0.414837296 0.000000000
s 2 0.014725569 0.014725569 0.029451137 0.000000000
sum over m 0.014725569 0.014725569 0.029451137 0.000000000
sum over m+mul 1.222890147 1.222890147 2.445780293 0.000000000
px 0 1.006388132 1.006388132 2.012776265 0.000000000
py 0 1.006388133 1.006388133 2.012776265 0.000000000
pz 0 1.006212111 1.006212111 2.012424222 0.000000000
sum over m 3.018988376 3.018988376 6.037976752 0.000000000
px 1 0.065410627 0.065410627 0.130821254 0.000000000
py 1 0.065410627 0.065410627 0.130821254 0.000000000
pz 1 0.040391458 0.040391458 0.080782916 0.000000000
sum over m 0.171212712 0.171212712 0.342425423 0.000000000
sum over m+mul 3.190201088 3.190201088 6.380402176 0.000000000
d3z^2-r^2 0 0.196287122 0.196287122 0.392574244 0.000000000
dx^2-y^2 0 0.201527539 0.201527539 0.403055078 0.000000000
dxy 0 0.250904239 0.250904239 0.501808479 0.000000000
dxz 0 0.268518766 0.268518766 0.537037532 0.000000000
dyz 0 0.268518766 0.268518766 0.537037532 0.000000000
sum over m 1.185756433 1.185756433 2.371512866 0.000000000
d3z^2-r^2 1 0.003478853 0.003478853 0.006957706 0.000000000
dx^2-y^2 1 -0.004471089 -0.004471089 -0.008942179 0.000000000
dxy 1 0.015339360 0.015339360 0.030678719 0.000000000
dxz 1 0.003488242 0.003488242 0.006976485 0.000000000
dyz 1 0.003488242 0.003488242 0.006976485 0.000000000
sum over m 0.021323608 0.021323608 0.042647216 0.000000000
sum over m+mul 1.207080041 1.207080041 2.414160082 0.000000000
525 O Up spin Down spin Sum Diff
multiple
s 0 0.893844755 0.893844755 1.787689510 0.000000000
sum over m 0.893844755 0.893844755 1.787689510 0.000000000
s 1 -0.003042247 -0.003042247 -0.006084494 0.000000000
sum over m -0.003042247 -0.003042247 -0.006084494 0.000000000
sum over m+mul 0.890802508 0.890802508 1.781605016 0.000000000
px 0 0.786875351 0.786875351 1.573750701 0.000000000
py 0 0.786875351 0.786875351 1.573750701 0.000000000
pz 0 0.779893592 0.779893592 1.559787185 0.000000000
sum over m 2.353644294 2.353644294 4.707288587 0.000000000
px 1 -0.008733176 -0.008733176 -0.017466353 0.000000000
py 1 -0.008733176 -0.008733176 -0.017466353 0.000000000
pz 1 -0.006466755 -0.006466755 -0.012933509 0.000000000
sum over m -0.023933108 -0.023933108 -0.047866215 0.000000000
sum over m+mul 2.329711186 2.329711186 4.659422372 0.000000000
d3z^2-r^2 0 -0.006389262 -0.006389262 -0.012778524 0.000000000
dx^2-y^2 0 -0.005061423 -0.005061423 -0.010122847 0.000000000
dxy 0 -0.005431671 -0.005431671 -0.010863342 0.000000000
dxz 0 -0.006935209 -0.006935209 -0.013870418 0.000000000
dyz 0 -0.006935209 -0.006935209 -0.013870418 0.000000000
sum over m -0.030752774 -0.030752774 -0.061505548 0.000000000
sum over m+mul -0.030752774 -0.030752774 -0.061505548 0.000000000
526 O Up spin Down spin Sum Diff
multiple
s 0 0.893912763 0.893912763 1.787825525 0.000000000
sum over m 0.893912763 0.893912763 1.787825525 0.000000000
s 1 -0.003042849 -0.003042849 -0.006085698 0.000000000
sum over m -0.003042849 -0.003042849 -0.006085698 0.000000000
sum over m+mul 0.890869914 0.890869914 1.781739827 0.000000000
px 0 0.787030360 0.787030360 1.574060721 0.000000000
py 0 0.787030360 0.787030360 1.574060720 0.000000000
pz 0 0.779715762 0.779715762 1.559431524 0.000000000
sum over m 2.353776483 2.353776483 4.707552966 0.000000000
px 1 -0.008738709 -0.008738709 -0.017477417 0.000000000
py 1 -0.008738709 -0.008738709 -0.017477417 0.000000000
pz 1 -0.006459031 -0.006459031 -0.012918061 0.000000000
sum over m -0.023936448 -0.023936448 -0.047872895 0.000000000
sum over m+mul 2.329840035 2.329840035 4.659680070 0.000000000
d3z^2-r^2 0 -0.006390607 -0.006390607 -0.012781214 0.000000000
dx^2-y^2 0 -0.005054867 -0.005054867 -0.010109734 0.000000000
dxy 0 -0.005435887 -0.005435887 -0.010871774 0.000000000
dxz 0 -0.006927842 -0.006927842 -0.013855685 0.000000000
dyz 0 -0.006927842 -0.006927842 -0.013855685 0.000000000
sum over m -0.030737045 -0.030737045 -0.061474091 0.000000000
sum over m+mul -0.030737045 -0.030737045 -0.061474091 0.000000000
527 O Up spin Down spin Sum Diff
multiple
s 0 0.893911080 0.893911080 1.787822159 0.000000000
sum over m 0.893911080 0.893911080 1.787822159 0.000000000
s 1 -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m+mul 0.890868718 0.890868718 1.781737435 0.000000000
px 0 0.786877548 0.786877548 1.573755096 0.000000000
py 0 0.787128937 0.787128937 1.574257875 0.000000000
pz 0 0.779760124 0.779760124 1.559520248 0.000000000
sum over m 2.353766609 2.353766609 4.707533219 0.000000000
px 1 -0.008737351 -0.008737351 -0.017474701 0.000000000
py 1 -0.008746473 -0.008746473 -0.017492946 0.000000000
pz 1 -0.006461545 -0.006461545 -0.012923089 0.000000000
sum over m -0.023945368 -0.023945368 -0.047890736 0.000000000
sum over m+mul 2.329821241 2.329821241 4.659642482 0.000000000
d3z^2-r^2 0 -0.006390862 -0.006390862 -0.012781724 0.000000000
dx^2-y^2 0 -0.005057552 -0.005057552 -0.010115104 0.000000000
dxy 0 -0.005435549 -0.005435549 -0.010871099 0.000000000
dxz 0 -0.006932912 -0.006932912 -0.013865825 0.000000000
dyz 0 -0.006926386 -0.006926386 -0.013852773 0.000000000
sum over m -0.030743262 -0.030743262 -0.061486525 0.000000000
sum over m+mul -0.030743262 -0.030743262 -0.061486525 0.000000000
528 O Up spin Down spin Sum Diff
multiple
s 0 0.893911080 0.893911080 1.787822159 0.000000000
sum over m 0.893911080 0.893911080 1.787822159 0.000000000
s 1 -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m+mul 0.890868718 0.890868718 1.781737435 0.000000000
px 0 0.787128938 0.787128938 1.574257875 0.000000000
py 0 0.786877548 0.786877548 1.573755097 0.000000000
pz 0 0.779760124 0.779760124 1.559520247 0.000000000
sum over m 2.353766610 2.353766610 4.707533219 0.000000000
px 1 -0.008746473 -0.008746473 -0.017492946 0.000000000
py 1 -0.008737351 -0.008737351 -0.017474701 0.000000000
pz 1 -0.006461545 -0.006461545 -0.012923090 0.000000000
sum over m -0.023945368 -0.023945368 -0.047890736 0.000000000
sum over m+mul 2.329821241 2.329821241 4.659642483 0.000000000
d3z^2-r^2 0 -0.006390862 -0.006390862 -0.012781724 0.000000000
dx^2-y^2 0 -0.005057552 -0.005057552 -0.010115104 0.000000000
dxy 0 -0.005435549 -0.005435549 -0.010871099 0.000000000
dxz 0 -0.006926386 -0.006926386 -0.013852773 0.000000000
dyz 0 -0.006932912 -0.006932912 -0.013865825 0.000000000
sum over m -0.030743262 -0.030743262 -0.061486525 0.000000000
sum over m+mul -0.030743262 -0.030743262 -0.061486525 0.000000000
529 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000771124 1.000771124 2.001542247 0.000000000
sum over m 1.000771124 1.000771124 2.001542247 0.000000000
s 1 0.207404835 0.207404835 0.414809670 0.000000000
sum over m 0.207404835 0.207404835 0.414809670 0.000000000
s 2 0.014723645 0.014723645 0.029447291 0.000000000
sum over m 0.014723645 0.014723645 0.029447291 0.000000000
sum over m+mul 1.222899604 1.222899604 2.445799208 0.000000000
px 0 1.006375680 1.006375680 2.012751359 0.000000000
py 0 1.006375680 1.006375680 2.012751360 0.000000000
pz 0 1.006201031 1.006201031 2.012402063 0.000000000
sum over m 3.018952391 3.018952391 6.037904782 0.000000000
px 1 0.065432025 0.065432025 0.130864050 0.000000000
py 1 0.065432025 0.065432025 0.130864050 0.000000000
pz 1 0.040373519 0.040373519 0.080747037 0.000000000
sum over m 0.171237569 0.171237569 0.342475137 0.000000000
sum over m+mul 3.190189960 3.190189960 6.380379919 0.000000000
d3z^2-r^2 0 0.196325657 0.196325657 0.392651313 0.000000000
dx^2-y^2 0 0.201528394 0.201528394 0.403056787 0.000000000
dxy 0 0.250938521 0.250938521 0.501877041 0.000000000
dxz 0 0.268491876 0.268491876 0.536983753 0.000000000
dyz 0 0.268491876 0.268491876 0.536983753 0.000000000
sum over m 1.185776324 1.185776324 2.371552648 0.000000000
d3z^2-r^2 1 0.003475853 0.003475853 0.006951707 0.000000000
dx^2-y^2 1 -0.004477967 -0.004477967 -0.008955935 0.000000000
dxy 1 0.015344177 0.015344177 0.030688354 0.000000000
dxz 1 0.003496792 0.003496792 0.006993583 0.000000000
dyz 1 0.003496792 0.003496792 0.006993583 0.000000000
sum over m 0.021335647 0.021335647 0.042671293 0.000000000
sum over m+mul 1.207111970 1.207111970 2.414223941 0.000000000
530 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000745930 1.000745930 2.001491860 0.000000000
sum over m 1.000745930 1.000745930 2.001491860 0.000000000
s 1 0.207418648 0.207418648 0.414837295 0.000000000
sum over m 0.207418648 0.207418648 0.414837295 0.000000000
s 2 0.014725569 0.014725569 0.029451137 0.000000000
sum over m 0.014725569 0.014725569 0.029451137 0.000000000
sum over m+mul 1.222890146 1.222890146 2.445780293 0.000000000
px 0 1.006388133 1.006388133 2.012776265 0.000000000
py 0 1.006388133 1.006388133 2.012776265 0.000000000
pz 0 1.006212111 1.006212111 2.012424222 0.000000000
sum over m 3.018988376 3.018988376 6.037976752 0.000000000
px 1 0.065410627 0.065410627 0.130821254 0.000000000
py 1 0.065410627 0.065410627 0.130821254 0.000000000
pz 1 0.040391458 0.040391458 0.080782916 0.000000000
sum over m 0.171212712 0.171212712 0.342425424 0.000000000
sum over m+mul 3.190201088 3.190201088 6.380402176 0.000000000
d3z^2-r^2 0 0.196287122 0.196287122 0.392574244 0.000000000
dx^2-y^2 0 0.201527539 0.201527539 0.403055079 0.000000000
dxy 0 0.250904239 0.250904239 0.501808479 0.000000000
dxz 0 0.268518766 0.268518766 0.537037532 0.000000000
dyz 0 0.268518766 0.268518766 0.537037532 0.000000000
sum over m 1.185756433 1.185756433 2.371512866 0.000000000
d3z^2-r^2 1 0.003478853 0.003478853 0.006957706 0.000000000
dx^2-y^2 1 -0.004471089 -0.004471089 -0.008942179 0.000000000
dxy 1 0.015339360 0.015339360 0.030678719 0.000000000
dxz 1 0.003488242 0.003488242 0.006976485 0.000000000
dyz 1 0.003488242 0.003488242 0.006976485 0.000000000
sum over m 0.021323608 0.021323608 0.042647216 0.000000000
sum over m+mul 1.207080041 1.207080041 2.414160082 0.000000000
531 O Up spin Down spin Sum Diff
multiple
s 0 0.893844755 0.893844755 1.787689510 0.000000000
sum over m 0.893844755 0.893844755 1.787689510 0.000000000
s 1 -0.003042247 -0.003042247 -0.006084494 0.000000000
sum over m -0.003042247 -0.003042247 -0.006084494 0.000000000
sum over m+mul 0.890802508 0.890802508 1.781605016 0.000000000
px 0 0.786875350 0.786875350 1.573750701 0.000000000
py 0 0.786875351 0.786875351 1.573750702 0.000000000
pz 0 0.779893593 0.779893593 1.559787185 0.000000000
sum over m 2.353644294 2.353644294 4.707288588 0.000000000
px 1 -0.008733176 -0.008733176 -0.017466353 0.000000000
py 1 -0.008733176 -0.008733176 -0.017466353 0.000000000
pz 1 -0.006466755 -0.006466755 -0.012933509 0.000000000
sum over m -0.023933108 -0.023933108 -0.047866215 0.000000000
sum over m+mul 2.329711186 2.329711186 4.659422372 0.000000000
d3z^2-r^2 0 -0.006389262 -0.006389262 -0.012778524 0.000000000
dx^2-y^2 0 -0.005061423 -0.005061423 -0.010122847 0.000000000
dxy 0 -0.005431671 -0.005431671 -0.010863342 0.000000000
dxz 0 -0.006935209 -0.006935209 -0.013870418 0.000000000
dyz 0 -0.006935209 -0.006935209 -0.013870418 0.000000000
sum over m -0.030752774 -0.030752774 -0.061505549 0.000000000
sum over m+mul -0.030752774 -0.030752774 -0.061505549 0.000000000
532 O Up spin Down spin Sum Diff
multiple
s 0 0.893912763 0.893912763 1.787825526 0.000000000
sum over m 0.893912763 0.893912763 1.787825526 0.000000000
s 1 -0.003042849 -0.003042849 -0.006085698 0.000000000
sum over m -0.003042849 -0.003042849 -0.006085698 0.000000000
sum over m+mul 0.890869914 0.890869914 1.781739827 0.000000000
px 0 0.787030360 0.787030360 1.574060721 0.000000000
py 0 0.787030360 0.787030360 1.574060721 0.000000000
pz 0 0.779715762 0.779715762 1.559431524 0.000000000
sum over m 2.353776483 2.353776483 4.707552966 0.000000000
px 1 -0.008738709 -0.008738709 -0.017477417 0.000000000
py 1 -0.008738709 -0.008738709 -0.017477417 0.000000000
pz 1 -0.006459030 -0.006459030 -0.012918061 0.000000000
sum over m -0.023936448 -0.023936448 -0.047872895 0.000000000
sum over m+mul 2.329840035 2.329840035 4.659680070 0.000000000
d3z^2-r^2 0 -0.006390607 -0.006390607 -0.012781214 0.000000000
dx^2-y^2 0 -0.005054867 -0.005054867 -0.010109734 0.000000000
dxy 0 -0.005435887 -0.005435887 -0.010871774 0.000000000
dxz 0 -0.006927842 -0.006927842 -0.013855685 0.000000000
dyz 0 -0.006927842 -0.006927842 -0.013855685 0.000000000
sum over m -0.030737045 -0.030737045 -0.061474091 0.000000000
sum over m+mul -0.030737045 -0.030737045 -0.061474091 0.000000000
533 O Up spin Down spin Sum Diff
multiple
s 0 0.893911080 0.893911080 1.787822159 0.000000000
sum over m 0.893911080 0.893911080 1.787822159 0.000000000
s 1 -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m+mul 0.890868718 0.890868718 1.781737435 0.000000000
px 0 0.786877548 0.786877548 1.573755096 0.000000000
py 0 0.787128937 0.787128937 1.574257875 0.000000000
pz 0 0.779760124 0.779760124 1.559520248 0.000000000
sum over m 2.353766609 2.353766609 4.707533219 0.000000000
px 1 -0.008737351 -0.008737351 -0.017474701 0.000000000
py 1 -0.008746473 -0.008746473 -0.017492946 0.000000000
pz 1 -0.006461545 -0.006461545 -0.012923089 0.000000000
sum over m -0.023945368 -0.023945368 -0.047890736 0.000000000
sum over m+mul 2.329821241 2.329821241 4.659642482 0.000000000
d3z^2-r^2 0 -0.006390862 -0.006390862 -0.012781724 0.000000000
dx^2-y^2 0 -0.005057552 -0.005057552 -0.010115104 0.000000000
dxy 0 -0.005435549 -0.005435549 -0.010871099 0.000000000
dxz 0 -0.006932912 -0.006932912 -0.013865825 0.000000000
dyz 0 -0.006926386 -0.006926386 -0.013852773 0.000000000
sum over m -0.030743262 -0.030743262 -0.061486525 0.000000000
sum over m+mul -0.030743262 -0.030743262 -0.061486525 0.000000000
534 O Up spin Down spin Sum Diff
multiple
s 0 0.893911079 0.893911079 1.787822159 0.000000000
sum over m 0.893911079 0.893911079 1.787822159 0.000000000
s 1 -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m+mul 0.890868718 0.890868718 1.781737435 0.000000000
px 0 0.787128938 0.787128938 1.574257875 0.000000000
py 0 0.786877548 0.786877548 1.573755096 0.000000000
pz 0 0.779760124 0.779760124 1.559520248 0.000000000
sum over m 2.353766610 2.353766610 4.707533219 0.000000000
px 1 -0.008746473 -0.008746473 -0.017492945 0.000000000
py 1 -0.008737351 -0.008737351 -0.017474701 0.000000000
pz 1 -0.006461545 -0.006461545 -0.012923090 0.000000000
sum over m -0.023945368 -0.023945368 -0.047890736 0.000000000
sum over m+mul 2.329821242 2.329821242 4.659642483 0.000000000
d3z^2-r^2 0 -0.006390862 -0.006390862 -0.012781724 0.000000000
dx^2-y^2 0 -0.005057552 -0.005057552 -0.010115104 0.000000000
dxy 0 -0.005435549 -0.005435549 -0.010871099 0.000000000
dxz 0 -0.006926386 -0.006926386 -0.013852773 0.000000000
dyz 0 -0.006932912 -0.006932912 -0.013865825 0.000000000
sum over m -0.030743262 -0.030743262 -0.061486525 0.000000000
sum over m+mul -0.030743262 -0.030743262 -0.061486525 0.000000000
535 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000771124 1.000771124 2.001542247 0.000000000
sum over m 1.000771124 1.000771124 2.001542247 0.000000000
s 1 0.207404835 0.207404835 0.414809670 0.000000000
sum over m 0.207404835 0.207404835 0.414809670 0.000000000
s 2 0.014723645 0.014723645 0.029447291 0.000000000
sum over m 0.014723645 0.014723645 0.029447291 0.000000000
sum over m+mul 1.222899604 1.222899604 2.445799209 0.000000000
px 0 1.006375680 1.006375680 2.012751359 0.000000000
py 0 1.006375680 1.006375680 2.012751360 0.000000000
pz 0 1.006201032 1.006201032 2.012402063 0.000000000
sum over m 3.018952391 3.018952391 6.037904782 0.000000000
px 1 0.065432025 0.065432025 0.130864050 0.000000000
py 1 0.065432025 0.065432025 0.130864050 0.000000000
pz 1 0.040373518 0.040373518 0.080747037 0.000000000
sum over m 0.171237568 0.171237568 0.342475137 0.000000000
sum over m+mul 3.190189960 3.190189960 6.380379919 0.000000000
d3z^2-r^2 0 0.196325657 0.196325657 0.392651313 0.000000000
dx^2-y^2 0 0.201528394 0.201528394 0.403056788 0.000000000
dxy 0 0.250938521 0.250938521 0.501877041 0.000000000
dxz 0 0.268491876 0.268491876 0.536983753 0.000000000
dyz 0 0.268491876 0.268491876 0.536983753 0.000000000
sum over m 1.185776324 1.185776324 2.371552648 0.000000000
d3z^2-r^2 1 0.003475853 0.003475853 0.006951707 0.000000000
dx^2-y^2 1 -0.004477967 -0.004477967 -0.008955935 0.000000000
dxy 1 0.015344177 0.015344177 0.030688354 0.000000000
dxz 1 0.003496792 0.003496792 0.006993583 0.000000000
dyz 1 0.003496792 0.003496792 0.006993583 0.000000000
sum over m 0.021335646 0.021335646 0.042671293 0.000000000
sum over m+mul 1.207111970 1.207111970 2.414223941 0.000000000
536 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000745930 1.000745930 2.001491861 0.000000000
sum over m 1.000745930 1.000745930 2.001491861 0.000000000
s 1 0.207418648 0.207418648 0.414837295 0.000000000
sum over m 0.207418648 0.207418648 0.414837295 0.000000000
s 2 0.014725569 0.014725569 0.029451137 0.000000000
sum over m 0.014725569 0.014725569 0.029451137 0.000000000
sum over m+mul 1.222890147 1.222890147 2.445780293 0.000000000
px 0 1.006388133 1.006388133 2.012776265 0.000000000
py 0 1.006388133 1.006388133 2.012776265 0.000000000
pz 0 1.006212111 1.006212111 2.012424222 0.000000000
sum over m 3.018988376 3.018988376 6.037976752 0.000000000
px 1 0.065410627 0.065410627 0.130821254 0.000000000
py 1 0.065410627 0.065410627 0.130821254 0.000000000
pz 1 0.040391458 0.040391458 0.080782916 0.000000000
sum over m 0.171212712 0.171212712 0.342425424 0.000000000
sum over m+mul 3.190201088 3.190201088 6.380402176 0.000000000
d3z^2-r^2 0 0.196287122 0.196287122 0.392574244 0.000000000
dx^2-y^2 0 0.201527539 0.201527539 0.403055078 0.000000000
dxy 0 0.250904239 0.250904239 0.501808479 0.000000000
dxz 0 0.268518766 0.268518766 0.537037532 0.000000000
dyz 0 0.268518766 0.268518766 0.537037532 0.000000000
sum over m 1.185756432 1.185756432 2.371512865 0.000000000
d3z^2-r^2 1 0.003478853 0.003478853 0.006957706 0.000000000
dx^2-y^2 1 -0.004471089 -0.004471089 -0.008942179 0.000000000
dxy 1 0.015339360 0.015339360 0.030678719 0.000000000
dxz 1 0.003488242 0.003488242 0.006976485 0.000000000
dyz 1 0.003488242 0.003488242 0.006976485 0.000000000
sum over m 0.021323608 0.021323608 0.042647216 0.000000000
sum over m+mul 1.207080041 1.207080041 2.414160081 0.000000000
537 O Up spin Down spin Sum Diff
multiple
s 0 0.893844755 0.893844755 1.787689510 0.000000000
sum over m 0.893844755 0.893844755 1.787689510 0.000000000
s 1 -0.003042247 -0.003042247 -0.006084494 0.000000000
sum over m -0.003042247 -0.003042247 -0.006084494 0.000000000
sum over m+mul 0.890802508 0.890802508 1.781605016 0.000000000
px 0 0.786875351 0.786875351 1.573750701 0.000000000
py 0 0.786875351 0.786875351 1.573750701 0.000000000
pz 0 0.779893593 0.779893593 1.559787185 0.000000000
sum over m 2.353644294 2.353644294 4.707288588 0.000000000
px 1 -0.008733176 -0.008733176 -0.017466353 0.000000000
py 1 -0.008733176 -0.008733176 -0.017466353 0.000000000
pz 1 -0.006466755 -0.006466755 -0.012933510 0.000000000
sum over m -0.023933108 -0.023933108 -0.047866215 0.000000000
sum over m+mul 2.329711186 2.329711186 4.659422373 0.000000000
d3z^2-r^2 0 -0.006389262 -0.006389262 -0.012778524 0.000000000
dx^2-y^2 0 -0.005061423 -0.005061423 -0.010122847 0.000000000
dxy 0 -0.005431671 -0.005431671 -0.010863342 0.000000000
dxz 0 -0.006935209 -0.006935209 -0.013870418 0.000000000
dyz 0 -0.006935209 -0.006935209 -0.013870418 0.000000000
sum over m -0.030752774 -0.030752774 -0.061505548 0.000000000
sum over m+mul -0.030752774 -0.030752774 -0.061505548 0.000000000
538 O Up spin Down spin Sum Diff
multiple
s 0 0.893912763 0.893912763 1.787825526 0.000000000
sum over m 0.893912763 0.893912763 1.787825526 0.000000000
s 1 -0.003042849 -0.003042849 -0.006085698 0.000000000
sum over m -0.003042849 -0.003042849 -0.006085698 0.000000000
sum over m+mul 0.890869914 0.890869914 1.781739827 0.000000000
px 0 0.787030361 0.787030361 1.574060721 0.000000000
py 0 0.787030360 0.787030360 1.574060721 0.000000000
pz 0 0.779715762 0.779715762 1.559431524 0.000000000
sum over m 2.353776483 2.353776483 4.707552966 0.000000000
px 1 -0.008738709 -0.008738709 -0.017477417 0.000000000
py 1 -0.008738709 -0.008738709 -0.017477417 0.000000000
pz 1 -0.006459030 -0.006459030 -0.012918061 0.000000000
sum over m -0.023936448 -0.023936448 -0.047872895 0.000000000
sum over m+mul 2.329840035 2.329840035 4.659680071 0.000000000
d3z^2-r^2 0 -0.006390607 -0.006390607 -0.012781214 0.000000000
dx^2-y^2 0 -0.005054867 -0.005054867 -0.010109734 0.000000000
dxy 0 -0.005435887 -0.005435887 -0.010871774 0.000000000
dxz 0 -0.006927842 -0.006927842 -0.013855685 0.000000000
dyz 0 -0.006927842 -0.006927842 -0.013855685 0.000000000
sum over m -0.030737045 -0.030737045 -0.061474091 0.000000000
sum over m+mul -0.030737045 -0.030737045 -0.061474091 0.000000000
539 O Up spin Down spin Sum Diff
multiple
s 0 0.893911080 0.893911080 1.787822159 0.000000000
sum over m 0.893911080 0.893911080 1.787822159 0.000000000
s 1 -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m+mul 0.890868718 0.890868718 1.781737435 0.000000000
px 0 0.786877548 0.786877548 1.573755096 0.000000000
py 0 0.787128937 0.787128937 1.574257875 0.000000000
pz 0 0.779760124 0.779760124 1.559520248 0.000000000
sum over m 2.353766609 2.353766609 4.707533219 0.000000000
px 1 -0.008737351 -0.008737351 -0.017474701 0.000000000
py 1 -0.008746473 -0.008746473 -0.017492946 0.000000000
pz 1 -0.006461545 -0.006461545 -0.012923089 0.000000000
sum over m -0.023945368 -0.023945368 -0.047890736 0.000000000
sum over m+mul 2.329821241 2.329821241 4.659642482 0.000000000
d3z^2-r^2 0 -0.006390862 -0.006390862 -0.012781724 0.000000000
dx^2-y^2 0 -0.005057552 -0.005057552 -0.010115104 0.000000000
dxy 0 -0.005435549 -0.005435549 -0.010871099 0.000000000
dxz 0 -0.006932912 -0.006932912 -0.013865825 0.000000000
dyz 0 -0.006926386 -0.006926386 -0.013852773 0.000000000
sum over m -0.030743262 -0.030743262 -0.061486525 0.000000000
sum over m+mul -0.030743262 -0.030743262 -0.061486525 0.000000000
540 O Up spin Down spin Sum Diff
multiple
s 0 0.893911080 0.893911080 1.787822159 0.000000000
sum over m 0.893911080 0.893911080 1.787822159 0.000000000
s 1 -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m+mul 0.890868718 0.890868718 1.781737435 0.000000000
px 0 0.787128937 0.787128937 1.574257875 0.000000000
py 0 0.786877548 0.786877548 1.573755096 0.000000000
pz 0 0.779760124 0.779760124 1.559520248 0.000000000
sum over m 2.353766609 2.353766609 4.707533219 0.000000000
px 1 -0.008746473 -0.008746473 -0.017492946 0.000000000
py 1 -0.008737351 -0.008737351 -0.017474701 0.000000000
pz 1 -0.006461545 -0.006461545 -0.012923090 0.000000000
sum over m -0.023945368 -0.023945368 -0.047890737 0.000000000
sum over m+mul 2.329821241 2.329821241 4.659642482 0.000000000
d3z^2-r^2 0 -0.006390862 -0.006390862 -0.012781724 0.000000000
dx^2-y^2 0 -0.005057552 -0.005057552 -0.010115104 0.000000000
dxy 0 -0.005435549 -0.005435549 -0.010871099 0.000000000
dxz 0 -0.006926386 -0.006926386 -0.013852773 0.000000000
dyz 0 -0.006932912 -0.006932912 -0.013865825 0.000000000
sum over m -0.030743262 -0.030743262 -0.061486525 0.000000000
sum over m+mul -0.030743262 -0.030743262 -0.061486525 0.000000000
541 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000771124 1.000771124 2.001542247 0.000000000
sum over m 1.000771124 1.000771124 2.001542247 0.000000000
s 1 0.207404835 0.207404835 0.414809670 0.000000000
sum over m 0.207404835 0.207404835 0.414809670 0.000000000
s 2 0.014723645 0.014723645 0.029447291 0.000000000
sum over m 0.014723645 0.014723645 0.029447291 0.000000000
sum over m+mul 1.222899604 1.222899604 2.445799208 0.000000000
px 0 1.006375680 1.006375680 2.012751360 0.000000000
py 0 1.006375680 1.006375680 2.012751360 0.000000000
pz 0 1.006201032 1.006201032 2.012402063 0.000000000
sum over m 3.018952391 3.018952391 6.037904783 0.000000000
px 1 0.065432025 0.065432025 0.130864050 0.000000000
py 1 0.065432025 0.065432025 0.130864050 0.000000000
pz 1 0.040373518 0.040373518 0.080747036 0.000000000
sum over m 0.171237568 0.171237568 0.342475136 0.000000000
sum over m+mul 3.190189960 3.190189960 6.380379919 0.000000000
d3z^2-r^2 0 0.196325656 0.196325656 0.392651313 0.000000000
dx^2-y^2 0 0.201528394 0.201528394 0.403056788 0.000000000
dxy 0 0.250938521 0.250938521 0.501877041 0.000000000
dxz 0 0.268491876 0.268491876 0.536983753 0.000000000
dyz 0 0.268491876 0.268491876 0.536983753 0.000000000
sum over m 1.185776324 1.185776324 2.371552647 0.000000000
d3z^2-r^2 1 0.003475853 0.003475853 0.006951707 0.000000000
dx^2-y^2 1 -0.004477967 -0.004477967 -0.008955935 0.000000000
dxy 1 0.015344177 0.015344177 0.030688354 0.000000000
dxz 1 0.003496792 0.003496792 0.006993583 0.000000000
dyz 1 0.003496792 0.003496792 0.006993583 0.000000000
sum over m 0.021335647 0.021335647 0.042671293 0.000000000
sum over m+mul 1.207111970 1.207111970 2.414223941 0.000000000
542 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000745930 1.000745930 2.001491860 0.000000000
sum over m 1.000745930 1.000745930 2.001491860 0.000000000
s 1 0.207418648 0.207418648 0.414837295 0.000000000
sum over m 0.207418648 0.207418648 0.414837295 0.000000000
s 2 0.014725569 0.014725569 0.029451137 0.000000000
sum over m 0.014725569 0.014725569 0.029451137 0.000000000
sum over m+mul 1.222890146 1.222890146 2.445780293 0.000000000
px 0 1.006388133 1.006388133 2.012776265 0.000000000
py 0 1.006388133 1.006388133 2.012776265 0.000000000
pz 0 1.006212111 1.006212111 2.012424222 0.000000000
sum over m 3.018988376 3.018988376 6.037976753 0.000000000
px 1 0.065410627 0.065410627 0.130821254 0.000000000
py 1 0.065410627 0.065410627 0.130821254 0.000000000
pz 1 0.040391458 0.040391458 0.080782915 0.000000000
sum over m 0.171212712 0.171212712 0.342425424 0.000000000
sum over m+mul 3.190201088 3.190201088 6.380402176 0.000000000
d3z^2-r^2 0 0.196287122 0.196287122 0.392574244 0.000000000
dx^2-y^2 0 0.201527539 0.201527539 0.403055079 0.000000000
dxy 0 0.250904239 0.250904239 0.501808479 0.000000000
dxz 0 0.268518766 0.268518766 0.537037532 0.000000000
dyz 0 0.268518766 0.268518766 0.537037532 0.000000000
sum over m 1.185756432 1.185756432 2.371512865 0.000000000
d3z^2-r^2 1 0.003478853 0.003478853 0.006957706 0.000000000
dx^2-y^2 1 -0.004471089 -0.004471089 -0.008942179 0.000000000
dxy 1 0.015339360 0.015339360 0.030678719 0.000000000
dxz 1 0.003488242 0.003488242 0.006976485 0.000000000
dyz 1 0.003488242 0.003488242 0.006976485 0.000000000
sum over m 0.021323608 0.021323608 0.042647216 0.000000000
sum over m+mul 1.207080040 1.207080040 2.414160081 0.000000000
543 O Up spin Down spin Sum Diff
multiple
s 0 0.893844755 0.893844755 1.787689510 0.000000000
sum over m 0.893844755 0.893844755 1.787689510 0.000000000
s 1 -0.003042247 -0.003042247 -0.006084494 0.000000000
sum over m -0.003042247 -0.003042247 -0.006084494 0.000000000
sum over m+mul 0.890802508 0.890802508 1.781605016 0.000000000
px 0 0.786875351 0.786875351 1.573750702 0.000000000
py 0 0.786875351 0.786875351 1.573750702 0.000000000
pz 0 0.779893593 0.779893593 1.559787185 0.000000000
sum over m 2.353644294 2.353644294 4.707288589 0.000000000
px 1 -0.008733176 -0.008733176 -0.017466353 0.000000000
py 1 -0.008733176 -0.008733176 -0.017466353 0.000000000
pz 1 -0.006466755 -0.006466755 -0.012933509 0.000000000
sum over m -0.023933108 -0.023933108 -0.047866215 0.000000000
sum over m+mul 2.329711187 2.329711187 4.659422373 0.000000000
d3z^2-r^2 0 -0.006389262 -0.006389262 -0.012778524 0.000000000
dx^2-y^2 0 -0.005061423 -0.005061423 -0.010122847 0.000000000
dxy 0 -0.005431671 -0.005431671 -0.010863342 0.000000000
dxz 0 -0.006935209 -0.006935209 -0.013870418 0.000000000
dyz 0 -0.006935209 -0.006935209 -0.013870418 0.000000000
sum over m -0.030752774 -0.030752774 -0.061505548 0.000000000
sum over m+mul -0.030752774 -0.030752774 -0.061505548 0.000000000
544 O Up spin Down spin Sum Diff
multiple
s 0 0.893912763 0.893912763 1.787825526 0.000000000
sum over m 0.893912763 0.893912763 1.787825526 0.000000000
s 1 -0.003042849 -0.003042849 -0.006085698 0.000000000
sum over m -0.003042849 -0.003042849 -0.006085698 0.000000000
sum over m+mul 0.890869914 0.890869914 1.781739827 0.000000000
px 0 0.787030361 0.787030361 1.574060721 0.000000000
py 0 0.787030361 0.787030361 1.574060721 0.000000000
pz 0 0.779715762 0.779715762 1.559431524 0.000000000
sum over m 2.353776483 2.353776483 4.707552967 0.000000000
px 1 -0.008738709 -0.008738709 -0.017477417 0.000000000
py 1 -0.008738709 -0.008738709 -0.017477417 0.000000000
pz 1 -0.006459030 -0.006459030 -0.012918061 0.000000000
sum over m -0.023936448 -0.023936448 -0.047872895 0.000000000
sum over m+mul 2.329840036 2.329840036 4.659680072 0.000000000
d3z^2-r^2 0 -0.006390607 -0.006390607 -0.012781214 0.000000000
dx^2-y^2 0 -0.005054867 -0.005054867 -0.010109734 0.000000000
dxy 0 -0.005435887 -0.005435887 -0.010871774 0.000000000
dxz 0 -0.006927842 -0.006927842 -0.013855685 0.000000000
dyz 0 -0.006927842 -0.006927842 -0.013855685 0.000000000
sum over m -0.030737045 -0.030737045 -0.061474091 0.000000000
sum over m+mul -0.030737045 -0.030737045 -0.061474091 0.000000000
545 O Up spin Down spin Sum Diff
multiple
s 0 0.893911080 0.893911080 1.787822159 0.000000000
sum over m 0.893911080 0.893911080 1.787822159 0.000000000
s 1 -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m+mul 0.890868718 0.890868718 1.781737435 0.000000000
px 0 0.786877548 0.786877548 1.573755096 0.000000000
py 0 0.787128937 0.787128937 1.574257875 0.000000000
pz 0 0.779760124 0.779760124 1.559520248 0.000000000
sum over m 2.353766609 2.353766609 4.707533219 0.000000000
px 1 -0.008737351 -0.008737351 -0.017474701 0.000000000
py 1 -0.008746473 -0.008746473 -0.017492946 0.000000000
pz 1 -0.006461545 -0.006461545 -0.012923089 0.000000000
sum over m -0.023945368 -0.023945368 -0.047890736 0.000000000
sum over m+mul 2.329821241 2.329821241 4.659642483 0.000000000
d3z^2-r^2 0 -0.006390862 -0.006390862 -0.012781724 0.000000000
dx^2-y^2 0 -0.005057552 -0.005057552 -0.010115104 0.000000000
dxy 0 -0.005435549 -0.005435549 -0.010871099 0.000000000
dxz 0 -0.006932912 -0.006932912 -0.013865825 0.000000000
dyz 0 -0.006926386 -0.006926386 -0.013852773 0.000000000
sum over m -0.030743262 -0.030743262 -0.061486525 0.000000000
sum over m+mul -0.030743262 -0.030743262 -0.061486525 0.000000000
546 O Up spin Down spin Sum Diff
multiple
s 0 0.893911080 0.893911080 1.787822159 0.000000000
sum over m 0.893911080 0.893911080 1.787822159 0.000000000
s 1 -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m -0.003042362 -0.003042362 -0.006084724 0.000000000
sum over m+mul 0.890868718 0.890868718 1.781737435 0.000000000
px 0 0.787128938 0.787128938 1.574257875 0.000000000
py 0 0.786877548 0.786877548 1.573755096 0.000000000
pz 0 0.779760124 0.779760124 1.559520248 0.000000000
sum over m 2.353766610 2.353766610 4.707533219 0.000000000
px 1 -0.008746473 -0.008746473 -0.017492946 0.000000000
py 1 -0.008737351 -0.008737351 -0.017474701 0.000000000
pz 1 -0.006461545 -0.006461545 -0.012923090 0.000000000
sum over m -0.023945368 -0.023945368 -0.047890737 0.000000000
sum over m+mul 2.329821241 2.329821241 4.659642483 0.000000000
d3z^2-r^2 0 -0.006390862 -0.006390862 -0.012781724 0.000000000
dx^2-y^2 0 -0.005057552 -0.005057552 -0.010115104 0.000000000
dxy 0 -0.005435549 -0.005435549 -0.010871099 0.000000000
dxz 0 -0.006926386 -0.006926386 -0.013852773 0.000000000
dyz 0 -0.006932912 -0.006932912 -0.013865825 0.000000000
sum over m -0.030743262 -0.030743262 -0.061486525 0.000000000
sum over m+mul -0.030743262 -0.030743262 -0.061486525 0.000000000
547 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758580 1.000758580 2.001517159 0.000000000
sum over m 1.000758580 1.000758580 2.001517159 0.000000000
s 1 0.207412087 0.207412087 0.414824173 0.000000000
sum over m 0.207412087 0.207412087 0.414824173 0.000000000
s 2 0.014726635 0.014726635 0.029453269 0.000000000
sum over m 0.014726635 0.014726635 0.029453269 0.000000000
sum over m+mul 1.222897301 1.222897301 2.445794602 0.000000000
px 0 1.006373430 1.006373430 2.012746861 0.000000000
py 0 1.006367276 1.006367276 2.012734551 0.000000000
pz 0 1.006214903 1.006214903 2.012429807 0.000000000
sum over m 3.018955609 3.018955609 6.037911219 0.000000000
px 1 0.065442149 0.065442149 0.130884299 0.000000000
py 1 0.065432003 0.065432003 0.130864006 0.000000000
pz 1 0.040381942 0.040381942 0.080763885 0.000000000
sum over m 0.171256095 0.171256095 0.342512190 0.000000000
sum over m+mul 3.190211704 3.190211704 6.380423409 0.000000000
d3z^2-r^2 0 0.196307095 0.196307095 0.392614189 0.000000000
dx^2-y^2 0 0.201519175 0.201519175 0.403038351 0.000000000
dxy 0 0.250925910 0.250925910 0.501851820 0.000000000
dxz 0 0.268500223 0.268500223 0.537000446 0.000000000
dyz 0 0.268516582 0.268516582 0.537033165 0.000000000
sum over m 1.185768985 1.185768985 2.371537971 0.000000000
d3z^2-r^2 1 0.003480294 0.003480294 0.006960588 0.000000000
dx^2-y^2 1 -0.004472707 -0.004472707 -0.008945415 0.000000000
dxy 1 0.015341260 0.015341260 0.030682519 0.000000000
dxz 1 0.003493777 0.003493777 0.006987555 0.000000000
dyz 1 0.003494934 0.003494934 0.006989868 0.000000000
sum over m 0.021337558 0.021337558 0.042675116 0.000000000
sum over m+mul 1.207106543 1.207106543 2.414213086 0.000000000
548 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742726 1.000742726 2.001485451 0.000000000
sum over m 1.000742726 1.000742726 2.001485451 0.000000000
s 1 0.207416785 0.207416785 0.414833569 0.000000000
sum over m 0.207416785 0.207416785 0.414833569 0.000000000
s 2 0.014727186 0.014727186 0.029454373 0.000000000
sum over m 0.014727186 0.014727186 0.029454373 0.000000000
sum over m+mul 1.222886697 1.222886697 2.445773393 0.000000000
px 0 1.006382080 1.006382080 2.012764160 0.000000000
py 0 1.006376184 1.006376184 2.012752368 0.000000000
pz 0 1.006198775 1.006198775 2.012397550 0.000000000
sum over m 3.018957039 3.018957039 6.037914078 0.000000000
px 1 0.065428977 0.065428977 0.130857954 0.000000000
py 1 0.065418224 0.065418224 0.130836448 0.000000000
pz 1 0.040408116 0.040408116 0.080816232 0.000000000
sum over m 0.171255317 0.171255317 0.342510635 0.000000000
sum over m+mul 3.190212356 3.190212356 6.380424713 0.000000000
d3z^2-r^2 0 0.196303172 0.196303172 0.392606344 0.000000000
dx^2-y^2 0 0.201527816 0.201527816 0.403055631 0.000000000
dxy 0 0.250905702 0.250905702 0.501811405 0.000000000
dxz 0 0.268515396 0.268515396 0.537030791 0.000000000
dyz 0 0.268520733 0.268520733 0.537041465 0.000000000
sum over m 1.185772818 1.185772818 2.371545637 0.000000000
d3z^2-r^2 1 0.003482203 0.003482203 0.006964407 0.000000000
dx^2-y^2 1 -0.004468465 -0.004468465 -0.008936930 0.000000000
dxy 1 0.015338826 0.015338826 0.030677652 0.000000000
dxz 1 0.003495915 0.003495915 0.006991831 0.000000000
dyz 1 0.003494083 0.003494083 0.006988166 0.000000000
sum over m 0.021342563 0.021342563 0.042685126 0.000000000
sum over m+mul 1.207115381 1.207115381 2.414230763 0.000000000
549 O Up spin Down spin Sum Diff
multiple
s 0 0.893872050 0.893872050 1.787744100 0.000000000
sum over m 0.893872050 0.893872050 1.787744100 0.000000000
s 1 -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m+mul 0.890829757 0.890829757 1.781659513 0.000000000
px 0 0.786838333 0.786838333 1.573676667 0.000000000
py 0 0.787000794 0.787000794 1.574001587 0.000000000
pz 0 0.779837016 0.779837016 1.559674032 0.000000000
sum over m 2.353676143 2.353676143 4.707352285 0.000000000
px 1 -0.008735882 -0.008735882 -0.017471764 0.000000000
py 1 -0.008738859 -0.008738859 -0.017477718 0.000000000
pz 1 -0.006464962 -0.006464962 -0.012929924 0.000000000
sum over m -0.023939703 -0.023939703 -0.047879406 0.000000000
sum over m+mul 2.329736440 2.329736440 4.659472879 0.000000000
d3z^2-r^2 0 -0.006389678 -0.006389678 -0.012779356 0.000000000
dx^2-y^2 0 -0.005060152 -0.005060152 -0.010120305 0.000000000
dxy 0 -0.005433238 -0.005433238 -0.010866475 0.000000000
dxz 0 -0.006934550 -0.006934550 -0.013869101 0.000000000
dyz 0 -0.006932198 -0.006932198 -0.013864396 0.000000000
sum over m -0.030749817 -0.030749817 -0.061499633 0.000000000
sum over m+mul -0.030749817 -0.030749817 -0.061499633 0.000000000
550 O Up spin Down spin Sum Diff
multiple
s 0 0.893902719 0.893902719 1.787805439 0.000000000
sum over m 0.893902719 0.893902719 1.787805439 0.000000000
s 1 -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m+mul 0.890860394 0.890860394 1.781720789 0.000000000
px 0 0.787071019 0.787071019 1.574142038 0.000000000
py 0 0.786877452 0.786877452 1.573754904 0.000000000
pz 0 0.779782974 0.779782974 1.559565948 0.000000000
sum over m 2.353731445 2.353731445 4.707462890 0.000000000
px 1 -0.008744038 -0.008744038 -0.017488076 0.000000000
py 1 -0.008738305 -0.008738305 -0.017476611 0.000000000
pz 1 -0.006462860 -0.006462860 -0.012925721 0.000000000
sum over m -0.023945204 -0.023945204 -0.047890408 0.000000000
sum over m+mul 2.329786241 2.329786241 4.659572482 0.000000000
d3z^2-r^2 0 -0.006390819 -0.006390819 -0.012781637 0.000000000
dx^2-y^2 0 -0.005058326 -0.005058326 -0.010116653 0.000000000
dxy 0 -0.005435279 -0.005435279 -0.010870557 0.000000000
dxz 0 -0.006928893 -0.006928893 -0.013857785 0.000000000
dyz 0 -0.006933211 -0.006933211 -0.013866423 0.000000000
sum over m -0.030746527 -0.030746527 -0.061493055 0.000000000
sum over m+mul -0.030746527 -0.030746527 -0.061493055 0.000000000
551 O Up spin Down spin Sum Diff
multiple
s 0 0.893885965 0.893885965 1.787771929 0.000000000
sum over m 0.893885965 0.893885965 1.787771929 0.000000000
s 1 -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m+mul 0.890843481 0.890843481 1.781686962 0.000000000
px 0 0.786888859 0.786888859 1.573777718 0.000000000
py 0 0.786986432 0.786986432 1.573972864 0.000000000
pz 0 0.779817968 0.779817968 1.559635937 0.000000000
sum over m 2.353693259 2.353693259 4.707386519 0.000000000
px 1 -0.008737547 -0.008737547 -0.017475095 0.000000000
py 1 -0.008740182 -0.008740182 -0.017480364 0.000000000
pz 1 -0.006464629 -0.006464629 -0.012929258 0.000000000
sum over m -0.023942358 -0.023942358 -0.047884717 0.000000000
sum over m+mul 2.329750901 2.329750901 4.659501802 0.000000000
d3z^2-r^2 0 -0.006390490 -0.006390490 -0.012780980 0.000000000
dx^2-y^2 0 -0.005059495 -0.005059495 -0.010118990 0.000000000
dxy 0 -0.005434167 -0.005434167 -0.010868334 0.000000000
dxz 0 -0.006933943 -0.006933943 -0.013867886 0.000000000
dyz 0 -0.006932257 -0.006932257 -0.013864513 0.000000000
sum over m -0.030750352 -0.030750352 -0.061500704 0.000000000
sum over m+mul -0.030750352 -0.030750352 -0.061500704 0.000000000
552 O Up spin Down spin Sum Diff
multiple
s 0 0.893912541 0.893912541 1.787825082 0.000000000
sum over m 0.893912541 0.893912541 1.787825082 0.000000000
s 1 -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m+mul 0.890869972 0.890869972 1.781739944 0.000000000
px 0 0.787071176 0.787071176 1.574142353 0.000000000
py 0 0.787021576 0.787021576 1.574043151 0.000000000
pz 0 0.779696459 0.779696459 1.559392918 0.000000000
sum over m 2.353789211 2.353789211 4.707578422 0.000000000
px 1 -0.008735385 -0.008735385 -0.017470771 0.000000000
py 1 -0.008734448 -0.008734448 -0.017468896 0.000000000
pz 1 -0.006455985 -0.006455985 -0.012911971 0.000000000
sum over m -0.023925818 -0.023925818 -0.047851637 0.000000000
sum over m+mul 2.329863392 2.329863392 4.659726785 0.000000000
d3z^2-r^2 0 -0.006390385 -0.006390385 -0.012780770 0.000000000
dx^2-y^2 0 -0.005053856 -0.005053856 -0.010107711 0.000000000
dxy 0 -0.005436296 -0.005436296 -0.010872593 0.000000000
dxz 0 -0.006924533 -0.006924533 -0.013849065 0.000000000
dyz 0 -0.006927057 -0.006927057 -0.013854114 0.000000000
sum over m -0.030732127 -0.030732127 -0.061464253 0.000000000
sum over m+mul -0.030732127 -0.030732127 -0.061464253 0.000000000
553 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758579 1.000758579 2.001517159 0.000000000
sum over m 1.000758579 1.000758579 2.001517159 0.000000000
s 1 0.207412087 0.207412087 0.414824173 0.000000000
sum over m 0.207412087 0.207412087 0.414824173 0.000000000
s 2 0.014726635 0.014726635 0.029453269 0.000000000
sum over m 0.014726635 0.014726635 0.029453269 0.000000000
sum over m+mul 1.222897301 1.222897301 2.445794602 0.000000000
px 0 1.006373430 1.006373430 2.012746861 0.000000000
py 0 1.006367276 1.006367276 2.012734551 0.000000000
pz 0 1.006214903 1.006214903 2.012429807 0.000000000
sum over m 3.018955609 3.018955609 6.037911219 0.000000000
px 1 0.065442150 0.065442150 0.130884299 0.000000000
py 1 0.065432003 0.065432003 0.130864006 0.000000000
pz 1 0.040381942 0.040381942 0.080763885 0.000000000
sum over m 0.171256095 0.171256095 0.342512190 0.000000000
sum over m+mul 3.190211705 3.190211705 6.380423409 0.000000000
d3z^2-r^2 0 0.196307095 0.196307095 0.392614190 0.000000000
dx^2-y^2 0 0.201519175 0.201519175 0.403038350 0.000000000
dxy 0 0.250925910 0.250925910 0.501851821 0.000000000
dxz 0 0.268500223 0.268500223 0.537000446 0.000000000
dyz 0 0.268516582 0.268516582 0.537033165 0.000000000
sum over m 1.185768986 1.185768986 2.371537971 0.000000000
d3z^2-r^2 1 0.003480294 0.003480294 0.006960588 0.000000000
dx^2-y^2 1 -0.004472707 -0.004472707 -0.008945415 0.000000000
dxy 1 0.015341260 0.015341260 0.030682519 0.000000000
dxz 1 0.003493777 0.003493777 0.006987555 0.000000000
dyz 1 0.003494934 0.003494934 0.006989868 0.000000000
sum over m 0.021337558 0.021337558 0.042675116 0.000000000
sum over m+mul 1.207106543 1.207106543 2.414213087 0.000000000
554 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742726 1.000742726 2.001485451 0.000000000
sum over m 1.000742726 1.000742726 2.001485451 0.000000000
s 1 0.207416785 0.207416785 0.414833570 0.000000000
sum over m 0.207416785 0.207416785 0.414833570 0.000000000
s 2 0.014727186 0.014727186 0.029454373 0.000000000
sum over m 0.014727186 0.014727186 0.029454373 0.000000000
sum over m+mul 1.222886697 1.222886697 2.445773394 0.000000000
px 0 1.006382080 1.006382080 2.012764160 0.000000000
py 0 1.006376184 1.006376184 2.012752368 0.000000000
pz 0 1.006198775 1.006198775 2.012397550 0.000000000
sum over m 3.018957039 3.018957039 6.037914078 0.000000000
px 1 0.065428977 0.065428977 0.130857953 0.000000000
py 1 0.065418224 0.065418224 0.130836448 0.000000000
pz 1 0.040408116 0.040408116 0.080816233 0.000000000
sum over m 0.171255317 0.171255317 0.342510634 0.000000000
sum over m+mul 3.190212356 3.190212356 6.380424712 0.000000000
d3z^2-r^2 0 0.196303172 0.196303172 0.392606345 0.000000000
dx^2-y^2 0 0.201527816 0.201527816 0.403055631 0.000000000
dxy 0 0.250905702 0.250905702 0.501811405 0.000000000
dxz 0 0.268515396 0.268515396 0.537030791 0.000000000
dyz 0 0.268520733 0.268520733 0.537041465 0.000000000
sum over m 1.185772819 1.185772819 2.371545637 0.000000000
d3z^2-r^2 1 0.003482203 0.003482203 0.006964407 0.000000000
dx^2-y^2 1 -0.004468465 -0.004468465 -0.008936930 0.000000000
dxy 1 0.015338826 0.015338826 0.030677652 0.000000000
dxz 1 0.003495915 0.003495915 0.006991831 0.000000000
dyz 1 0.003494083 0.003494083 0.006988166 0.000000000
sum over m 0.021342563 0.021342563 0.042685126 0.000000000
sum over m+mul 1.207115382 1.207115382 2.414230763 0.000000000
555 O Up spin Down spin Sum Diff
multiple
s 0 0.893872050 0.893872050 1.787744100 0.000000000
sum over m 0.893872050 0.893872050 1.787744100 0.000000000
s 1 -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m+mul 0.890829757 0.890829757 1.781659513 0.000000000
px 0 0.786838333 0.786838333 1.573676667 0.000000000
py 0 0.787000793 0.787000793 1.574001587 0.000000000
pz 0 0.779837016 0.779837016 1.559674032 0.000000000
sum over m 2.353676143 2.353676143 4.707352286 0.000000000
px 1 -0.008735882 -0.008735882 -0.017471764 0.000000000
py 1 -0.008738859 -0.008738859 -0.017477718 0.000000000
pz 1 -0.006464962 -0.006464962 -0.012929924 0.000000000
sum over m -0.023939703 -0.023939703 -0.047879406 0.000000000
sum over m+mul 2.329736440 2.329736440 4.659472880 0.000000000
d3z^2-r^2 0 -0.006389678 -0.006389678 -0.012779356 0.000000000
dx^2-y^2 0 -0.005060152 -0.005060152 -0.010120305 0.000000000
dxy 0 -0.005433238 -0.005433238 -0.010866475 0.000000000
dxz 0 -0.006934550 -0.006934550 -0.013869101 0.000000000
dyz 0 -0.006932198 -0.006932198 -0.013864396 0.000000000
sum over m -0.030749817 -0.030749817 -0.061499633 0.000000000
sum over m+mul -0.030749817 -0.030749817 -0.061499633 0.000000000
556 O Up spin Down spin Sum Diff
multiple
s 0 0.893902719 0.893902719 1.787805439 0.000000000
sum over m 0.893902719 0.893902719 1.787805439 0.000000000
s 1 -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m+mul 0.890860395 0.890860395 1.781720789 0.000000000
px 0 0.787071019 0.787071019 1.574142039 0.000000000
py 0 0.786877452 0.786877452 1.573754904 0.000000000
pz 0 0.779782974 0.779782974 1.559565947 0.000000000
sum over m 2.353731445 2.353731445 4.707462890 0.000000000
px 1 -0.008744038 -0.008744038 -0.017488076 0.000000000
py 1 -0.008738306 -0.008738306 -0.017476611 0.000000000
pz 1 -0.006462860 -0.006462860 -0.012925721 0.000000000
sum over m -0.023945204 -0.023945204 -0.047890408 0.000000000
sum over m+mul 2.329786241 2.329786241 4.659572482 0.000000000
d3z^2-r^2 0 -0.006390819 -0.006390819 -0.012781637 0.000000000
dx^2-y^2 0 -0.005058326 -0.005058326 -0.010116653 0.000000000
dxy 0 -0.005435279 -0.005435279 -0.010870557 0.000000000
dxz 0 -0.006928893 -0.006928893 -0.013857785 0.000000000
dyz 0 -0.006933211 -0.006933211 -0.013866423 0.000000000
sum over m -0.030746527 -0.030746527 -0.061493055 0.000000000
sum over m+mul -0.030746527 -0.030746527 -0.061493055 0.000000000
557 O Up spin Down spin Sum Diff
multiple
s 0 0.893885965 0.893885965 1.787771929 0.000000000
sum over m 0.893885965 0.893885965 1.787771929 0.000000000
s 1 -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m+mul 0.890843481 0.890843481 1.781686962 0.000000000
px 0 0.786888859 0.786888859 1.573777718 0.000000000
py 0 0.786986432 0.786986432 1.573972864 0.000000000
pz 0 0.779817968 0.779817968 1.559635937 0.000000000
sum over m 2.353693260 2.353693260 4.707386519 0.000000000
px 1 -0.008737547 -0.008737547 -0.017475095 0.000000000
py 1 -0.008740182 -0.008740182 -0.017480364 0.000000000
pz 1 -0.006464629 -0.006464629 -0.012929258 0.000000000
sum over m -0.023942358 -0.023942358 -0.047884717 0.000000000
sum over m+mul 2.329750901 2.329750901 4.659501803 0.000000000
d3z^2-r^2 0 -0.006390490 -0.006390490 -0.012780980 0.000000000
dx^2-y^2 0 -0.005059495 -0.005059495 -0.010118990 0.000000000
dxy 0 -0.005434167 -0.005434167 -0.010868334 0.000000000
dxz 0 -0.006933943 -0.006933943 -0.013867886 0.000000000
dyz 0 -0.006932257 -0.006932257 -0.013864513 0.000000000
sum over m -0.030750352 -0.030750352 -0.061500704 0.000000000
sum over m+mul -0.030750352 -0.030750352 -0.061500704 0.000000000
558 O Up spin Down spin Sum Diff
multiple
s 0 0.893912541 0.893912541 1.787825082 0.000000000
sum over m 0.893912541 0.893912541 1.787825082 0.000000000
s 1 -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m+mul 0.890869972 0.890869972 1.781739944 0.000000000
px 0 0.787071177 0.787071177 1.574142353 0.000000000
py 0 0.787021576 0.787021576 1.574043151 0.000000000
pz 0 0.779696459 0.779696459 1.559392918 0.000000000
sum over m 2.353789211 2.353789211 4.707578422 0.000000000
px 1 -0.008735385 -0.008735385 -0.017470771 0.000000000
py 1 -0.008734448 -0.008734448 -0.017468896 0.000000000
pz 1 -0.006455985 -0.006455985 -0.012911971 0.000000000
sum over m -0.023925819 -0.023925819 -0.047851637 0.000000000
sum over m+mul 2.329863392 2.329863392 4.659726785 0.000000000
d3z^2-r^2 0 -0.006390385 -0.006390385 -0.012780770 0.000000000
dx^2-y^2 0 -0.005053856 -0.005053856 -0.010107711 0.000000000
dxy 0 -0.005436296 -0.005436296 -0.010872593 0.000000000
dxz 0 -0.006924533 -0.006924533 -0.013849065 0.000000000
dyz 0 -0.006927057 -0.006927057 -0.013854114 0.000000000
sum over m -0.030732127 -0.030732127 -0.061464253 0.000000000
sum over m+mul -0.030732127 -0.030732127 -0.061464253 0.000000000
559 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758580 1.000758580 2.001517159 0.000000000
sum over m 1.000758580 1.000758580 2.001517159 0.000000000
s 1 0.207412087 0.207412087 0.414824173 0.000000000
sum over m 0.207412087 0.207412087 0.414824173 0.000000000
s 2 0.014726635 0.014726635 0.029453269 0.000000000
sum over m 0.014726635 0.014726635 0.029453269 0.000000000
sum over m+mul 1.222897301 1.222897301 2.445794602 0.000000000
px 0 1.006373430 1.006373430 2.012746861 0.000000000
py 0 1.006367276 1.006367276 2.012734551 0.000000000
pz 0 1.006214904 1.006214904 2.012429807 0.000000000
sum over m 3.018955609 3.018955609 6.037911219 0.000000000
px 1 0.065442149 0.065442149 0.130884299 0.000000000
py 1 0.065432003 0.065432003 0.130864006 0.000000000
pz 1 0.040381942 0.040381942 0.080763885 0.000000000
sum over m 0.171256095 0.171256095 0.342512189 0.000000000
sum over m+mul 3.190211704 3.190211704 6.380423408 0.000000000
d3z^2-r^2 0 0.196307095 0.196307095 0.392614190 0.000000000
dx^2-y^2 0 0.201519175 0.201519175 0.403038350 0.000000000
dxy 0 0.250925910 0.250925910 0.501851820 0.000000000
dxz 0 0.268500223 0.268500223 0.537000446 0.000000000
dyz 0 0.268516582 0.268516582 0.537033165 0.000000000
sum over m 1.185768985 1.185768985 2.371537971 0.000000000
d3z^2-r^2 1 0.003480294 0.003480294 0.006960588 0.000000000
dx^2-y^2 1 -0.004472707 -0.004472707 -0.008945415 0.000000000
dxy 1 0.015341260 0.015341260 0.030682519 0.000000000
dxz 1 0.003493777 0.003493777 0.006987555 0.000000000
dyz 1 0.003494934 0.003494934 0.006989868 0.000000000
sum over m 0.021337558 0.021337558 0.042675116 0.000000000
sum over m+mul 1.207106543 1.207106543 2.414213087 0.000000000
560 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742726 1.000742726 2.001485451 0.000000000
sum over m 1.000742726 1.000742726 2.001485451 0.000000000
s 1 0.207416785 0.207416785 0.414833570 0.000000000
sum over m 0.207416785 0.207416785 0.414833570 0.000000000
s 2 0.014727186 0.014727186 0.029454373 0.000000000
sum over m 0.014727186 0.014727186 0.029454373 0.000000000
sum over m+mul 1.222886697 1.222886697 2.445773394 0.000000000
px 0 1.006382080 1.006382080 2.012764160 0.000000000
py 0 1.006376184 1.006376184 2.012752368 0.000000000
pz 0 1.006198775 1.006198775 2.012397550 0.000000000
sum over m 3.018957039 3.018957039 6.037914078 0.000000000
px 1 0.065428977 0.065428977 0.130857953 0.000000000
py 1 0.065418224 0.065418224 0.130836448 0.000000000
pz 1 0.040408116 0.040408116 0.080816232 0.000000000
sum over m 0.171255317 0.171255317 0.342510634 0.000000000
sum over m+mul 3.190212356 3.190212356 6.380424712 0.000000000
d3z^2-r^2 0 0.196303172 0.196303172 0.392606345 0.000000000
dx^2-y^2 0 0.201527816 0.201527816 0.403055631 0.000000000
dxy 0 0.250905702 0.250905702 0.501811404 0.000000000
dxz 0 0.268515396 0.268515396 0.537030791 0.000000000
dyz 0 0.268520733 0.268520733 0.537041466 0.000000000
sum over m 1.185772818 1.185772818 2.371545637 0.000000000
d3z^2-r^2 1 0.003482203 0.003482203 0.006964407 0.000000000
dx^2-y^2 1 -0.004468465 -0.004468465 -0.008936930 0.000000000
dxy 1 0.015338826 0.015338826 0.030677652 0.000000000
dxz 1 0.003495915 0.003495915 0.006991831 0.000000000
dyz 1 0.003494083 0.003494083 0.006988166 0.000000000
sum over m 0.021342563 0.021342563 0.042685126 0.000000000
sum over m+mul 1.207115381 1.207115381 2.414230763 0.000000000
561 O Up spin Down spin Sum Diff
multiple
s 0 0.893872050 0.893872050 1.787744100 0.000000000
sum over m 0.893872050 0.893872050 1.787744100 0.000000000
s 1 -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m+mul 0.890829757 0.890829757 1.781659513 0.000000000
px 0 0.786838333 0.786838333 1.573676667 0.000000000
py 0 0.787000794 0.787000794 1.574001587 0.000000000
pz 0 0.779837016 0.779837016 1.559674032 0.000000000
sum over m 2.353676143 2.353676143 4.707352286 0.000000000
px 1 -0.008735882 -0.008735882 -0.017471764 0.000000000
py 1 -0.008738859 -0.008738859 -0.017477718 0.000000000
pz 1 -0.006464962 -0.006464962 -0.012929924 0.000000000
sum over m -0.023939703 -0.023939703 -0.047879406 0.000000000
sum over m+mul 2.329736440 2.329736440 4.659472880 0.000000000
d3z^2-r^2 0 -0.006389678 -0.006389678 -0.012779356 0.000000000
dx^2-y^2 0 -0.005060152 -0.005060152 -0.010120305 0.000000000
dxy 0 -0.005433238 -0.005433238 -0.010866475 0.000000000
dxz 0 -0.006934550 -0.006934550 -0.013869101 0.000000000
dyz 0 -0.006932198 -0.006932198 -0.013864396 0.000000000
sum over m -0.030749817 -0.030749817 -0.061499633 0.000000000
sum over m+mul -0.030749817 -0.030749817 -0.061499633 0.000000000
562 O Up spin Down spin Sum Diff
multiple
s 0 0.893902719 0.893902719 1.787805439 0.000000000
sum over m 0.893902719 0.893902719 1.787805439 0.000000000
s 1 -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m+mul 0.890860394 0.890860394 1.781720789 0.000000000
px 0 0.787071019 0.787071019 1.574142038 0.000000000
py 0 0.786877452 0.786877452 1.573754903 0.000000000
pz 0 0.779782974 0.779782974 1.559565948 0.000000000
sum over m 2.353731445 2.353731445 4.707462890 0.000000000
px 1 -0.008744038 -0.008744038 -0.017488076 0.000000000
py 1 -0.008738305 -0.008738305 -0.017476611 0.000000000
pz 1 -0.006462860 -0.006462860 -0.012925721 0.000000000
sum over m -0.023945204 -0.023945204 -0.047890408 0.000000000
sum over m+mul 2.329786241 2.329786241 4.659572482 0.000000000
d3z^2-r^2 0 -0.006390819 -0.006390819 -0.012781637 0.000000000
dx^2-y^2 0 -0.005058326 -0.005058326 -0.010116653 0.000000000
dxy 0 -0.005435279 -0.005435279 -0.010870557 0.000000000
dxz 0 -0.006928893 -0.006928893 -0.013857785 0.000000000
dyz 0 -0.006933211 -0.006933211 -0.013866423 0.000000000
sum over m -0.030746527 -0.030746527 -0.061493055 0.000000000
sum over m+mul -0.030746527 -0.030746527 -0.061493055 0.000000000
563 O Up spin Down spin Sum Diff
multiple
s 0 0.893885965 0.893885965 1.787771930 0.000000000
sum over m 0.893885965 0.893885965 1.787771930 0.000000000
s 1 -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m+mul 0.890843481 0.890843481 1.781686962 0.000000000
px 0 0.786888859 0.786888859 1.573777718 0.000000000
py 0 0.786986432 0.786986432 1.573972864 0.000000000
pz 0 0.779817968 0.779817968 1.559635937 0.000000000
sum over m 2.353693259 2.353693259 4.707386519 0.000000000
px 1 -0.008737548 -0.008737548 -0.017475095 0.000000000
py 1 -0.008740182 -0.008740182 -0.017480364 0.000000000
pz 1 -0.006464629 -0.006464629 -0.012929258 0.000000000
sum over m -0.023942358 -0.023942358 -0.047884717 0.000000000
sum over m+mul 2.329750901 2.329750901 4.659501802 0.000000000
d3z^2-r^2 0 -0.006390490 -0.006390490 -0.012780980 0.000000000
dx^2-y^2 0 -0.005059495 -0.005059495 -0.010118990 0.000000000
dxy 0 -0.005434167 -0.005434167 -0.010868334 0.000000000
dxz 0 -0.006933943 -0.006933943 -0.013867886 0.000000000
dyz 0 -0.006932257 -0.006932257 -0.013864513 0.000000000
sum over m -0.030750352 -0.030750352 -0.061500704 0.000000000
sum over m+mul -0.030750352 -0.030750352 -0.061500704 0.000000000
564 O Up spin Down spin Sum Diff
multiple
s 0 0.893912541 0.893912541 1.787825082 0.000000000
sum over m 0.893912541 0.893912541 1.787825082 0.000000000
s 1 -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m+mul 0.890869972 0.890869972 1.781739945 0.000000000
px 0 0.787071177 0.787071177 1.574142353 0.000000000
py 0 0.787021575 0.787021575 1.574043151 0.000000000
pz 0 0.779696459 0.779696459 1.559392917 0.000000000
sum over m 2.353789211 2.353789211 4.707578421 0.000000000
px 1 -0.008735385 -0.008735385 -0.017470771 0.000000000
py 1 -0.008734448 -0.008734448 -0.017468896 0.000000000
pz 1 -0.006455985 -0.006455985 -0.012911971 0.000000000
sum over m -0.023925819 -0.023925819 -0.047851637 0.000000000
sum over m+mul 2.329863392 2.329863392 4.659726784 0.000000000
d3z^2-r^2 0 -0.006390385 -0.006390385 -0.012780770 0.000000000
dx^2-y^2 0 -0.005053856 -0.005053856 -0.010107711 0.000000000
dxy 0 -0.005436296 -0.005436296 -0.010872593 0.000000000
dxz 0 -0.006924533 -0.006924533 -0.013849065 0.000000000
dyz 0 -0.006927057 -0.006927057 -0.013854115 0.000000000
sum over m -0.030732127 -0.030732127 -0.061464253 0.000000000
sum over m+mul -0.030732127 -0.030732127 -0.061464253 0.000000000
565 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758580 1.000758580 2.001517159 0.000000000
sum over m 1.000758580 1.000758580 2.001517159 0.000000000
s 1 0.207412087 0.207412087 0.414824173 0.000000000
sum over m 0.207412087 0.207412087 0.414824173 0.000000000
s 2 0.014726635 0.014726635 0.029453269 0.000000000
sum over m 0.014726635 0.014726635 0.029453269 0.000000000
sum over m+mul 1.222897301 1.222897301 2.445794602 0.000000000
px 0 1.006373430 1.006373430 2.012746861 0.000000000
py 0 1.006367276 1.006367276 2.012734551 0.000000000
pz 0 1.006214903 1.006214903 2.012429807 0.000000000
sum over m 3.018955609 3.018955609 6.037911219 0.000000000
px 1 0.065442149 0.065442149 0.130884299 0.000000000
py 1 0.065432003 0.065432003 0.130864006 0.000000000
pz 1 0.040381942 0.040381942 0.080763885 0.000000000
sum over m 0.171256095 0.171256095 0.342512189 0.000000000
sum over m+mul 3.190211704 3.190211704 6.380423408 0.000000000
d3z^2-r^2 0 0.196307095 0.196307095 0.392614189 0.000000000
dx^2-y^2 0 0.201519175 0.201519175 0.403038350 0.000000000
dxy 0 0.250925910 0.250925910 0.501851820 0.000000000
dxz 0 0.268500223 0.268500223 0.537000446 0.000000000
dyz 0 0.268516583 0.268516583 0.537033165 0.000000000
sum over m 1.185768986 1.185768986 2.371537971 0.000000000
d3z^2-r^2 1 0.003480294 0.003480294 0.006960588 0.000000000
dx^2-y^2 1 -0.004472707 -0.004472707 -0.008945415 0.000000000
dxy 1 0.015341260 0.015341260 0.030682519 0.000000000
dxz 1 0.003493777 0.003493777 0.006987555 0.000000000
dyz 1 0.003494934 0.003494934 0.006989868 0.000000000
sum over m 0.021337558 0.021337558 0.042675116 0.000000000
sum over m+mul 1.207106544 1.207106544 2.414213087 0.000000000
566 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742726 1.000742726 2.001485451 0.000000000
sum over m 1.000742726 1.000742726 2.001485451 0.000000000
s 1 0.207416785 0.207416785 0.414833570 0.000000000
sum over m 0.207416785 0.207416785 0.414833570 0.000000000
s 2 0.014727186 0.014727186 0.029454373 0.000000000
sum over m 0.014727186 0.014727186 0.029454373 0.000000000
sum over m+mul 1.222886697 1.222886697 2.445773394 0.000000000
px 0 1.006382080 1.006382080 2.012764160 0.000000000
py 0 1.006376184 1.006376184 2.012752368 0.000000000
pz 0 1.006198775 1.006198775 2.012397550 0.000000000
sum over m 3.018957039 3.018957039 6.037914078 0.000000000
px 1 0.065428976 0.065428976 0.130857953 0.000000000
py 1 0.065418224 0.065418224 0.130836448 0.000000000
pz 1 0.040408116 0.040408116 0.080816232 0.000000000
sum over m 0.171255317 0.171255317 0.342510634 0.000000000
sum over m+mul 3.190212356 3.190212356 6.380424711 0.000000000
d3z^2-r^2 0 0.196303172 0.196303172 0.392606344 0.000000000
dx^2-y^2 0 0.201527816 0.201527816 0.403055632 0.000000000
dxy 0 0.250905702 0.250905702 0.501811404 0.000000000
dxz 0 0.268515396 0.268515396 0.537030791 0.000000000
dyz 0 0.268520733 0.268520733 0.537041465 0.000000000
sum over m 1.185772818 1.185772818 2.371545637 0.000000000
d3z^2-r^2 1 0.003482203 0.003482203 0.006964407 0.000000000
dx^2-y^2 1 -0.004468465 -0.004468465 -0.008936930 0.000000000
dxy 1 0.015338826 0.015338826 0.030677652 0.000000000
dxz 1 0.003495915 0.003495915 0.006991831 0.000000000
dyz 1 0.003494083 0.003494083 0.006988166 0.000000000
sum over m 0.021342563 0.021342563 0.042685126 0.000000000
sum over m+mul 1.207115381 1.207115381 2.414230763 0.000000000
567 O Up spin Down spin Sum Diff
multiple
s 0 0.893872050 0.893872050 1.787744100 0.000000000
sum over m 0.893872050 0.893872050 1.787744100 0.000000000
s 1 -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m+mul 0.890829757 0.890829757 1.781659513 0.000000000
px 0 0.786838334 0.786838334 1.573676667 0.000000000
py 0 0.787000793 0.787000793 1.574001587 0.000000000
pz 0 0.779837016 0.779837016 1.559674032 0.000000000
sum over m 2.353676143 2.353676143 4.707352286 0.000000000
px 1 -0.008735882 -0.008735882 -0.017471764 0.000000000
py 1 -0.008738859 -0.008738859 -0.017477718 0.000000000
pz 1 -0.006464962 -0.006464962 -0.012929924 0.000000000
sum over m -0.023939703 -0.023939703 -0.047879406 0.000000000
sum over m+mul 2.329736440 2.329736440 4.659472880 0.000000000
d3z^2-r^2 0 -0.006389678 -0.006389678 -0.012779356 0.000000000
dx^2-y^2 0 -0.005060152 -0.005060152 -0.010120305 0.000000000
dxy 0 -0.005433238 -0.005433238 -0.010866475 0.000000000
dxz 0 -0.006934550 -0.006934550 -0.013869101 0.000000000
dyz 0 -0.006932198 -0.006932198 -0.013864396 0.000000000
sum over m -0.030749817 -0.030749817 -0.061499633 0.000000000
sum over m+mul -0.030749817 -0.030749817 -0.061499633 0.000000000
568 O Up spin Down spin Sum Diff
multiple
s 0 0.893902719 0.893902719 1.787805438 0.000000000
sum over m 0.893902719 0.893902719 1.787805438 0.000000000
s 1 -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m+mul 0.890860394 0.890860394 1.781720789 0.000000000
px 0 0.787071019 0.787071019 1.574142039 0.000000000
py 0 0.786877452 0.786877452 1.573754904 0.000000000
pz 0 0.779782974 0.779782974 1.559565948 0.000000000
sum over m 2.353731445 2.353731445 4.707462890 0.000000000
px 1 -0.008744038 -0.008744038 -0.017488076 0.000000000
py 1 -0.008738305 -0.008738305 -0.017476611 0.000000000
pz 1 -0.006462860 -0.006462860 -0.012925721 0.000000000
sum over m -0.023945204 -0.023945204 -0.047890408 0.000000000
sum over m+mul 2.329786241 2.329786241 4.659572482 0.000000000
d3z^2-r^2 0 -0.006390819 -0.006390819 -0.012781637 0.000000000
dx^2-y^2 0 -0.005058326 -0.005058326 -0.010116653 0.000000000
dxy 0 -0.005435279 -0.005435279 -0.010870557 0.000000000
dxz 0 -0.006928893 -0.006928893 -0.013857785 0.000000000
dyz 0 -0.006933211 -0.006933211 -0.013866423 0.000000000
sum over m -0.030746527 -0.030746527 -0.061493055 0.000000000
sum over m+mul -0.030746527 -0.030746527 -0.061493055 0.000000000
569 O Up spin Down spin Sum Diff
multiple
s 0 0.893885965 0.893885965 1.787771930 0.000000000
sum over m 0.893885965 0.893885965 1.787771930 0.000000000
s 1 -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m+mul 0.890843481 0.890843481 1.781686962 0.000000000
px 0 0.786888859 0.786888859 1.573777718 0.000000000
py 0 0.786986432 0.786986432 1.573972864 0.000000000
pz 0 0.779817968 0.779817968 1.559635937 0.000000000
sum over m 2.353693259 2.353693259 4.707386519 0.000000000
px 1 -0.008737548 -0.008737548 -0.017475095 0.000000000
py 1 -0.008740182 -0.008740182 -0.017480364 0.000000000
pz 1 -0.006464629 -0.006464629 -0.012929258 0.000000000
sum over m -0.023942358 -0.023942358 -0.047884717 0.000000000
sum over m+mul 2.329750901 2.329750901 4.659501802 0.000000000
d3z^2-r^2 0 -0.006390490 -0.006390490 -0.012780980 0.000000000
dx^2-y^2 0 -0.005059495 -0.005059495 -0.010118990 0.000000000
dxy 0 -0.005434167 -0.005434167 -0.010868334 0.000000000
dxz 0 -0.006933943 -0.006933943 -0.013867886 0.000000000
dyz 0 -0.006932257 -0.006932257 -0.013864513 0.000000000
sum over m -0.030750352 -0.030750352 -0.061500704 0.000000000
sum over m+mul -0.030750352 -0.030750352 -0.061500704 0.000000000
570 O Up spin Down spin Sum Diff
multiple
s 0 0.893912541 0.893912541 1.787825082 0.000000000
sum over m 0.893912541 0.893912541 1.787825082 0.000000000
s 1 -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m+mul 0.890869972 0.890869972 1.781739944 0.000000000
px 0 0.787071177 0.787071177 1.574142353 0.000000000
py 0 0.787021576 0.787021576 1.574043151 0.000000000
pz 0 0.779696459 0.779696459 1.559392918 0.000000000
sum over m 2.353789211 2.353789211 4.707578422 0.000000000
px 1 -0.008735385 -0.008735385 -0.017470771 0.000000000
py 1 -0.008734448 -0.008734448 -0.017468896 0.000000000
pz 1 -0.006455985 -0.006455985 -0.012911971 0.000000000
sum over m -0.023925818 -0.023925818 -0.047851637 0.000000000
sum over m+mul 2.329863393 2.329863393 4.659726785 0.000000000
d3z^2-r^2 0 -0.006390385 -0.006390385 -0.012780770 0.000000000
dx^2-y^2 0 -0.005053856 -0.005053856 -0.010107711 0.000000000
dxy 0 -0.005436296 -0.005436296 -0.010872593 0.000000000
dxz 0 -0.006924533 -0.006924533 -0.013849065 0.000000000
dyz 0 -0.006927057 -0.006927057 -0.013854114 0.000000000
sum over m -0.030732127 -0.030732127 -0.061464253 0.000000000
sum over m+mul -0.030732127 -0.030732127 -0.061464253 0.000000000
571 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758579 1.000758579 2.001517159 0.000000000
sum over m 1.000758579 1.000758579 2.001517159 0.000000000
s 1 0.207412087 0.207412087 0.414824174 0.000000000
sum over m 0.207412087 0.207412087 0.414824174 0.000000000
s 2 0.014726635 0.014726635 0.029453270 0.000000000
sum over m 0.014726635 0.014726635 0.029453270 0.000000000
sum over m+mul 1.222897301 1.222897301 2.445794602 0.000000000
px 0 1.006373430 1.006373430 2.012746861 0.000000000
py 0 1.006367276 1.006367276 2.012734551 0.000000000
pz 0 1.006214904 1.006214904 2.012429807 0.000000000
sum over m 3.018955610 3.018955610 6.037911219 0.000000000
px 1 0.065442150 0.065442150 0.130884300 0.000000000
py 1 0.065432003 0.065432003 0.130864006 0.000000000
pz 1 0.040381942 0.040381942 0.080763884 0.000000000
sum over m 0.171256095 0.171256095 0.342512190 0.000000000
sum over m+mul 3.190211705 3.190211705 6.380423409 0.000000000
d3z^2-r^2 0 0.196307095 0.196307095 0.392614189 0.000000000
dx^2-y^2 0 0.201519175 0.201519175 0.403038350 0.000000000
dxy 0 0.250925910 0.250925910 0.501851821 0.000000000
dxz 0 0.268500223 0.268500223 0.537000446 0.000000000
dyz 0 0.268516583 0.268516583 0.537033165 0.000000000
sum over m 1.185768986 1.185768986 2.371537972 0.000000000
d3z^2-r^2 1 0.003480294 0.003480294 0.006960588 0.000000000
dx^2-y^2 1 -0.004472707 -0.004472707 -0.008945415 0.000000000
dxy 1 0.015341260 0.015341260 0.030682519 0.000000000
dxz 1 0.003493777 0.003493777 0.006987555 0.000000000
dyz 1 0.003494934 0.003494934 0.006989868 0.000000000
sum over m 0.021337558 0.021337558 0.042675116 0.000000000
sum over m+mul 1.207106544 1.207106544 2.414213088 0.000000000
572 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742726 1.000742726 2.001485451 0.000000000
sum over m 1.000742726 1.000742726 2.001485451 0.000000000
s 1 0.207416785 0.207416785 0.414833570 0.000000000
sum over m 0.207416785 0.207416785 0.414833570 0.000000000
s 2 0.014727186 0.014727186 0.029454373 0.000000000
sum over m 0.014727186 0.014727186 0.029454373 0.000000000
sum over m+mul 1.222886697 1.222886697 2.445773394 0.000000000
px 0 1.006382080 1.006382080 2.012764160 0.000000000
py 0 1.006376184 1.006376184 2.012752367 0.000000000
pz 0 1.006198775 1.006198775 2.012397550 0.000000000
sum over m 3.018957039 3.018957039 6.037914078 0.000000000
px 1 0.065428977 0.065428977 0.130857953 0.000000000
py 1 0.065418224 0.065418224 0.130836448 0.000000000
pz 1 0.040408116 0.040408116 0.080816232 0.000000000
sum over m 0.171255317 0.171255317 0.342510634 0.000000000
sum over m+mul 3.190212356 3.190212356 6.380424712 0.000000000
d3z^2-r^2 0 0.196303172 0.196303172 0.392606345 0.000000000
dx^2-y^2 0 0.201527816 0.201527816 0.403055631 0.000000000
dxy 0 0.250905702 0.250905702 0.501811404 0.000000000
dxz 0 0.268515396 0.268515396 0.537030791 0.000000000
dyz 0 0.268520733 0.268520733 0.537041465 0.000000000
sum over m 1.185772819 1.185772819 2.371545637 0.000000000
d3z^2-r^2 1 0.003482203 0.003482203 0.006964407 0.000000000
dx^2-y^2 1 -0.004468465 -0.004468465 -0.008936930 0.000000000
dxy 1 0.015338826 0.015338826 0.030677652 0.000000000
dxz 1 0.003495915 0.003495915 0.006991831 0.000000000
dyz 1 0.003494083 0.003494083 0.006988166 0.000000000
sum over m 0.021342563 0.021342563 0.042685126 0.000000000
sum over m+mul 1.207115381 1.207115381 2.414230763 0.000000000
573 O Up spin Down spin Sum Diff
multiple
s 0 0.893872050 0.893872050 1.787744100 0.000000000
sum over m 0.893872050 0.893872050 1.787744100 0.000000000
s 1 -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m+mul 0.890829757 0.890829757 1.781659513 0.000000000
px 0 0.786838333 0.786838333 1.573676667 0.000000000
py 0 0.787000794 0.787000794 1.574001587 0.000000000
pz 0 0.779837016 0.779837016 1.559674032 0.000000000
sum over m 2.353676143 2.353676143 4.707352286 0.000000000
px 1 -0.008735882 -0.008735882 -0.017471764 0.000000000
py 1 -0.008738859 -0.008738859 -0.017477718 0.000000000
pz 1 -0.006464962 -0.006464962 -0.012929924 0.000000000
sum over m -0.023939703 -0.023939703 -0.047879406 0.000000000
sum over m+mul 2.329736440 2.329736440 4.659472880 0.000000000
d3z^2-r^2 0 -0.006389678 -0.006389678 -0.012779356 0.000000000
dx^2-y^2 0 -0.005060152 -0.005060152 -0.010120305 0.000000000
dxy 0 -0.005433238 -0.005433238 -0.010866475 0.000000000
dxz 0 -0.006934550 -0.006934550 -0.013869101 0.000000000
dyz 0 -0.006932198 -0.006932198 -0.013864396 0.000000000
sum over m -0.030749817 -0.030749817 -0.061499633 0.000000000
sum over m+mul -0.030749817 -0.030749817 -0.061499633 0.000000000
574 O Up spin Down spin Sum Diff
multiple
s 0 0.893902719 0.893902719 1.787805439 0.000000000
sum over m 0.893902719 0.893902719 1.787805439 0.000000000
s 1 -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m+mul 0.890860394 0.890860394 1.781720789 0.000000000
px 0 0.787071019 0.787071019 1.574142039 0.000000000
py 0 0.786877452 0.786877452 1.573754904 0.000000000
pz 0 0.779782974 0.779782974 1.559565948 0.000000000
sum over m 2.353731445 2.353731445 4.707462890 0.000000000
px 1 -0.008744038 -0.008744038 -0.017488076 0.000000000
py 1 -0.008738305 -0.008738305 -0.017476611 0.000000000
pz 1 -0.006462860 -0.006462860 -0.012925721 0.000000000
sum over m -0.023945204 -0.023945204 -0.047890408 0.000000000
sum over m+mul 2.329786241 2.329786241 4.659572482 0.000000000
d3z^2-r^2 0 -0.006390819 -0.006390819 -0.012781637 0.000000000
dx^2-y^2 0 -0.005058326 -0.005058326 -0.010116653 0.000000000
dxy 0 -0.005435279 -0.005435279 -0.010870557 0.000000000
dxz 0 -0.006928893 -0.006928893 -0.013857785 0.000000000
dyz 0 -0.006933211 -0.006933211 -0.013866423 0.000000000
sum over m -0.030746527 -0.030746527 -0.061493055 0.000000000
sum over m+mul -0.030746527 -0.030746527 -0.061493055 0.000000000
575 O Up spin Down spin Sum Diff
multiple
s 0 0.893885965 0.893885965 1.787771929 0.000000000
sum over m 0.893885965 0.893885965 1.787771929 0.000000000
s 1 -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m+mul 0.890843481 0.890843481 1.781686962 0.000000000
px 0 0.786888859 0.786888859 1.573777718 0.000000000
py 0 0.786986432 0.786986432 1.573972864 0.000000000
pz 0 0.779817968 0.779817968 1.559635937 0.000000000
sum over m 2.353693260 2.353693260 4.707386519 0.000000000
px 1 -0.008737547 -0.008737547 -0.017475095 0.000000000
py 1 -0.008740182 -0.008740182 -0.017480364 0.000000000
pz 1 -0.006464629 -0.006464629 -0.012929258 0.000000000
sum over m -0.023942358 -0.023942358 -0.047884717 0.000000000
sum over m+mul 2.329750901 2.329750901 4.659501802 0.000000000
d3z^2-r^2 0 -0.006390490 -0.006390490 -0.012780980 0.000000000
dx^2-y^2 0 -0.005059495 -0.005059495 -0.010118990 0.000000000
dxy 0 -0.005434167 -0.005434167 -0.010868334 0.000000000
dxz 0 -0.006933943 -0.006933943 -0.013867886 0.000000000
dyz 0 -0.006932257 -0.006932257 -0.013864513 0.000000000
sum over m -0.030750352 -0.030750352 -0.061500704 0.000000000
sum over m+mul -0.030750352 -0.030750352 -0.061500704 0.000000000
576 O Up spin Down spin Sum Diff
multiple
s 0 0.893912541 0.893912541 1.787825082 0.000000000
sum over m 0.893912541 0.893912541 1.787825082 0.000000000
s 1 -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m+mul 0.890869972 0.890869972 1.781739944 0.000000000
px 0 0.787071176 0.787071176 1.574142353 0.000000000
py 0 0.787021575 0.787021575 1.574043151 0.000000000
pz 0 0.779696459 0.779696459 1.559392918 0.000000000
sum over m 2.353789211 2.353789211 4.707578421 0.000000000
px 1 -0.008735385 -0.008735385 -0.017470771 0.000000000
py 1 -0.008734448 -0.008734448 -0.017468896 0.000000000
pz 1 -0.006455985 -0.006455985 -0.012911971 0.000000000
sum over m -0.023925819 -0.023925819 -0.047851637 0.000000000
sum over m+mul 2.329863392 2.329863392 4.659726784 0.000000000
d3z^2-r^2 0 -0.006390385 -0.006390385 -0.012780770 0.000000000
dx^2-y^2 0 -0.005053856 -0.005053856 -0.010107711 0.000000000
dxy 0 -0.005436296 -0.005436296 -0.010872593 0.000000000
dxz 0 -0.006924533 -0.006924533 -0.013849065 0.000000000
dyz 0 -0.006927057 -0.006927057 -0.013854114 0.000000000
sum over m -0.030732127 -0.030732127 -0.061464253 0.000000000
sum over m+mul -0.030732127 -0.030732127 -0.061464253 0.000000000
577 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758580 1.000758580 2.001517159 0.000000000
sum over m 1.000758580 1.000758580 2.001517159 0.000000000
s 1 0.207412086 0.207412086 0.414824173 0.000000000
sum over m 0.207412086 0.207412086 0.414824173 0.000000000
s 2 0.014726635 0.014726635 0.029453270 0.000000000
sum over m 0.014726635 0.014726635 0.029453270 0.000000000
sum over m+mul 1.222897301 1.222897301 2.445794602 0.000000000
px 0 1.006373430 1.006373430 2.012746861 0.000000000
py 0 1.006367276 1.006367276 2.012734551 0.000000000
pz 0 1.006214903 1.006214903 2.012429807 0.000000000
sum over m 3.018955609 3.018955609 6.037911219 0.000000000
px 1 0.065442150 0.065442150 0.130884299 0.000000000
py 1 0.065432003 0.065432003 0.130864006 0.000000000
pz 1 0.040381942 0.040381942 0.080763884 0.000000000
sum over m 0.171256094 0.171256094 0.342512189 0.000000000
sum over m+mul 3.190211704 3.190211704 6.380423408 0.000000000
d3z^2-r^2 0 0.196307095 0.196307095 0.392614189 0.000000000
dx^2-y^2 0 0.201519175 0.201519175 0.403038351 0.000000000
dxy 0 0.250925910 0.250925910 0.501851821 0.000000000
dxz 0 0.268500223 0.268500223 0.537000446 0.000000000
dyz 0 0.268516582 0.268516582 0.537033165 0.000000000
sum over m 1.185768986 1.185768986 2.371537971 0.000000000
d3z^2-r^2 1 0.003480294 0.003480294 0.006960588 0.000000000
dx^2-y^2 1 -0.004472707 -0.004472707 -0.008945415 0.000000000
dxy 1 0.015341260 0.015341260 0.030682519 0.000000000
dxz 1 0.003493777 0.003493777 0.006987555 0.000000000
dyz 1 0.003494934 0.003494934 0.006989868 0.000000000
sum over m 0.021337558 0.021337558 0.042675116 0.000000000
sum over m+mul 1.207106544 1.207106544 2.414213087 0.000000000
578 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742726 1.000742726 2.001485451 0.000000000
sum over m 1.000742726 1.000742726 2.001485451 0.000000000
s 1 0.207416785 0.207416785 0.414833570 0.000000000
sum over m 0.207416785 0.207416785 0.414833570 0.000000000
s 2 0.014727186 0.014727186 0.029454373 0.000000000
sum over m 0.014727186 0.014727186 0.029454373 0.000000000
sum over m+mul 1.222886697 1.222886697 2.445773393 0.000000000
px 0 1.006382080 1.006382080 2.012764160 0.000000000
py 0 1.006376184 1.006376184 2.012752367 0.000000000
pz 0 1.006198775 1.006198775 2.012397550 0.000000000
sum over m 3.018957039 3.018957039 6.037914078 0.000000000
px 1 0.065428977 0.065428977 0.130857954 0.000000000
py 1 0.065418224 0.065418224 0.130836448 0.000000000
pz 1 0.040408116 0.040408116 0.080816232 0.000000000
sum over m 0.171255317 0.171255317 0.342510634 0.000000000
sum over m+mul 3.190212356 3.190212356 6.380424712 0.000000000
d3z^2-r^2 0 0.196303172 0.196303172 0.392606345 0.000000000
dx^2-y^2 0 0.201527816 0.201527816 0.403055631 0.000000000
dxy 0 0.250905702 0.250905702 0.501811405 0.000000000
dxz 0 0.268515396 0.268515396 0.537030791 0.000000000
dyz 0 0.268520733 0.268520733 0.537041466 0.000000000
sum over m 1.185772819 1.185772819 2.371545637 0.000000000
d3z^2-r^2 1 0.003482203 0.003482203 0.006964407 0.000000000
dx^2-y^2 1 -0.004468465 -0.004468465 -0.008936930 0.000000000
dxy 1 0.015338826 0.015338826 0.030677652 0.000000000
dxz 1 0.003495915 0.003495915 0.006991831 0.000000000
dyz 1 0.003494083 0.003494083 0.006988166 0.000000000
sum over m 0.021342563 0.021342563 0.042685126 0.000000000
sum over m+mul 1.207115382 1.207115382 2.414230763 0.000000000
579 O Up spin Down spin Sum Diff
multiple
s 0 0.893872050 0.893872050 1.787744100 0.000000000
sum over m 0.893872050 0.893872050 1.787744100 0.000000000
s 1 -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m+mul 0.890829757 0.890829757 1.781659513 0.000000000
px 0 0.786838334 0.786838334 1.573676667 0.000000000
py 0 0.787000793 0.787000793 1.574001587 0.000000000
pz 0 0.779837016 0.779837016 1.559674032 0.000000000
sum over m 2.353676143 2.353676143 4.707352286 0.000000000
px 1 -0.008735882 -0.008735882 -0.017471764 0.000000000
py 1 -0.008738859 -0.008738859 -0.017477718 0.000000000
pz 1 -0.006464962 -0.006464962 -0.012929924 0.000000000
sum over m -0.023939703 -0.023939703 -0.047879406 0.000000000
sum over m+mul 2.329736440 2.329736440 4.659472880 0.000000000
d3z^2-r^2 0 -0.006389678 -0.006389678 -0.012779356 0.000000000
dx^2-y^2 0 -0.005060152 -0.005060152 -0.010120305 0.000000000
dxy 0 -0.005433238 -0.005433238 -0.010866475 0.000000000
dxz 0 -0.006934550 -0.006934550 -0.013869101 0.000000000
dyz 0 -0.006932198 -0.006932198 -0.013864396 0.000000000
sum over m -0.030749817 -0.030749817 -0.061499633 0.000000000
sum over m+mul -0.030749817 -0.030749817 -0.061499633 0.000000000
580 O Up spin Down spin Sum Diff
multiple
s 0 0.893902719 0.893902719 1.787805439 0.000000000
sum over m 0.893902719 0.893902719 1.787805439 0.000000000
s 1 -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m+mul 0.890860394 0.890860394 1.781720789 0.000000000
px 0 0.787071019 0.787071019 1.574142038 0.000000000
py 0 0.786877452 0.786877452 1.573754904 0.000000000
pz 0 0.779782974 0.779782974 1.559565948 0.000000000
sum over m 2.353731445 2.353731445 4.707462890 0.000000000
px 1 -0.008744038 -0.008744038 -0.017488076 0.000000000
py 1 -0.008738305 -0.008738305 -0.017476611 0.000000000
pz 1 -0.006462860 -0.006462860 -0.012925721 0.000000000
sum over m -0.023945204 -0.023945204 -0.047890408 0.000000000
sum over m+mul 2.329786241 2.329786241 4.659572482 0.000000000
d3z^2-r^2 0 -0.006390819 -0.006390819 -0.012781637 0.000000000
dx^2-y^2 0 -0.005058326 -0.005058326 -0.010116652 0.000000000
dxy 0 -0.005435279 -0.005435279 -0.010870557 0.000000000
dxz 0 -0.006928893 -0.006928893 -0.013857785 0.000000000
dyz 0 -0.006933211 -0.006933211 -0.013866423 0.000000000
sum over m -0.030746527 -0.030746527 -0.061493055 0.000000000
sum over m+mul -0.030746527 -0.030746527 -0.061493055 0.000000000
581 O Up spin Down spin Sum Diff
multiple
s 0 0.893885965 0.893885965 1.787771930 0.000000000
sum over m 0.893885965 0.893885965 1.787771930 0.000000000
s 1 -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m+mul 0.890843481 0.890843481 1.781686962 0.000000000
px 0 0.786888859 0.786888859 1.573777718 0.000000000
py 0 0.786986432 0.786986432 1.573972864 0.000000000
pz 0 0.779817968 0.779817968 1.559635937 0.000000000
sum over m 2.353693260 2.353693260 4.707386519 0.000000000
px 1 -0.008737547 -0.008737547 -0.017475095 0.000000000
py 1 -0.008740182 -0.008740182 -0.017480364 0.000000000
pz 1 -0.006464629 -0.006464629 -0.012929258 0.000000000
sum over m -0.023942358 -0.023942358 -0.047884717 0.000000000
sum over m+mul 2.329750901 2.329750901 4.659501803 0.000000000
d3z^2-r^2 0 -0.006390490 -0.006390490 -0.012780980 0.000000000
dx^2-y^2 0 -0.005059495 -0.005059495 -0.010118990 0.000000000
dxy 0 -0.005434167 -0.005434167 -0.010868334 0.000000000
dxz 0 -0.006933943 -0.006933943 -0.013867886 0.000000000
dyz 0 -0.006932257 -0.006932257 -0.013864513 0.000000000
sum over m -0.030750352 -0.030750352 -0.061500704 0.000000000
sum over m+mul -0.030750352 -0.030750352 -0.061500704 0.000000000
582 O Up spin Down spin Sum Diff
multiple
s 0 0.893912541 0.893912541 1.787825082 0.000000000
sum over m 0.893912541 0.893912541 1.787825082 0.000000000
s 1 -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m+mul 0.890869972 0.890869972 1.781739944 0.000000000
px 0 0.787071176 0.787071176 1.574142353 0.000000000
py 0 0.787021576 0.787021576 1.574043151 0.000000000
pz 0 0.779696459 0.779696459 1.559392918 0.000000000
sum over m 2.353789211 2.353789211 4.707578422 0.000000000
px 1 -0.008735385 -0.008735385 -0.017470771 0.000000000
py 1 -0.008734448 -0.008734448 -0.017468896 0.000000000
pz 1 -0.006455985 -0.006455985 -0.012911971 0.000000000
sum over m -0.023925819 -0.023925819 -0.047851637 0.000000000
sum over m+mul 2.329863392 2.329863392 4.659726785 0.000000000
d3z^2-r^2 0 -0.006390385 -0.006390385 -0.012780770 0.000000000
dx^2-y^2 0 -0.005053856 -0.005053856 -0.010107711 0.000000000
dxy 0 -0.005436296 -0.005436296 -0.010872593 0.000000000
dxz 0 -0.006924533 -0.006924533 -0.013849065 0.000000000
dyz 0 -0.006927057 -0.006927057 -0.013854114 0.000000000
sum over m -0.030732127 -0.030732127 -0.061464253 0.000000000
sum over m+mul -0.030732127 -0.030732127 -0.061464253 0.000000000
583 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758580 1.000758580 2.001517159 0.000000000
sum over m 1.000758580 1.000758580 2.001517159 0.000000000
s 1 0.207412087 0.207412087 0.414824173 0.000000000
sum over m 0.207412087 0.207412087 0.414824173 0.000000000
s 2 0.014726635 0.014726635 0.029453270 0.000000000
sum over m 0.014726635 0.014726635 0.029453270 0.000000000
sum over m+mul 1.222897301 1.222897301 2.445794602 0.000000000
px 0 1.006373430 1.006373430 2.012746861 0.000000000
py 0 1.006367276 1.006367276 2.012734551 0.000000000
pz 0 1.006214904 1.006214904 2.012429807 0.000000000
sum over m 3.018955610 3.018955610 6.037911219 0.000000000
px 1 0.065442149 0.065442149 0.130884299 0.000000000
py 1 0.065432003 0.065432003 0.130864006 0.000000000
pz 1 0.040381942 0.040381942 0.080763884 0.000000000
sum over m 0.171256095 0.171256095 0.342512189 0.000000000
sum over m+mul 3.190211704 3.190211704 6.380423409 0.000000000
d3z^2-r^2 0 0.196307095 0.196307095 0.392614189 0.000000000
dx^2-y^2 0 0.201519175 0.201519175 0.403038350 0.000000000
dxy 0 0.250925910 0.250925910 0.501851821 0.000000000
dxz 0 0.268500223 0.268500223 0.537000446 0.000000000
dyz 0 0.268516583 0.268516583 0.537033165 0.000000000
sum over m 1.185768986 1.185768986 2.371537971 0.000000000
d3z^2-r^2 1 0.003480294 0.003480294 0.006960588 0.000000000
dx^2-y^2 1 -0.004472707 -0.004472707 -0.008945415 0.000000000
dxy 1 0.015341260 0.015341260 0.030682519 0.000000000
dxz 1 0.003493777 0.003493777 0.006987555 0.000000000
dyz 1 0.003494934 0.003494934 0.006989868 0.000000000
sum over m 0.021337558 0.021337558 0.042675116 0.000000000
sum over m+mul 1.207106544 1.207106544 2.414213087 0.000000000
584 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742726 1.000742726 2.001485451 0.000000000
sum over m 1.000742726 1.000742726 2.001485451 0.000000000
s 1 0.207416785 0.207416785 0.414833569 0.000000000
sum over m 0.207416785 0.207416785 0.414833569 0.000000000
s 2 0.014727186 0.014727186 0.029454373 0.000000000
sum over m 0.014727186 0.014727186 0.029454373 0.000000000
sum over m+mul 1.222886697 1.222886697 2.445773393 0.000000000
px 0 1.006382080 1.006382080 2.012764160 0.000000000
py 0 1.006376184 1.006376184 2.012752367 0.000000000
pz 0 1.006198775 1.006198775 2.012397550 0.000000000
sum over m 3.018957039 3.018957039 6.037914078 0.000000000
px 1 0.065428977 0.065428977 0.130857953 0.000000000
py 1 0.065418224 0.065418224 0.130836449 0.000000000
pz 1 0.040408116 0.040408116 0.080816232 0.000000000
sum over m 0.171255317 0.171255317 0.342510634 0.000000000
sum over m+mul 3.190212356 3.190212356 6.380424712 0.000000000
d3z^2-r^2 0 0.196303172 0.196303172 0.392606344 0.000000000
dx^2-y^2 0 0.201527816 0.201527816 0.403055632 0.000000000
dxy 0 0.250905702 0.250905702 0.501811404 0.000000000
dxz 0 0.268515396 0.268515396 0.537030791 0.000000000
dyz 0 0.268520733 0.268520733 0.537041466 0.000000000
sum over m 1.185772819 1.185772819 2.371545638 0.000000000
d3z^2-r^2 1 0.003482203 0.003482203 0.006964407 0.000000000
dx^2-y^2 1 -0.004468465 -0.004468465 -0.008936930 0.000000000
dxy 1 0.015338826 0.015338826 0.030677652 0.000000000
dxz 1 0.003495915 0.003495915 0.006991831 0.000000000
dyz 1 0.003494083 0.003494083 0.006988166 0.000000000
sum over m 0.021342563 0.021342563 0.042685126 0.000000000
sum over m+mul 1.207115382 1.207115382 2.414230763 0.000000000
585 O Up spin Down spin Sum Diff
multiple
s 0 0.893872050 0.893872050 1.787744100 0.000000000
sum over m 0.893872050 0.893872050 1.787744100 0.000000000
s 1 -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m+mul 0.890829757 0.890829757 1.781659513 0.000000000
px 0 0.786838334 0.786838334 1.573676667 0.000000000
py 0 0.787000794 0.787000794 1.574001587 0.000000000
pz 0 0.779837016 0.779837016 1.559674032 0.000000000
sum over m 2.353676143 2.353676143 4.707352286 0.000000000
px 1 -0.008735882 -0.008735882 -0.017471764 0.000000000
py 1 -0.008738859 -0.008738859 -0.017477718 0.000000000
pz 1 -0.006464962 -0.006464962 -0.012929924 0.000000000
sum over m -0.023939703 -0.023939703 -0.047879406 0.000000000
sum over m+mul 2.329736440 2.329736440 4.659472880 0.000000000
d3z^2-r^2 0 -0.006389678 -0.006389678 -0.012779356 0.000000000
dx^2-y^2 0 -0.005060152 -0.005060152 -0.010120305 0.000000000
dxy 0 -0.005433238 -0.005433238 -0.010866475 0.000000000
dxz 0 -0.006934550 -0.006934550 -0.013869101 0.000000000
dyz 0 -0.006932198 -0.006932198 -0.013864396 0.000000000
sum over m -0.030749817 -0.030749817 -0.061499633 0.000000000
sum over m+mul -0.030749817 -0.030749817 -0.061499633 0.000000000
586 O Up spin Down spin Sum Diff
multiple
s 0 0.893902719 0.893902719 1.787805438 0.000000000
sum over m 0.893902719 0.893902719 1.787805438 0.000000000
s 1 -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m+mul 0.890860394 0.890860394 1.781720789 0.000000000
px 0 0.787071019 0.787071019 1.574142038 0.000000000
py 0 0.786877452 0.786877452 1.573754904 0.000000000
pz 0 0.779782974 0.779782974 1.559565948 0.000000000
sum over m 2.353731445 2.353731445 4.707462890 0.000000000
px 1 -0.008744038 -0.008744038 -0.017488076 0.000000000
py 1 -0.008738305 -0.008738305 -0.017476611 0.000000000
pz 1 -0.006462860 -0.006462860 -0.012925721 0.000000000
sum over m -0.023945204 -0.023945204 -0.047890408 0.000000000
sum over m+mul 2.329786241 2.329786241 4.659572482 0.000000000
d3z^2-r^2 0 -0.006390819 -0.006390819 -0.012781637 0.000000000
dx^2-y^2 0 -0.005058326 -0.005058326 -0.010116653 0.000000000
dxy 0 -0.005435279 -0.005435279 -0.010870557 0.000000000
dxz 0 -0.006928893 -0.006928893 -0.013857785 0.000000000
dyz 0 -0.006933211 -0.006933211 -0.013866423 0.000000000
sum over m -0.030746527 -0.030746527 -0.061493055 0.000000000
sum over m+mul -0.030746527 -0.030746527 -0.061493055 0.000000000
587 O Up spin Down spin Sum Diff
multiple
s 0 0.893885965 0.893885965 1.787771930 0.000000000
sum over m 0.893885965 0.893885965 1.787771930 0.000000000
s 1 -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m+mul 0.890843481 0.890843481 1.781686962 0.000000000
px 0 0.786888859 0.786888859 1.573777718 0.000000000
py 0 0.786986432 0.786986432 1.573972864 0.000000000
pz 0 0.779817968 0.779817968 1.559635936 0.000000000
sum over m 2.353693259 2.353693259 4.707386519 0.000000000
px 1 -0.008737548 -0.008737548 -0.017475095 0.000000000
py 1 -0.008740182 -0.008740182 -0.017480364 0.000000000
pz 1 -0.006464629 -0.006464629 -0.012929258 0.000000000
sum over m -0.023942358 -0.023942358 -0.047884717 0.000000000
sum over m+mul 2.329750901 2.329750901 4.659501802 0.000000000
d3z^2-r^2 0 -0.006390490 -0.006390490 -0.012780980 0.000000000
dx^2-y^2 0 -0.005059495 -0.005059495 -0.010118990 0.000000000
dxy 0 -0.005434167 -0.005434167 -0.010868334 0.000000000
dxz 0 -0.006933943 -0.006933943 -0.013867886 0.000000000
dyz 0 -0.006932257 -0.006932257 -0.013864513 0.000000000
sum over m -0.030750352 -0.030750352 -0.061500704 0.000000000
sum over m+mul -0.030750352 -0.030750352 -0.061500704 0.000000000
588 O Up spin Down spin Sum Diff
multiple
s 0 0.893912541 0.893912541 1.787825082 0.000000000
sum over m 0.893912541 0.893912541 1.787825082 0.000000000
s 1 -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m+mul 0.890869972 0.890869972 1.781739944 0.000000000
px 0 0.787071176 0.787071176 1.574142353 0.000000000
py 0 0.787021575 0.787021575 1.574043151 0.000000000
pz 0 0.779696459 0.779696459 1.559392918 0.000000000
sum over m 2.353789211 2.353789211 4.707578421 0.000000000
px 1 -0.008735385 -0.008735385 -0.017470771 0.000000000
py 1 -0.008734448 -0.008734448 -0.017468896 0.000000000
pz 1 -0.006455985 -0.006455985 -0.012911971 0.000000000
sum over m -0.023925819 -0.023925819 -0.047851637 0.000000000
sum over m+mul 2.329863392 2.329863392 4.659726784 0.000000000
d3z^2-r^2 0 -0.006390385 -0.006390385 -0.012780770 0.000000000
dx^2-y^2 0 -0.005053856 -0.005053856 -0.010107711 0.000000000
dxy 0 -0.005436296 -0.005436296 -0.010872593 0.000000000
dxz 0 -0.006924533 -0.006924533 -0.013849065 0.000000000
dyz 0 -0.006927057 -0.006927057 -0.013854115 0.000000000
sum over m -0.030732127 -0.030732127 -0.061464253 0.000000000
sum over m+mul -0.030732127 -0.030732127 -0.061464253 0.000000000
589 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000754531 1.000754531 2.001509062 0.000000000
sum over m 1.000754531 1.000754531 2.001509062 0.000000000
s 1 0.207411818 0.207411818 0.414823636 0.000000000
sum over m 0.207411818 0.207411818 0.414823636 0.000000000
s 2 0.014724175 0.014724175 0.029448350 0.000000000
sum over m 0.014724175 0.014724175 0.029448350 0.000000000
sum over m+mul 1.222890524 1.222890524 2.445781048 0.000000000
px 0 1.006397581 1.006397581 2.012795162 0.000000000
py 0 1.006383481 1.006383481 2.012766962 0.000000000
pz 0 1.006194369 1.006194369 2.012388738 0.000000000
sum over m 3.018975431 3.018975431 6.037950862 0.000000000
px 1 0.065420473 0.065420473 0.130840947 0.000000000
py 1 0.065410391 0.065410391 0.130820782 0.000000000
pz 1 0.040382927 0.040382927 0.080765854 0.000000000
sum over m 0.171213792 0.171213792 0.342427584 0.000000000
sum over m+mul 3.190189223 3.190189223 6.380378445 0.000000000
d3z^2-r^2 0 0.196288897 0.196288897 0.392577793 0.000000000
dx^2-y^2 0 0.201525016 0.201525016 0.403050032 0.000000000
dxy 0 0.250915966 0.250915966 0.501831931 0.000000000
dxz 0 0.268508678 0.268508678 0.537017356 0.000000000
dyz 0 0.268517838 0.268517838 0.537035675 0.000000000
sum over m 1.185756394 1.185756394 2.371512788 0.000000000
d3z^2-r^2 1 0.003474672 0.003474672 0.006949344 0.000000000
dx^2-y^2 1 -0.004474966 -0.004474966 -0.008949931 0.000000000
dxy 1 0.015340900 0.015340900 0.030681800 0.000000000
dxz 1 0.003487410 0.003487410 0.006974819 0.000000000
dyz 1 0.003486522 0.003486522 0.006973045 0.000000000
sum over m 0.021314538 0.021314538 0.042629076 0.000000000
sum over m+mul 1.207070932 1.207070932 2.414141864 0.000000000
590 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758742 1.000758742 2.001517485 0.000000000
sum over m 1.000758742 1.000758742 2.001517485 0.000000000
s 1 0.207414910 0.207414910 0.414829820 0.000000000
sum over m 0.207414910 0.207414910 0.414829820 0.000000000
s 2 0.014725535 0.014725535 0.029451070 0.000000000
sum over m 0.014725535 0.014725535 0.029451070 0.000000000
sum over m+mul 1.222899188 1.222899188 2.445798375 0.000000000
px 0 1.006372704 1.006372704 2.012745408 0.000000000
py 0 1.006384943 1.006384943 2.012769885 0.000000000
pz 0 1.006196973 1.006196973 2.012393946 0.000000000
sum over m 3.018954620 3.018954620 6.037909239 0.000000000
px 1 0.065439817 0.065439817 0.130879633 0.000000000
py 1 0.065431299 0.065431299 0.130862598 0.000000000
pz 1 0.040384285 0.040384285 0.080768571 0.000000000
sum over m 0.171255401 0.171255401 0.342510802 0.000000000
sum over m+mul 3.190210021 3.190210021 6.380420042 0.000000000
d3z^2-r^2 0 0.196319114 0.196319114 0.392638228 0.000000000
dx^2-y^2 0 0.201523316 0.201523316 0.403046632 0.000000000
dxy 0 0.250932370 0.250932370 0.501864739 0.000000000
dxz 0 0.268505638 0.268505638 0.537011276 0.000000000
dyz 0 0.268496820 0.268496820 0.536993639 0.000000000
sum over m 1.185777257 1.185777257 2.371554514 0.000000000
d3z^2-r^2 1 0.003478698 0.003478698 0.006957395 0.000000000
dx^2-y^2 1 -0.004474298 -0.004474298 -0.008948596 0.000000000
dxy 1 0.015342454 0.015342454 0.030684909 0.000000000
dxz 1 0.003497584 0.003497584 0.006995168 0.000000000
dyz 1 0.003496402 0.003496402 0.006992803 0.000000000
sum over m 0.021340839 0.021340839 0.042681678 0.000000000
sum over m+mul 1.207118096 1.207118096 2.414236192 0.000000000
591 O Up spin Down spin Sum Diff
multiple
s 0 0.893905933 0.893905933 1.787811867 0.000000000
sum over m 0.893905933 0.893905933 1.787811867 0.000000000
s 1 -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m+mul 0.890863858 0.890863858 1.781727717 0.000000000
px 0 0.786822811 0.786822811 1.573645622 0.000000000
py 0 0.787143494 0.787143494 1.574286988 0.000000000
pz 0 0.779781122 0.779781122 1.559562245 0.000000000
sum over m 2.353747427 2.353747427 4.707494855 0.000000000
px 1 -0.008735009 -0.008735009 -0.017470018 0.000000000
py 1 -0.008746988 -0.008746988 -0.017493976 0.000000000
pz 1 -0.006461732 -0.006461732 -0.012923463 0.000000000
sum over m -0.023943729 -0.023943729 -0.047887457 0.000000000
sum over m+mul 2.329803699 2.329803699 4.659607398 0.000000000
d3z^2-r^2 0 -0.006391211 -0.006391211 -0.012782421 0.000000000
dx^2-y^2 0 -0.005058570 -0.005058570 -0.010117140 0.000000000
dxy 0 -0.005434801 -0.005434801 -0.010869602 0.000000000
dxz 0 -0.006933434 -0.006933434 -0.013866868 0.000000000
dyz 0 -0.006926741 -0.006926741 -0.013853482 0.000000000
sum over m -0.030744757 -0.030744757 -0.061489514 0.000000000
sum over m+mul -0.030744757 -0.030744757 -0.061489514 0.000000000
592 O Up spin Down spin Sum Diff
multiple
s 0 0.893886844 0.893886844 1.787773688 0.000000000
sum over m 0.893886844 0.893886844 1.787773688 0.000000000
s 1 -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m+mul 0.890844535 0.890844535 1.781689070 0.000000000
px 0 0.787087238 0.787087238 1.574174475 0.000000000
py 0 0.786825603 0.786825603 1.573651205 0.000000000
pz 0 0.779800672 0.779800672 1.559601343 0.000000000
sum over m 2.353713512 2.353713512 4.707427024 0.000000000
px 1 -0.008741148 -0.008741148 -0.017482296 0.000000000
py 1 -0.008737361 -0.008737361 -0.017474723 0.000000000
pz 1 -0.006464051 -0.006464051 -0.012928103 0.000000000
sum over m -0.023942561 -0.023942561 -0.047885121 0.000000000
sum over m+mul 2.329770951 2.329770951 4.659541903 0.000000000
d3z^2-r^2 0 -0.006390264 -0.006390264 -0.012780529 0.000000000
dx^2-y^2 0 -0.005059183 -0.005059183 -0.010118366 0.000000000
dxy 0 -0.005433461 -0.005433461 -0.010866922 0.000000000
dxz 0 -0.006928949 -0.006928949 -0.013857898 0.000000000
dyz 0 -0.006932932 -0.006932932 -0.013865865 0.000000000
sum over m -0.030744789 -0.030744789 -0.061489578 0.000000000
sum over m+mul -0.030744789 -0.030744789 -0.061489578 0.000000000
593 O Up spin Down spin Sum Diff
multiple
s 0 0.893853134 0.893853134 1.787706267 0.000000000
sum over m 0.893853134 0.893853134 1.787706267 0.000000000
s 1 -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m+mul 0.890810709 0.890810709 1.781621419 0.000000000
px 0 0.786921166 0.786921166 1.573842332 0.000000000
py 0 0.786858059 0.786858059 1.573716119 0.000000000
pz 0 0.779871468 0.779871468 1.559742936 0.000000000
sum over m 2.353650694 2.353650694 4.707301387 0.000000000
px 1 -0.008736407 -0.008736407 -0.017472815 0.000000000
py 1 -0.008736997 -0.008736997 -0.017473994 0.000000000
pz 1 -0.006466568 -0.006466568 -0.012933136 0.000000000
sum over m -0.023939972 -0.023939972 -0.047879944 0.000000000
sum over m+mul 2.329710722 2.329710722 4.659421443 0.000000000
d3z^2-r^2 0 -0.006389349 -0.006389349 -0.012778697 0.000000000
dx^2-y^2 0 -0.005061152 -0.005061152 -0.010122305 0.000000000
dxy 0 -0.005431835 -0.005431835 -0.010863669 0.000000000
dxz 0 -0.006934510 -0.006934510 -0.013869019 0.000000000
dyz 0 -0.006935035 -0.006935035 -0.013870070 0.000000000
sum over m -0.030751880 -0.030751880 -0.061503761 0.000000000
sum over m+mul -0.030751880 -0.030751880 -0.061503761 0.000000000
594 O Up spin Down spin Sum Diff
multiple
s 0 0.893907585 0.893907585 1.787815171 0.000000000
sum over m 0.893907585 0.893907585 1.787815171 0.000000000
s 1 -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m+mul 0.890865012 0.890865012 1.781730024 0.000000000
px 0 0.787047565 0.787047565 1.574095129 0.000000000
py 0 0.787044942 0.787044942 1.574089885 0.000000000
pz 0 0.779681977 0.779681977 1.559363955 0.000000000
sum over m 2.353774484 2.353774484 4.707548969 0.000000000
px 1 -0.008730546 -0.008730546 -0.017461092 0.000000000
py 1 -0.008732352 -0.008732352 -0.017464704 0.000000000
pz 1 -0.006453076 -0.006453076 -0.012906152 0.000000000
sum over m -0.023915974 -0.023915974 -0.047831948 0.000000000
sum over m+mul 2.329858510 2.329858510 4.659717020 0.000000000
d3z^2-r^2 0 -0.006390178 -0.006390178 -0.012780355 0.000000000
dx^2-y^2 0 -0.005052335 -0.005052335 -0.010104670 0.000000000
dxy 0 -0.005435478 -0.005435478 -0.010870956 0.000000000
dxz 0 -0.006924277 -0.006924277 -0.013848555 0.000000000
dyz 0 -0.006923240 -0.006923240 -0.013846479 0.000000000
sum over m -0.030725507 -0.030725507 -0.061451015 0.000000000
sum over m+mul -0.030725507 -0.030725507 -0.061451015 0.000000000
595 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000754531 1.000754531 2.001509062 0.000000000
sum over m 1.000754531 1.000754531 2.001509062 0.000000000
s 1 0.207411818 0.207411818 0.414823636 0.000000000
sum over m 0.207411818 0.207411818 0.414823636 0.000000000
s 2 0.014724175 0.014724175 0.029448350 0.000000000
sum over m 0.014724175 0.014724175 0.029448350 0.000000000
sum over m+mul 1.222890524 1.222890524 2.445781048 0.000000000
px 0 1.006397581 1.006397581 2.012795162 0.000000000
py 0 1.006383481 1.006383481 2.012766962 0.000000000
pz 0 1.006194369 1.006194369 2.012388738 0.000000000
sum over m 3.018975431 3.018975431 6.037950862 0.000000000
px 1 0.065420474 0.065420474 0.130840947 0.000000000
py 1 0.065410391 0.065410391 0.130820783 0.000000000
pz 1 0.040382927 0.040382927 0.080765853 0.000000000
sum over m 0.171213792 0.171213792 0.342427583 0.000000000
sum over m+mul 3.190189222 3.190189222 6.380378445 0.000000000
d3z^2-r^2 0 0.196288897 0.196288897 0.392577794 0.000000000
dx^2-y^2 0 0.201525016 0.201525016 0.403050033 0.000000000
dxy 0 0.250915966 0.250915966 0.501831931 0.000000000
dxz 0 0.268508678 0.268508678 0.537017356 0.000000000
dyz 0 0.268517837 0.268517837 0.537035675 0.000000000
sum over m 1.185756394 1.185756394 2.371512789 0.000000000
d3z^2-r^2 1 0.003474672 0.003474672 0.006949344 0.000000000
dx^2-y^2 1 -0.004474966 -0.004474966 -0.008949931 0.000000000
dxy 1 0.015340900 0.015340900 0.030681800 0.000000000
dxz 1 0.003487410 0.003487410 0.006974819 0.000000000
dyz 1 0.003486522 0.003486522 0.006973045 0.000000000
sum over m 0.021314538 0.021314538 0.042629076 0.000000000
sum over m+mul 1.207070932 1.207070932 2.414141865 0.000000000
596 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758742 1.000758742 2.001517485 0.000000000
sum over m 1.000758742 1.000758742 2.001517485 0.000000000
s 1 0.207414910 0.207414910 0.414829820 0.000000000
sum over m 0.207414910 0.207414910 0.414829820 0.000000000
s 2 0.014725535 0.014725535 0.029451070 0.000000000
sum over m 0.014725535 0.014725535 0.029451070 0.000000000
sum over m+mul 1.222899188 1.222899188 2.445798375 0.000000000
px 0 1.006372704 1.006372704 2.012745408 0.000000000
py 0 1.006384943 1.006384943 2.012769885 0.000000000
pz 0 1.006196973 1.006196973 2.012393946 0.000000000
sum over m 3.018954620 3.018954620 6.037909239 0.000000000
px 1 0.065439816 0.065439816 0.130879633 0.000000000
py 1 0.065431299 0.065431299 0.130862598 0.000000000
pz 1 0.040384285 0.040384285 0.080768571 0.000000000
sum over m 0.171255401 0.171255401 0.342510802 0.000000000
sum over m+mul 3.190210021 3.190210021 6.380420042 0.000000000
d3z^2-r^2 0 0.196319114 0.196319114 0.392638228 0.000000000
dx^2-y^2 0 0.201523316 0.201523316 0.403046631 0.000000000
dxy 0 0.250932369 0.250932369 0.501864738 0.000000000
dxz 0 0.268505638 0.268505638 0.537011276 0.000000000
dyz 0 0.268496820 0.268496820 0.536993639 0.000000000
sum over m 1.185777256 1.185777256 2.371554512 0.000000000
d3z^2-r^2 1 0.003478698 0.003478698 0.006957395 0.000000000
dx^2-y^2 1 -0.004474298 -0.004474298 -0.008948596 0.000000000
dxy 1 0.015342454 0.015342454 0.030684909 0.000000000
dxz 1 0.003497584 0.003497584 0.006995168 0.000000000
dyz 1 0.003496402 0.003496402 0.006992803 0.000000000
sum over m 0.021340839 0.021340839 0.042681678 0.000000000
sum over m+mul 1.207118095 1.207118095 2.414236190 0.000000000
597 O Up spin Down spin Sum Diff
multiple
s 0 0.893905933 0.893905933 1.787811867 0.000000000
sum over m 0.893905933 0.893905933 1.787811867 0.000000000
s 1 -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m+mul 0.890863858 0.890863858 1.781727717 0.000000000
px 0 0.786822811 0.786822811 1.573645622 0.000000000
py 0 0.787143494 0.787143494 1.574286988 0.000000000
pz 0 0.779781122 0.779781122 1.559562245 0.000000000
sum over m 2.353747427 2.353747427 4.707494854 0.000000000
px 1 -0.008735009 -0.008735009 -0.017470018 0.000000000
py 1 -0.008746988 -0.008746988 -0.017493976 0.000000000
pz 1 -0.006461732 -0.006461732 -0.012923463 0.000000000
sum over m -0.023943729 -0.023943729 -0.047887457 0.000000000
sum over m+mul 2.329803698 2.329803698 4.659607397 0.000000000
d3z^2-r^2 0 -0.006391211 -0.006391211 -0.012782421 0.000000000
dx^2-y^2 0 -0.005058570 -0.005058570 -0.010117140 0.000000000
dxy 0 -0.005434801 -0.005434801 -0.010869602 0.000000000
dxz 0 -0.006933434 -0.006933434 -0.013866868 0.000000000
dyz 0 -0.006926741 -0.006926741 -0.013853482 0.000000000
sum over m -0.030744757 -0.030744757 -0.061489514 0.000000000
sum over m+mul -0.030744757 -0.030744757 -0.061489514 0.000000000
598 O Up spin Down spin Sum Diff
multiple
s 0 0.893886844 0.893886844 1.787773688 0.000000000
sum over m 0.893886844 0.893886844 1.787773688 0.000000000
s 1 -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m+mul 0.890844535 0.890844535 1.781689070 0.000000000
px 0 0.787087238 0.787087238 1.574174476 0.000000000
py 0 0.786825603 0.786825603 1.573651206 0.000000000
pz 0 0.779800671 0.779800671 1.559601343 0.000000000
sum over m 2.353713512 2.353713512 4.707427024 0.000000000
px 1 -0.008741148 -0.008741148 -0.017482296 0.000000000
py 1 -0.008737361 -0.008737361 -0.017474723 0.000000000
pz 1 -0.006464051 -0.006464051 -0.012928103 0.000000000
sum over m -0.023942561 -0.023942561 -0.047885121 0.000000000
sum over m+mul 2.329770952 2.329770952 4.659541903 0.000000000
d3z^2-r^2 0 -0.006390264 -0.006390264 -0.012780528 0.000000000
dx^2-y^2 0 -0.005059183 -0.005059183 -0.010118366 0.000000000
dxy 0 -0.005433461 -0.005433461 -0.010866922 0.000000000
dxz 0 -0.006928949 -0.006928949 -0.013857898 0.000000000
dyz 0 -0.006932932 -0.006932932 -0.013865865 0.000000000
sum over m -0.030744789 -0.030744789 -0.061489578 0.000000000
sum over m+mul -0.030744789 -0.030744789 -0.061489578 0.000000000
599 O Up spin Down spin Sum Diff
multiple
s 0 0.893853134 0.893853134 1.787706267 0.000000000
sum over m 0.893853134 0.893853134 1.787706267 0.000000000
s 1 -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m+mul 0.890810709 0.890810709 1.781621419 0.000000000
px 0 0.786921167 0.786921167 1.573842333 0.000000000
py 0 0.786858059 0.786858059 1.573716118 0.000000000
pz 0 0.779871468 0.779871468 1.559742937 0.000000000
sum over m 2.353650694 2.353650694 4.707301388 0.000000000
px 1 -0.008736407 -0.008736407 -0.017472815 0.000000000
py 1 -0.008736997 -0.008736997 -0.017473994 0.000000000
pz 1 -0.006466568 -0.006466568 -0.012933136 0.000000000
sum over m -0.023939972 -0.023939972 -0.047879944 0.000000000
sum over m+mul 2.329710722 2.329710722 4.659421444 0.000000000
d3z^2-r^2 0 -0.006389349 -0.006389349 -0.012778697 0.000000000
dx^2-y^2 0 -0.005061152 -0.005061152 -0.010122305 0.000000000
dxy 0 -0.005431835 -0.005431835 -0.010863669 0.000000000
dxz 0 -0.006934510 -0.006934510 -0.013869019 0.000000000
dyz 0 -0.006935035 -0.006935035 -0.013870070 0.000000000
sum over m -0.030751880 -0.030751880 -0.061503761 0.000000000
sum over m+mul -0.030751880 -0.030751880 -0.061503761 0.000000000
600 O Up spin Down spin Sum Diff
multiple
s 0 0.893907586 0.893907586 1.787815171 0.000000000
sum over m 0.893907586 0.893907586 1.787815171 0.000000000
s 1 -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m+mul 0.890865012 0.890865012 1.781730025 0.000000000
px 0 0.787047565 0.787047565 1.574095130 0.000000000
py 0 0.787044942 0.787044942 1.574089885 0.000000000
pz 0 0.779681977 0.779681977 1.559363955 0.000000000
sum over m 2.353774485 2.353774485 4.707548969 0.000000000
px 1 -0.008730546 -0.008730546 -0.017461092 0.000000000
py 1 -0.008732352 -0.008732352 -0.017464704 0.000000000
pz 1 -0.006453076 -0.006453076 -0.012906152 0.000000000
sum over m -0.023915974 -0.023915974 -0.047831948 0.000000000
sum over m+mul 2.329858510 2.329858510 4.659717021 0.000000000
d3z^2-r^2 0 -0.006390178 -0.006390178 -0.012780355 0.000000000
dx^2-y^2 0 -0.005052335 -0.005052335 -0.010104670 0.000000000
dxy 0 -0.005435478 -0.005435478 -0.010870956 0.000000000
dxz 0 -0.006924277 -0.006924277 -0.013848555 0.000000000
dyz 0 -0.006923240 -0.006923240 -0.013846479 0.000000000
sum over m -0.030725507 -0.030725507 -0.061451015 0.000000000
sum over m+mul -0.030725507 -0.030725507 -0.061451015 0.000000000
601 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000754531 1.000754531 2.001509062 0.000000000
sum over m 1.000754531 1.000754531 2.001509062 0.000000000
s 1 0.207411818 0.207411818 0.414823636 0.000000000
sum over m 0.207411818 0.207411818 0.414823636 0.000000000
s 2 0.014724175 0.014724175 0.029448350 0.000000000
sum over m 0.014724175 0.014724175 0.029448350 0.000000000
sum over m+mul 1.222890524 1.222890524 2.445781048 0.000000000
px 0 1.006397581 1.006397581 2.012795162 0.000000000
py 0 1.006383481 1.006383481 2.012766962 0.000000000
pz 0 1.006194369 1.006194369 2.012388738 0.000000000
sum over m 3.018975431 3.018975431 6.037950862 0.000000000
px 1 0.065420474 0.065420474 0.130840947 0.000000000
py 1 0.065410391 0.065410391 0.130820783 0.000000000
pz 1 0.040382927 0.040382927 0.080765854 0.000000000
sum over m 0.171213792 0.171213792 0.342427584 0.000000000
sum over m+mul 3.190189223 3.190189223 6.380378446 0.000000000
d3z^2-r^2 0 0.196288897 0.196288897 0.392577794 0.000000000
dx^2-y^2 0 0.201525017 0.201525017 0.403050033 0.000000000
dxy 0 0.250915966 0.250915966 0.501831931 0.000000000
dxz 0 0.268508678 0.268508678 0.537017356 0.000000000
dyz 0 0.268517838 0.268517838 0.537035675 0.000000000
sum over m 1.185756395 1.185756395 2.371512790 0.000000000
d3z^2-r^2 1 0.003474672 0.003474672 0.006949344 0.000000000
dx^2-y^2 1 -0.004474966 -0.004474966 -0.008949931 0.000000000
dxy 1 0.015340900 0.015340900 0.030681800 0.000000000
dxz 1 0.003487410 0.003487410 0.006974819 0.000000000
dyz 1 0.003486522 0.003486522 0.006973045 0.000000000
sum over m 0.021314538 0.021314538 0.042629076 0.000000000
sum over m+mul 1.207070933 1.207070933 2.414141866 0.000000000
602 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758742 1.000758742 2.001517485 0.000000000
sum over m 1.000758742 1.000758742 2.001517485 0.000000000
s 1 0.207414910 0.207414910 0.414829819 0.000000000
sum over m 0.207414910 0.207414910 0.414829819 0.000000000
s 2 0.014725535 0.014725535 0.029451070 0.000000000
sum over m 0.014725535 0.014725535 0.029451070 0.000000000
sum over m+mul 1.222899187 1.222899187 2.445798374 0.000000000
px 0 1.006372704 1.006372704 2.012745408 0.000000000
py 0 1.006384943 1.006384943 2.012769885 0.000000000
pz 0 1.006196973 1.006196973 2.012393946 0.000000000
sum over m 3.018954620 3.018954620 6.037909239 0.000000000
px 1 0.065439817 0.065439817 0.130879633 0.000000000
py 1 0.065431300 0.065431300 0.130862599 0.000000000
pz 1 0.040384285 0.040384285 0.080768571 0.000000000
sum over m 0.171255402 0.171255402 0.342510803 0.000000000
sum over m+mul 3.190210021 3.190210021 6.380420042 0.000000000
d3z^2-r^2 0 0.196319114 0.196319114 0.392638228 0.000000000
dx^2-y^2 0 0.201523316 0.201523316 0.403046632 0.000000000
dxy 0 0.250932369 0.250932369 0.501864739 0.000000000
dxz 0 0.268505638 0.268505638 0.537011276 0.000000000
dyz 0 0.268496820 0.268496820 0.536993639 0.000000000
sum over m 1.185777256 1.185777256 2.371554513 0.000000000
d3z^2-r^2 1 0.003478698 0.003478698 0.006957395 0.000000000
dx^2-y^2 1 -0.004474298 -0.004474298 -0.008948596 0.000000000
dxy 1 0.015342454 0.015342454 0.030684909 0.000000000
dxz 1 0.003497584 0.003497584 0.006995168 0.000000000
dyz 1 0.003496402 0.003496402 0.006992803 0.000000000
sum over m 0.021340839 0.021340839 0.042681678 0.000000000
sum over m+mul 1.207118096 1.207118096 2.414236191 0.000000000
603 O Up spin Down spin Sum Diff
multiple
s 0 0.893905933 0.893905933 1.787811867 0.000000000
sum over m 0.893905933 0.893905933 1.787811867 0.000000000
s 1 -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m+mul 0.890863858 0.890863858 1.781727717 0.000000000
px 0 0.786822811 0.786822811 1.573645621 0.000000000
py 0 0.787143494 0.787143494 1.574286987 0.000000000
pz 0 0.779781123 0.779781123 1.559562245 0.000000000
sum over m 2.353747427 2.353747427 4.707494854 0.000000000
px 1 -0.008735009 -0.008735009 -0.017470018 0.000000000
py 1 -0.008746988 -0.008746988 -0.017493976 0.000000000
pz 1 -0.006461732 -0.006461732 -0.012923463 0.000000000
sum over m -0.023943729 -0.023943729 -0.047887457 0.000000000
sum over m+mul 2.329803698 2.329803698 4.659607397 0.000000000
d3z^2-r^2 0 -0.006391211 -0.006391211 -0.012782421 0.000000000
dx^2-y^2 0 -0.005058570 -0.005058570 -0.010117141 0.000000000
dxy 0 -0.005434801 -0.005434801 -0.010869602 0.000000000
dxz 0 -0.006933434 -0.006933434 -0.013866868 0.000000000
dyz 0 -0.006926741 -0.006926741 -0.013853482 0.000000000
sum over m -0.030744757 -0.030744757 -0.061489514 0.000000000
sum over m+mul -0.030744757 -0.030744757 -0.061489514 0.000000000
604 O Up spin Down spin Sum Diff
multiple
s 0 0.893886844 0.893886844 1.787773688 0.000000000
sum over m 0.893886844 0.893886844 1.787773688 0.000000000
s 1 -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m+mul 0.890844535 0.890844535 1.781689070 0.000000000
px 0 0.787087238 0.787087238 1.574174476 0.000000000
py 0 0.786825603 0.786825603 1.573651206 0.000000000
pz 0 0.779800671 0.779800671 1.559601343 0.000000000
sum over m 2.353713512 2.353713512 4.707427024 0.000000000
px 1 -0.008741148 -0.008741148 -0.017482296 0.000000000
py 1 -0.008737361 -0.008737361 -0.017474723 0.000000000
pz 1 -0.006464051 -0.006464051 -0.012928103 0.000000000
sum over m -0.023942561 -0.023942561 -0.047885121 0.000000000
sum over m+mul 2.329770952 2.329770952 4.659541903 0.000000000
d3z^2-r^2 0 -0.006390264 -0.006390264 -0.012780529 0.000000000
dx^2-y^2 0 -0.005059183 -0.005059183 -0.010118366 0.000000000
dxy 0 -0.005433461 -0.005433461 -0.010866922 0.000000000
dxz 0 -0.006928949 -0.006928949 -0.013857898 0.000000000
dyz 0 -0.006932932 -0.006932932 -0.013865865 0.000000000
sum over m -0.030744789 -0.030744789 -0.061489578 0.000000000
sum over m+mul -0.030744789 -0.030744789 -0.061489578 0.000000000
605 O Up spin Down spin Sum Diff
multiple
s 0 0.893853134 0.893853134 1.787706267 0.000000000
sum over m 0.893853134 0.893853134 1.787706267 0.000000000
s 1 -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m+mul 0.890810709 0.890810709 1.781621419 0.000000000
px 0 0.786921167 0.786921167 1.573842333 0.000000000
py 0 0.786858059 0.786858059 1.573716118 0.000000000
pz 0 0.779871469 0.779871469 1.559742937 0.000000000
sum over m 2.353650694 2.353650694 4.707301388 0.000000000
px 1 -0.008736407 -0.008736407 -0.017472815 0.000000000
py 1 -0.008736997 -0.008736997 -0.017473994 0.000000000
pz 1 -0.006466568 -0.006466568 -0.012933136 0.000000000
sum over m -0.023939972 -0.023939972 -0.047879944 0.000000000
sum over m+mul 2.329710722 2.329710722 4.659421444 0.000000000
d3z^2-r^2 0 -0.006389349 -0.006389349 -0.012778697 0.000000000
dx^2-y^2 0 -0.005061152 -0.005061152 -0.010122305 0.000000000
dxy 0 -0.005431835 -0.005431835 -0.010863669 0.000000000
dxz 0 -0.006934510 -0.006934510 -0.013869019 0.000000000
dyz 0 -0.006935035 -0.006935035 -0.013870070 0.000000000
sum over m -0.030751880 -0.030751880 -0.061503761 0.000000000
sum over m+mul -0.030751880 -0.030751880 -0.061503761 0.000000000
606 O Up spin Down spin Sum Diff
multiple
s 0 0.893907585 0.893907585 1.787815171 0.000000000
sum over m 0.893907585 0.893907585 1.787815171 0.000000000
s 1 -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m+mul 0.890865012 0.890865012 1.781730024 0.000000000
px 0 0.787047565 0.787047565 1.574095130 0.000000000
py 0 0.787044942 0.787044942 1.574089885 0.000000000
pz 0 0.779681978 0.779681978 1.559363955 0.000000000
sum over m 2.353774485 2.353774485 4.707548969 0.000000000
px 1 -0.008730546 -0.008730546 -0.017461092 0.000000000
py 1 -0.008732352 -0.008732352 -0.017464704 0.000000000
pz 1 -0.006453076 -0.006453076 -0.012906152 0.000000000
sum over m -0.023915974 -0.023915974 -0.047831948 0.000000000
sum over m+mul 2.329858510 2.329858510 4.659717021 0.000000000
d3z^2-r^2 0 -0.006390178 -0.006390178 -0.012780355 0.000000000
dx^2-y^2 0 -0.005052335 -0.005052335 -0.010104670 0.000000000
dxy 0 -0.005435478 -0.005435478 -0.010870956 0.000000000
dxz 0 -0.006924277 -0.006924277 -0.013848555 0.000000000
dyz 0 -0.006923240 -0.006923240 -0.013846479 0.000000000
sum over m -0.030725507 -0.030725507 -0.061451015 0.000000000
sum over m+mul -0.030725507 -0.030725507 -0.061451015 0.000000000
607 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000754531 1.000754531 2.001509062 0.000000000
sum over m 1.000754531 1.000754531 2.001509062 0.000000000
s 1 0.207411818 0.207411818 0.414823636 0.000000000
sum over m 0.207411818 0.207411818 0.414823636 0.000000000
s 2 0.014724175 0.014724175 0.029448350 0.000000000
sum over m 0.014724175 0.014724175 0.029448350 0.000000000
sum over m+mul 1.222890524 1.222890524 2.445781048 0.000000000
px 0 1.006397581 1.006397581 2.012795162 0.000000000
py 0 1.006383481 1.006383481 2.012766962 0.000000000
pz 0 1.006194369 1.006194369 2.012388738 0.000000000
sum over m 3.018975431 3.018975431 6.037950862 0.000000000
px 1 0.065420473 0.065420473 0.130840947 0.000000000
py 1 0.065410392 0.065410392 0.130820783 0.000000000
pz 1 0.040382927 0.040382927 0.080765854 0.000000000
sum over m 0.171213792 0.171213792 0.342427584 0.000000000
sum over m+mul 3.190189223 3.190189223 6.380378446 0.000000000
d3z^2-r^2 0 0.196288897 0.196288897 0.392577794 0.000000000
dx^2-y^2 0 0.201525016 0.201525016 0.403050032 0.000000000
dxy 0 0.250915966 0.250915966 0.501831932 0.000000000
dxz 0 0.268508678 0.268508678 0.537017356 0.000000000
dyz 0 0.268517838 0.268517838 0.537035676 0.000000000
sum over m 1.185756394 1.185756394 2.371512789 0.000000000
d3z^2-r^2 1 0.003474672 0.003474672 0.006949344 0.000000000
dx^2-y^2 1 -0.004474966 -0.004474966 -0.008949932 0.000000000
dxy 1 0.015340900 0.015340900 0.030681800 0.000000000
dxz 1 0.003487410 0.003487410 0.006974819 0.000000000
dyz 1 0.003486522 0.003486522 0.006973045 0.000000000
sum over m 0.021314538 0.021314538 0.042629076 0.000000000
sum over m+mul 1.207070932 1.207070932 2.414141865 0.000000000
608 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758743 1.000758743 2.001517485 0.000000000
sum over m 1.000758743 1.000758743 2.001517485 0.000000000
s 1 0.207414910 0.207414910 0.414829820 0.000000000
sum over m 0.207414910 0.207414910 0.414829820 0.000000000
s 2 0.014725535 0.014725535 0.029451070 0.000000000
sum over m 0.014725535 0.014725535 0.029451070 0.000000000
sum over m+mul 1.222899188 1.222899188 2.445798375 0.000000000
px 0 1.006372704 1.006372704 2.012745408 0.000000000
py 0 1.006384943 1.006384943 2.012769885 0.000000000
pz 0 1.006196973 1.006196973 2.012393946 0.000000000
sum over m 3.018954620 3.018954620 6.037909239 0.000000000
px 1 0.065439817 0.065439817 0.130879633 0.000000000
py 1 0.065431299 0.065431299 0.130862598 0.000000000
pz 1 0.040384285 0.040384285 0.080768571 0.000000000
sum over m 0.171255401 0.171255401 0.342510802 0.000000000
sum over m+mul 3.190210021 3.190210021 6.380420041 0.000000000
d3z^2-r^2 0 0.196319114 0.196319114 0.392638228 0.000000000
dx^2-y^2 0 0.201523316 0.201523316 0.403046631 0.000000000
dxy 0 0.250932369 0.250932369 0.501864739 0.000000000
dxz 0 0.268505638 0.268505638 0.537011276 0.000000000
dyz 0 0.268496819 0.268496819 0.536993639 0.000000000
sum over m 1.185777256 1.185777256 2.371554513 0.000000000
d3z^2-r^2 1 0.003478698 0.003478698 0.006957395 0.000000000
dx^2-y^2 1 -0.004474298 -0.004474298 -0.008948596 0.000000000
dxy 1 0.015342454 0.015342454 0.030684909 0.000000000
dxz 1 0.003497584 0.003497584 0.006995168 0.000000000
dyz 1 0.003496402 0.003496402 0.006992803 0.000000000
sum over m 0.021340839 0.021340839 0.042681678 0.000000000
sum over m+mul 1.207118095 1.207118095 2.414236191 0.000000000
609 O Up spin Down spin Sum Diff
multiple
s 0 0.893905933 0.893905933 1.787811867 0.000000000
sum over m 0.893905933 0.893905933 1.787811867 0.000000000
s 1 -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m+mul 0.890863858 0.890863858 1.781727717 0.000000000
px 0 0.786822811 0.786822811 1.573645622 0.000000000
py 0 0.787143494 0.787143494 1.574286987 0.000000000
pz 0 0.779781123 0.779781123 1.559562245 0.000000000
sum over m 2.353747427 2.353747427 4.707494855 0.000000000
px 1 -0.008735009 -0.008735009 -0.017470018 0.000000000
py 1 -0.008746988 -0.008746988 -0.017493976 0.000000000
pz 1 -0.006461732 -0.006461732 -0.012923463 0.000000000
sum over m -0.023943729 -0.023943729 -0.047887457 0.000000000
sum over m+mul 2.329803699 2.329803699 4.659607398 0.000000000
d3z^2-r^2 0 -0.006391211 -0.006391211 -0.012782421 0.000000000
dx^2-y^2 0 -0.005058570 -0.005058570 -0.010117141 0.000000000
dxy 0 -0.005434801 -0.005434801 -0.010869602 0.000000000
dxz 0 -0.006933434 -0.006933434 -0.013866868 0.000000000
dyz 0 -0.006926741 -0.006926741 -0.013853482 0.000000000
sum over m -0.030744757 -0.030744757 -0.061489514 0.000000000
sum over m+mul -0.030744757 -0.030744757 -0.061489514 0.000000000
610 O Up spin Down spin Sum Diff
multiple
s 0 0.893886844 0.893886844 1.787773688 0.000000000
sum over m 0.893886844 0.893886844 1.787773688 0.000000000
s 1 -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m+mul 0.890844535 0.890844535 1.781689070 0.000000000
px 0 0.787087238 0.787087238 1.574174476 0.000000000
py 0 0.786825603 0.786825603 1.573651206 0.000000000
pz 0 0.779800671 0.779800671 1.559601343 0.000000000
sum over m 2.353713512 2.353713512 4.707427024 0.000000000
px 1 -0.008741148 -0.008741148 -0.017482296 0.000000000
py 1 -0.008737361 -0.008737361 -0.017474723 0.000000000
pz 1 -0.006464051 -0.006464051 -0.012928103 0.000000000
sum over m -0.023942561 -0.023942561 -0.047885121 0.000000000
sum over m+mul 2.329770951 2.329770951 4.659541903 0.000000000
d3z^2-r^2 0 -0.006390264 -0.006390264 -0.012780529 0.000000000
dx^2-y^2 0 -0.005059183 -0.005059183 -0.010118366 0.000000000
dxy 0 -0.005433461 -0.005433461 -0.010866922 0.000000000
dxz 0 -0.006928949 -0.006928949 -0.013857898 0.000000000
dyz 0 -0.006932932 -0.006932932 -0.013865865 0.000000000
sum over m -0.030744789 -0.030744789 -0.061489578 0.000000000
sum over m+mul -0.030744789 -0.030744789 -0.061489578 0.000000000
611 O Up spin Down spin Sum Diff
multiple
s 0 0.893853134 0.893853134 1.787706267 0.000000000
sum over m 0.893853134 0.893853134 1.787706267 0.000000000
s 1 -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m+mul 0.890810709 0.890810709 1.781621418 0.000000000
px 0 0.786921167 0.786921167 1.573842333 0.000000000
py 0 0.786858059 0.786858059 1.573716118 0.000000000
pz 0 0.779871468 0.779871468 1.559742937 0.000000000
sum over m 2.353650694 2.353650694 4.707301388 0.000000000
px 1 -0.008736407 -0.008736407 -0.017472815 0.000000000
py 1 -0.008736997 -0.008736997 -0.017473994 0.000000000
pz 1 -0.006466568 -0.006466568 -0.012933136 0.000000000
sum over m -0.023939972 -0.023939972 -0.047879944 0.000000000
sum over m+mul 2.329710722 2.329710722 4.659421444 0.000000000
d3z^2-r^2 0 -0.006389349 -0.006389349 -0.012778697 0.000000000
dx^2-y^2 0 -0.005061152 -0.005061152 -0.010122305 0.000000000
dxy 0 -0.005431835 -0.005431835 -0.010863669 0.000000000
dxz 0 -0.006934510 -0.006934510 -0.013869019 0.000000000
dyz 0 -0.006935035 -0.006935035 -0.013870070 0.000000000
sum over m -0.030751880 -0.030751880 -0.061503761 0.000000000
sum over m+mul -0.030751880 -0.030751880 -0.061503761 0.000000000
612 O Up spin Down spin Sum Diff
multiple
s 0 0.893907585 0.893907585 1.787815171 0.000000000
sum over m 0.893907585 0.893907585 1.787815171 0.000000000
s 1 -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m+mul 0.890865012 0.890865012 1.781730024 0.000000000
px 0 0.787047565 0.787047565 1.574095130 0.000000000
py 0 0.787044942 0.787044942 1.574089884 0.000000000
pz 0 0.779681977 0.779681977 1.559363955 0.000000000
sum over m 2.353774485 2.353774485 4.707548969 0.000000000
px 1 -0.008730546 -0.008730546 -0.017461092 0.000000000
py 1 -0.008732352 -0.008732352 -0.017464704 0.000000000
pz 1 -0.006453076 -0.006453076 -0.012906152 0.000000000
sum over m -0.023915974 -0.023915974 -0.047831948 0.000000000
sum over m+mul 2.329858510 2.329858510 4.659717021 0.000000000
d3z^2-r^2 0 -0.006390178 -0.006390178 -0.012780355 0.000000000
dx^2-y^2 0 -0.005052335 -0.005052335 -0.010104670 0.000000000
dxy 0 -0.005435478 -0.005435478 -0.010870956 0.000000000
dxz 0 -0.006924277 -0.006924277 -0.013848555 0.000000000
dyz 0 -0.006923240 -0.006923240 -0.013846479 0.000000000
sum over m -0.030725507 -0.030725507 -0.061451015 0.000000000
sum over m+mul -0.030725507 -0.030725507 -0.061451015 0.000000000
613 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000754531 1.000754531 2.001509062 0.000000000
sum over m 1.000754531 1.000754531 2.001509062 0.000000000
s 1 0.207411818 0.207411818 0.414823636 0.000000000
sum over m 0.207411818 0.207411818 0.414823636 0.000000000
s 2 0.014724175 0.014724175 0.029448350 0.000000000
sum over m 0.014724175 0.014724175 0.029448350 0.000000000
sum over m+mul 1.222890524 1.222890524 2.445781048 0.000000000
px 0 1.006397581 1.006397581 2.012795162 0.000000000
py 0 1.006383481 1.006383481 2.012766962 0.000000000
pz 0 1.006194369 1.006194369 2.012388738 0.000000000
sum over m 3.018975431 3.018975431 6.037950862 0.000000000
px 1 0.065420473 0.065420473 0.130840947 0.000000000
py 1 0.065410391 0.065410391 0.130820783 0.000000000
pz 1 0.040382927 0.040382927 0.080765854 0.000000000
sum over m 0.171213791 0.171213791 0.342427583 0.000000000
sum over m+mul 3.190189222 3.190189222 6.380378445 0.000000000
d3z^2-r^2 0 0.196288897 0.196288897 0.392577794 0.000000000
dx^2-y^2 0 0.201525016 0.201525016 0.403050033 0.000000000
dxy 0 0.250915966 0.250915966 0.501831931 0.000000000
dxz 0 0.268508678 0.268508678 0.537017356 0.000000000
dyz 0 0.268517837 0.268517837 0.537035675 0.000000000
sum over m 1.185756394 1.185756394 2.371512789 0.000000000
d3z^2-r^2 1 0.003474672 0.003474672 0.006949344 0.000000000
dx^2-y^2 1 -0.004474966 -0.004474966 -0.008949932 0.000000000
dxy 1 0.015340900 0.015340900 0.030681800 0.000000000
dxz 1 0.003487410 0.003487410 0.006974819 0.000000000
dyz 1 0.003486522 0.003486522 0.006973045 0.000000000
sum over m 0.021314538 0.021314538 0.042629076 0.000000000
sum over m+mul 1.207070932 1.207070932 2.414141865 0.000000000
614 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758742 1.000758742 2.001517485 0.000000000
sum over m 1.000758742 1.000758742 2.001517485 0.000000000
s 1 0.207414910 0.207414910 0.414829820 0.000000000
sum over m 0.207414910 0.207414910 0.414829820 0.000000000
s 2 0.014725535 0.014725535 0.029451070 0.000000000
sum over m 0.014725535 0.014725535 0.029451070 0.000000000
sum over m+mul 1.222899188 1.222899188 2.445798375 0.000000000
px 0 1.006372704 1.006372704 2.012745408 0.000000000
py 0 1.006384943 1.006384943 2.012769885 0.000000000
pz 0 1.006196973 1.006196973 2.012393946 0.000000000
sum over m 3.018954620 3.018954620 6.037909239 0.000000000
px 1 0.065439817 0.065439817 0.130879633 0.000000000
py 1 0.065431299 0.065431299 0.130862599 0.000000000
pz 1 0.040384285 0.040384285 0.080768571 0.000000000
sum over m 0.171255401 0.171255401 0.342510803 0.000000000
sum over m+mul 3.190210021 3.190210021 6.380420042 0.000000000
d3z^2-r^2 0 0.196319114 0.196319114 0.392638228 0.000000000
dx^2-y^2 0 0.201523316 0.201523316 0.403046632 0.000000000
dxy 0 0.250932369 0.250932369 0.501864738 0.000000000
dxz 0 0.268505638 0.268505638 0.537011275 0.000000000
dyz 0 0.268496820 0.268496820 0.536993639 0.000000000
sum over m 1.185777256 1.185777256 2.371554513 0.000000000
d3z^2-r^2 1 0.003478698 0.003478698 0.006957395 0.000000000
dx^2-y^2 1 -0.004474298 -0.004474298 -0.008948596 0.000000000
dxy 1 0.015342454 0.015342454 0.030684909 0.000000000
dxz 1 0.003497584 0.003497584 0.006995168 0.000000000
dyz 1 0.003496402 0.003496402 0.006992803 0.000000000
sum over m 0.021340839 0.021340839 0.042681678 0.000000000
sum over m+mul 1.207118095 1.207118095 2.414236191 0.000000000
615 O Up spin Down spin Sum Diff
multiple
s 0 0.893905933 0.893905933 1.787811867 0.000000000
sum over m 0.893905933 0.893905933 1.787811867 0.000000000
s 1 -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m+mul 0.890863858 0.890863858 1.781727717 0.000000000
px 0 0.786822811 0.786822811 1.573645621 0.000000000
py 0 0.787143494 0.787143494 1.574286987 0.000000000
pz 0 0.779781123 0.779781123 1.559562245 0.000000000
sum over m 2.353747427 2.353747427 4.707494854 0.000000000
px 1 -0.008735009 -0.008735009 -0.017470018 0.000000000
py 1 -0.008746988 -0.008746988 -0.017493976 0.000000000
pz 1 -0.006461732 -0.006461732 -0.012923463 0.000000000
sum over m -0.023943729 -0.023943729 -0.047887457 0.000000000
sum over m+mul 2.329803698 2.329803698 4.659607397 0.000000000
d3z^2-r^2 0 -0.006391211 -0.006391211 -0.012782421 0.000000000
dx^2-y^2 0 -0.005058570 -0.005058570 -0.010117140 0.000000000
dxy 0 -0.005434801 -0.005434801 -0.010869602 0.000000000
dxz 0 -0.006933434 -0.006933434 -0.013866868 0.000000000
dyz 0 -0.006926741 -0.006926741 -0.013853482 0.000000000
sum over m -0.030744757 -0.030744757 -0.061489514 0.000000000
sum over m+mul -0.030744757 -0.030744757 -0.061489514 0.000000000
616 O Up spin Down spin Sum Diff
multiple
s 0 0.893886844 0.893886844 1.787773688 0.000000000
sum over m 0.893886844 0.893886844 1.787773688 0.000000000
s 1 -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m+mul 0.890844535 0.890844535 1.781689070 0.000000000
px 0 0.787087238 0.787087238 1.574174476 0.000000000
py 0 0.786825603 0.786825603 1.573651206 0.000000000
pz 0 0.779800671 0.779800671 1.559601343 0.000000000
sum over m 2.353713512 2.353713512 4.707427025 0.000000000
px 1 -0.008741148 -0.008741148 -0.017482296 0.000000000
py 1 -0.008737361 -0.008737361 -0.017474723 0.000000000
pz 1 -0.006464051 -0.006464051 -0.012928103 0.000000000
sum over m -0.023942561 -0.023942561 -0.047885121 0.000000000
sum over m+mul 2.329770952 2.329770952 4.659541904 0.000000000
d3z^2-r^2 0 -0.006390264 -0.006390264 -0.012780528 0.000000000
dx^2-y^2 0 -0.005059183 -0.005059183 -0.010118366 0.000000000
dxy 0 -0.005433461 -0.005433461 -0.010866922 0.000000000
dxz 0 -0.006928949 -0.006928949 -0.013857898 0.000000000
dyz 0 -0.006932932 -0.006932932 -0.013865865 0.000000000
sum over m -0.030744789 -0.030744789 -0.061489578 0.000000000
sum over m+mul -0.030744789 -0.030744789 -0.061489578 0.000000000
617 O Up spin Down spin Sum Diff
multiple
s 0 0.893853134 0.893853134 1.787706267 0.000000000
sum over m 0.893853134 0.893853134 1.787706267 0.000000000
s 1 -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m+mul 0.890810709 0.890810709 1.781621419 0.000000000
px 0 0.786921166 0.786921166 1.573842333 0.000000000
py 0 0.786858059 0.786858059 1.573716118 0.000000000
pz 0 0.779871468 0.779871468 1.559742937 0.000000000
sum over m 2.353650694 2.353650694 4.707301388 0.000000000
px 1 -0.008736407 -0.008736407 -0.017472815 0.000000000
py 1 -0.008736997 -0.008736997 -0.017473994 0.000000000
pz 1 -0.006466568 -0.006466568 -0.012933136 0.000000000
sum over m -0.023939972 -0.023939972 -0.047879944 0.000000000
sum over m+mul 2.329710722 2.329710722 4.659421444 0.000000000
d3z^2-r^2 0 -0.006389349 -0.006389349 -0.012778697 0.000000000
dx^2-y^2 0 -0.005061152 -0.005061152 -0.010122305 0.000000000
dxy 0 -0.005431835 -0.005431835 -0.010863669 0.000000000
dxz 0 -0.006934510 -0.006934510 -0.013869019 0.000000000
dyz 0 -0.006935035 -0.006935035 -0.013870070 0.000000000
sum over m -0.030751880 -0.030751880 -0.061503761 0.000000000
sum over m+mul -0.030751880 -0.030751880 -0.061503761 0.000000000
618 O Up spin Down spin Sum Diff
multiple
s 0 0.893907585 0.893907585 1.787815171 0.000000000
sum over m 0.893907585 0.893907585 1.787815171 0.000000000
s 1 -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m+mul 0.890865012 0.890865012 1.781730025 0.000000000
px 0 0.787047565 0.787047565 1.574095130 0.000000000
py 0 0.787044942 0.787044942 1.574089884 0.000000000
pz 0 0.779681978 0.779681978 1.559363955 0.000000000
sum over m 2.353774484 2.353774484 4.707548969 0.000000000
px 1 -0.008730546 -0.008730546 -0.017461092 0.000000000
py 1 -0.008732352 -0.008732352 -0.017464704 0.000000000
pz 1 -0.006453076 -0.006453076 -0.012906152 0.000000000
sum over m -0.023915974 -0.023915974 -0.047831948 0.000000000
sum over m+mul 2.329858510 2.329858510 4.659717020 0.000000000
d3z^2-r^2 0 -0.006390178 -0.006390178 -0.012780355 0.000000000
dx^2-y^2 0 -0.005052335 -0.005052335 -0.010104670 0.000000000
dxy 0 -0.005435478 -0.005435478 -0.010870956 0.000000000
dxz 0 -0.006924277 -0.006924277 -0.013848555 0.000000000
dyz 0 -0.006923240 -0.006923240 -0.013846479 0.000000000
sum over m -0.030725507 -0.030725507 -0.061451015 0.000000000
sum over m+mul -0.030725507 -0.030725507 -0.061451015 0.000000000
619 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000754531 1.000754531 2.001509062 0.000000000
sum over m 1.000754531 1.000754531 2.001509062 0.000000000
s 1 0.207411818 0.207411818 0.414823636 0.000000000
sum over m 0.207411818 0.207411818 0.414823636 0.000000000
s 2 0.014724175 0.014724175 0.029448350 0.000000000
sum over m 0.014724175 0.014724175 0.029448350 0.000000000
sum over m+mul 1.222890524 1.222890524 2.445781048 0.000000000
px 0 1.006397581 1.006397581 2.012795162 0.000000000
py 0 1.006383481 1.006383481 2.012766962 0.000000000
pz 0 1.006194369 1.006194369 2.012388738 0.000000000
sum over m 3.018975431 3.018975431 6.037950862 0.000000000
px 1 0.065420473 0.065420473 0.130840947 0.000000000
py 1 0.065410391 0.065410391 0.130820783 0.000000000
pz 1 0.040382927 0.040382927 0.080765854 0.000000000
sum over m 0.171213792 0.171213792 0.342427583 0.000000000
sum over m+mul 3.190189223 3.190189223 6.380378445 0.000000000
d3z^2-r^2 0 0.196288897 0.196288897 0.392577794 0.000000000
dx^2-y^2 0 0.201525017 0.201525017 0.403050034 0.000000000
dxy 0 0.250915966 0.250915966 0.501831931 0.000000000
dxz 0 0.268508678 0.268508678 0.537017356 0.000000000
dyz 0 0.268517838 0.268517838 0.537035675 0.000000000
sum over m 1.185756395 1.185756395 2.371512790 0.000000000
d3z^2-r^2 1 0.003474672 0.003474672 0.006949344 0.000000000
dx^2-y^2 1 -0.004474966 -0.004474966 -0.008949931 0.000000000
dxy 1 0.015340900 0.015340900 0.030681800 0.000000000
dxz 1 0.003487410 0.003487410 0.006974819 0.000000000
dyz 1 0.003486522 0.003486522 0.006973045 0.000000000
sum over m 0.021314538 0.021314538 0.042629076 0.000000000
sum over m+mul 1.207070933 1.207070933 2.414141866 0.000000000
620 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758743 1.000758743 2.001517485 0.000000000
sum over m 1.000758743 1.000758743 2.001517485 0.000000000
s 1 0.207414910 0.207414910 0.414829820 0.000000000
sum over m 0.207414910 0.207414910 0.414829820 0.000000000
s 2 0.014725535 0.014725535 0.029451070 0.000000000
sum over m 0.014725535 0.014725535 0.029451070 0.000000000
sum over m+mul 1.222899188 1.222899188 2.445798375 0.000000000
px 0 1.006372704 1.006372704 2.012745408 0.000000000
py 0 1.006384943 1.006384943 2.012769885 0.000000000
pz 0 1.006196973 1.006196973 2.012393946 0.000000000
sum over m 3.018954620 3.018954620 6.037909239 0.000000000
px 1 0.065439816 0.065439816 0.130879633 0.000000000
py 1 0.065431299 0.065431299 0.130862599 0.000000000
pz 1 0.040384285 0.040384285 0.080768571 0.000000000
sum over m 0.171255401 0.171255401 0.342510803 0.000000000
sum over m+mul 3.190210021 3.190210021 6.380420042 0.000000000
d3z^2-r^2 0 0.196319114 0.196319114 0.392638227 0.000000000
dx^2-y^2 0 0.201523316 0.201523316 0.403046631 0.000000000
dxy 0 0.250932370 0.250932370 0.501864739 0.000000000
dxz 0 0.268505638 0.268505638 0.537011276 0.000000000
dyz 0 0.268496820 0.268496820 0.536993639 0.000000000
sum over m 1.185777256 1.185777256 2.371554513 0.000000000
d3z^2-r^2 1 0.003478698 0.003478698 0.006957395 0.000000000
dx^2-y^2 1 -0.004474298 -0.004474298 -0.008948596 0.000000000
dxy 1 0.015342454 0.015342454 0.030684909 0.000000000
dxz 1 0.003497584 0.003497584 0.006995168 0.000000000
dyz 1 0.003496402 0.003496402 0.006992803 0.000000000
sum over m 0.021340839 0.021340839 0.042681678 0.000000000
sum over m+mul 1.207118095 1.207118095 2.414236191 0.000000000
621 O Up spin Down spin Sum Diff
multiple
s 0 0.893905933 0.893905933 1.787811867 0.000000000
sum over m 0.893905933 0.893905933 1.787811867 0.000000000
s 1 -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m+mul 0.890863858 0.890863858 1.781727717 0.000000000
px 0 0.786822811 0.786822811 1.573645622 0.000000000
py 0 0.787143494 0.787143494 1.574286988 0.000000000
pz 0 0.779781123 0.779781123 1.559562245 0.000000000
sum over m 2.353747427 2.353747427 4.707494855 0.000000000
px 1 -0.008735009 -0.008735009 -0.017470018 0.000000000
py 1 -0.008746988 -0.008746988 -0.017493976 0.000000000
pz 1 -0.006461732 -0.006461732 -0.012923463 0.000000000
sum over m -0.023943729 -0.023943729 -0.047887457 0.000000000
sum over m+mul 2.329803699 2.329803699 4.659607398 0.000000000
d3z^2-r^2 0 -0.006391211 -0.006391211 -0.012782421 0.000000000
dx^2-y^2 0 -0.005058570 -0.005058570 -0.010117141 0.000000000
dxy 0 -0.005434801 -0.005434801 -0.010869602 0.000000000
dxz 0 -0.006933434 -0.006933434 -0.013866868 0.000000000
dyz 0 -0.006926741 -0.006926741 -0.013853482 0.000000000
sum over m -0.030744757 -0.030744757 -0.061489514 0.000000000
sum over m+mul -0.030744757 -0.030744757 -0.061489514 0.000000000
622 O Up spin Down spin Sum Diff
multiple
s 0 0.893886844 0.893886844 1.787773688 0.000000000
sum over m 0.893886844 0.893886844 1.787773688 0.000000000
s 1 -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m+mul 0.890844535 0.890844535 1.781689070 0.000000000
px 0 0.787087238 0.787087238 1.574174476 0.000000000
py 0 0.786825603 0.786825603 1.573651206 0.000000000
pz 0 0.779800671 0.779800671 1.559601343 0.000000000
sum over m 2.353713512 2.353713512 4.707427024 0.000000000
px 1 -0.008741148 -0.008741148 -0.017482296 0.000000000
py 1 -0.008737361 -0.008737361 -0.017474723 0.000000000
pz 1 -0.006464051 -0.006464051 -0.012928103 0.000000000
sum over m -0.023942561 -0.023942561 -0.047885121 0.000000000
sum over m+mul 2.329770951 2.329770951 4.659541903 0.000000000
d3z^2-r^2 0 -0.006390264 -0.006390264 -0.012780529 0.000000000
dx^2-y^2 0 -0.005059183 -0.005059183 -0.010118366 0.000000000
dxy 0 -0.005433461 -0.005433461 -0.010866922 0.000000000
dxz 0 -0.006928949 -0.006928949 -0.013857898 0.000000000
dyz 0 -0.006932932 -0.006932932 -0.013865865 0.000000000
sum over m -0.030744789 -0.030744789 -0.061489578 0.000000000
sum over m+mul -0.030744789 -0.030744789 -0.061489578 0.000000000
623 O Up spin Down spin Sum Diff
multiple
s 0 0.893853134 0.893853134 1.787706267 0.000000000
sum over m 0.893853134 0.893853134 1.787706267 0.000000000
s 1 -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m+mul 0.890810709 0.890810709 1.781621419 0.000000000
px 0 0.786921167 0.786921167 1.573842333 0.000000000
py 0 0.786858059 0.786858059 1.573716119 0.000000000
pz 0 0.779871468 0.779871468 1.559742937 0.000000000
sum over m 2.353650694 2.353650694 4.707301389 0.000000000
px 1 -0.008736407 -0.008736407 -0.017472815 0.000000000
py 1 -0.008736997 -0.008736997 -0.017473994 0.000000000
pz 1 -0.006466568 -0.006466568 -0.012933136 0.000000000
sum over m -0.023939972 -0.023939972 -0.047879944 0.000000000
sum over m+mul 2.329710722 2.329710722 4.659421444 0.000000000
d3z^2-r^2 0 -0.006389349 -0.006389349 -0.012778697 0.000000000
dx^2-y^2 0 -0.005061152 -0.005061152 -0.010122305 0.000000000
dxy 0 -0.005431835 -0.005431835 -0.010863669 0.000000000
dxz 0 -0.006934510 -0.006934510 -0.013869019 0.000000000
dyz 0 -0.006935035 -0.006935035 -0.013870070 0.000000000
sum over m -0.030751880 -0.030751880 -0.061503761 0.000000000
sum over m+mul -0.030751880 -0.030751880 -0.061503761 0.000000000
624 O Up spin Down spin Sum Diff
multiple
s 0 0.893907585 0.893907585 1.787815171 0.000000000
sum over m 0.893907585 0.893907585 1.787815171 0.000000000
s 1 -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m+mul 0.890865012 0.890865012 1.781730025 0.000000000
px 0 0.787047565 0.787047565 1.574095130 0.000000000
py 0 0.787044942 0.787044942 1.574089884 0.000000000
pz 0 0.779681978 0.779681978 1.559363955 0.000000000
sum over m 2.353774485 2.353774485 4.707548969 0.000000000
px 1 -0.008730546 -0.008730546 -0.017461092 0.000000000
py 1 -0.008732352 -0.008732352 -0.017464704 0.000000000
pz 1 -0.006453076 -0.006453076 -0.012906152 0.000000000
sum over m -0.023915974 -0.023915974 -0.047831948 0.000000000
sum over m+mul 2.329858510 2.329858510 4.659717021 0.000000000
d3z^2-r^2 0 -0.006390178 -0.006390178 -0.012780355 0.000000000
dx^2-y^2 0 -0.005052335 -0.005052335 -0.010104670 0.000000000
dxy 0 -0.005435478 -0.005435478 -0.010870956 0.000000000
dxz 0 -0.006924277 -0.006924277 -0.013848555 0.000000000
dyz 0 -0.006923240 -0.006923240 -0.013846479 0.000000000
sum over m -0.030725507 -0.030725507 -0.061451015 0.000000000
sum over m+mul -0.030725507 -0.030725507 -0.061451015 0.000000000
625 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000754531 1.000754531 2.001509062 0.000000000
sum over m 1.000754531 1.000754531 2.001509062 0.000000000
s 1 0.207411818 0.207411818 0.414823636 0.000000000
sum over m 0.207411818 0.207411818 0.414823636 0.000000000
s 2 0.014724175 0.014724175 0.029448350 0.000000000
sum over m 0.014724175 0.014724175 0.029448350 0.000000000
sum over m+mul 1.222890524 1.222890524 2.445781048 0.000000000
px 0 1.006397581 1.006397581 2.012795162 0.000000000
py 0 1.006383481 1.006383481 2.012766962 0.000000000
pz 0 1.006194369 1.006194369 2.012388738 0.000000000
sum over m 3.018975431 3.018975431 6.037950862 0.000000000
px 1 0.065420474 0.065420474 0.130840947 0.000000000
py 1 0.065410391 0.065410391 0.130820782 0.000000000
pz 1 0.040382927 0.040382927 0.080765853 0.000000000
sum over m 0.171213792 0.171213792 0.342427583 0.000000000
sum over m+mul 3.190189222 3.190189222 6.380378445 0.000000000
d3z^2-r^2 0 0.196288897 0.196288897 0.392577794 0.000000000
dx^2-y^2 0 0.201525016 0.201525016 0.403050033 0.000000000
dxy 0 0.250915966 0.250915966 0.501831931 0.000000000
dxz 0 0.268508678 0.268508678 0.537017356 0.000000000
dyz 0 0.268517838 0.268517838 0.537035675 0.000000000
sum over m 1.185756394 1.185756394 2.371512789 0.000000000
d3z^2-r^2 1 0.003474672 0.003474672 0.006949344 0.000000000
dx^2-y^2 1 -0.004474966 -0.004474966 -0.008949931 0.000000000
dxy 1 0.015340900 0.015340900 0.030681800 0.000000000
dxz 1 0.003487410 0.003487410 0.006974819 0.000000000
dyz 1 0.003486522 0.003486522 0.006973045 0.000000000
sum over m 0.021314538 0.021314538 0.042629076 0.000000000
sum over m+mul 1.207070933 1.207070933 2.414141865 0.000000000
626 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758743 1.000758743 2.001517485 0.000000000
sum over m 1.000758743 1.000758743 2.001517485 0.000000000
s 1 0.207414910 0.207414910 0.414829819 0.000000000
sum over m 0.207414910 0.207414910 0.414829819 0.000000000
s 2 0.014725535 0.014725535 0.029451070 0.000000000
sum over m 0.014725535 0.014725535 0.029451070 0.000000000
sum over m+mul 1.222899188 1.222899188 2.445798375 0.000000000
px 0 1.006372704 1.006372704 2.012745408 0.000000000
py 0 1.006384943 1.006384943 2.012769885 0.000000000
pz 0 1.006196973 1.006196973 2.012393946 0.000000000
sum over m 3.018954619 3.018954619 6.037909239 0.000000000
px 1 0.065439816 0.065439816 0.130879633 0.000000000
py 1 0.065431299 0.065431299 0.130862599 0.000000000
pz 1 0.040384285 0.040384285 0.080768571 0.000000000
sum over m 0.171255401 0.171255401 0.342510802 0.000000000
sum over m+mul 3.190210020 3.190210020 6.380420041 0.000000000
d3z^2-r^2 0 0.196319114 0.196319114 0.392638228 0.000000000
dx^2-y^2 0 0.201523316 0.201523316 0.403046632 0.000000000
dxy 0 0.250932369 0.250932369 0.501864739 0.000000000
dxz 0 0.268505638 0.268505638 0.537011276 0.000000000
dyz 0 0.268496819 0.268496819 0.536993639 0.000000000
sum over m 1.185777257 1.185777257 2.371554513 0.000000000
d3z^2-r^2 1 0.003478698 0.003478698 0.006957395 0.000000000
dx^2-y^2 1 -0.004474298 -0.004474298 -0.008948596 0.000000000
dxy 1 0.015342454 0.015342454 0.030684909 0.000000000
dxz 1 0.003497584 0.003497584 0.006995168 0.000000000
dyz 1 0.003496402 0.003496402 0.006992803 0.000000000
sum over m 0.021340839 0.021340839 0.042681678 0.000000000
sum over m+mul 1.207118096 1.207118096 2.414236191 0.000000000
627 O Up spin Down spin Sum Diff
multiple
s 0 0.893905933 0.893905933 1.787811867 0.000000000
sum over m 0.893905933 0.893905933 1.787811867 0.000000000
s 1 -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m+mul 0.890863858 0.890863858 1.781727717 0.000000000
px 0 0.786822811 0.786822811 1.573645622 0.000000000
py 0 0.787143494 0.787143494 1.574286987 0.000000000
pz 0 0.779781123 0.779781123 1.559562245 0.000000000
sum over m 2.353747427 2.353747427 4.707494854 0.000000000
px 1 -0.008735009 -0.008735009 -0.017470018 0.000000000
py 1 -0.008746988 -0.008746988 -0.017493976 0.000000000
pz 1 -0.006461732 -0.006461732 -0.012923463 0.000000000
sum over m -0.023943729 -0.023943729 -0.047887457 0.000000000
sum over m+mul 2.329803699 2.329803699 4.659607397 0.000000000
d3z^2-r^2 0 -0.006391211 -0.006391211 -0.012782421 0.000000000
dx^2-y^2 0 -0.005058570 -0.005058570 -0.010117141 0.000000000
dxy 0 -0.005434801 -0.005434801 -0.010869602 0.000000000
dxz 0 -0.006933434 -0.006933434 -0.013866868 0.000000000
dyz 0 -0.006926741 -0.006926741 -0.013853482 0.000000000
sum over m -0.030744757 -0.030744757 -0.061489514 0.000000000
sum over m+mul -0.030744757 -0.030744757 -0.061489514 0.000000000
628 O Up spin Down spin Sum Diff
multiple
s 0 0.893886844 0.893886844 1.787773688 0.000000000
sum over m 0.893886844 0.893886844 1.787773688 0.000000000
s 1 -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m+mul 0.890844535 0.890844535 1.781689070 0.000000000
px 0 0.787087238 0.787087238 1.574174476 0.000000000
py 0 0.786825603 0.786825603 1.573651206 0.000000000
pz 0 0.779800671 0.779800671 1.559601343 0.000000000
sum over m 2.353713512 2.353713512 4.707427024 0.000000000
px 1 -0.008741148 -0.008741148 -0.017482296 0.000000000
py 1 -0.008737361 -0.008737361 -0.017474723 0.000000000
pz 1 -0.006464051 -0.006464051 -0.012928103 0.000000000
sum over m -0.023942561 -0.023942561 -0.047885121 0.000000000
sum over m+mul 2.329770952 2.329770952 4.659541903 0.000000000
d3z^2-r^2 0 -0.006390264 -0.006390264 -0.012780529 0.000000000
dx^2-y^2 0 -0.005059183 -0.005059183 -0.010118366 0.000000000
dxy 0 -0.005433461 -0.005433461 -0.010866922 0.000000000
dxz 0 -0.006928949 -0.006928949 -0.013857898 0.000000000
dyz 0 -0.006932932 -0.006932932 -0.013865865 0.000000000
sum over m -0.030744789 -0.030744789 -0.061489578 0.000000000
sum over m+mul -0.030744789 -0.030744789 -0.061489578 0.000000000
629 O Up spin Down spin Sum Diff
multiple
s 0 0.893853134 0.893853134 1.787706267 0.000000000
sum over m 0.893853134 0.893853134 1.787706267 0.000000000
s 1 -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m+mul 0.890810709 0.890810709 1.781621419 0.000000000
px 0 0.786921166 0.786921166 1.573842333 0.000000000
py 0 0.786858059 0.786858059 1.573716118 0.000000000
pz 0 0.779871468 0.779871468 1.559742937 0.000000000
sum over m 2.353650694 2.353650694 4.707301388 0.000000000
px 1 -0.008736407 -0.008736407 -0.017472815 0.000000000
py 1 -0.008736997 -0.008736997 -0.017473994 0.000000000
pz 1 -0.006466568 -0.006466568 -0.012933136 0.000000000
sum over m -0.023939972 -0.023939972 -0.047879944 0.000000000
sum over m+mul 2.329710722 2.329710722 4.659421443 0.000000000
d3z^2-r^2 0 -0.006389349 -0.006389349 -0.012778697 0.000000000
dx^2-y^2 0 -0.005061152 -0.005061152 -0.010122305 0.000000000
dxy 0 -0.005431835 -0.005431835 -0.010863669 0.000000000
dxz 0 -0.006934510 -0.006934510 -0.013869019 0.000000000
dyz 0 -0.006935035 -0.006935035 -0.013870070 0.000000000
sum over m -0.030751880 -0.030751880 -0.061503761 0.000000000
sum over m+mul -0.030751880 -0.030751880 -0.061503761 0.000000000
630 O Up spin Down spin Sum Diff
multiple
s 0 0.893907585 0.893907585 1.787815171 0.000000000
sum over m 0.893907585 0.893907585 1.787815171 0.000000000
s 1 -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m+mul 0.890865012 0.890865012 1.781730025 0.000000000
px 0 0.787047565 0.787047565 1.574095130 0.000000000
py 0 0.787044942 0.787044942 1.574089885 0.000000000
pz 0 0.779681977 0.779681977 1.559363955 0.000000000
sum over m 2.353774485 2.353774485 4.707548969 0.000000000
px 1 -0.008730546 -0.008730546 -0.017461092 0.000000000
py 1 -0.008732352 -0.008732352 -0.017464704 0.000000000
pz 1 -0.006453076 -0.006453076 -0.012906152 0.000000000
sum over m -0.023915974 -0.023915974 -0.047831948 0.000000000
sum over m+mul 2.329858510 2.329858510 4.659717021 0.000000000
d3z^2-r^2 0 -0.006390178 -0.006390178 -0.012780355 0.000000000
dx^2-y^2 0 -0.005052335 -0.005052335 -0.010104670 0.000000000
dxy 0 -0.005435478 -0.005435478 -0.010870956 0.000000000
dxz 0 -0.006924277 -0.006924277 -0.013848555 0.000000000
dyz 0 -0.006923240 -0.006923240 -0.013846479 0.000000000
sum over m -0.030725507 -0.030725507 -0.061451015 0.000000000
sum over m+mul -0.030725507 -0.030725507 -0.061451015 0.000000000
631 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000770732 1.000770732 2.001541464 0.000000000
sum over m 1.000770732 1.000770732 2.001541464 0.000000000
s 1 0.207415353 0.207415353 0.414830707 0.000000000
sum over m 0.207415353 0.207415353 0.414830707 0.000000000
s 2 0.014725018 0.014725018 0.029450037 0.000000000
sum over m 0.014725018 0.014725018 0.029450037 0.000000000
sum over m+mul 1.222911104 1.222911104 2.445822208 0.000000000
px 0 1.006363497 1.006363497 2.012726994 0.000000000
py 0 1.006377070 1.006377070 2.012754140 0.000000000
pz 0 1.006197347 1.006197347 2.012394695 0.000000000
sum over m 3.018937914 3.018937914 6.037875828 0.000000000
px 1 0.065430544 0.065430544 0.130861088 0.000000000
py 1 0.065435974 0.065435974 0.130871948 0.000000000
pz 1 0.040378093 0.040378093 0.080756187 0.000000000
sum over m 0.171244611 0.171244611 0.342489223 0.000000000
sum over m+mul 3.190182526 3.190182526 6.380365051 0.000000000
d3z^2-r^2 0 0.196300924 0.196300924 0.392601848 0.000000000
dx^2-y^2 0 0.201509474 0.201509474 0.403018948 0.000000000
dxy 0 0.250938064 0.250938064 0.501876129 0.000000000
dxz 0 0.268515406 0.268515406 0.537030812 0.000000000
dyz 0 0.268491138 0.268491138 0.536982276 0.000000000
sum over m 1.185755007 1.185755007 2.371510013 0.000000000
d3z^2-r^2 1 0.003475239 0.003475239 0.006950478 0.000000000
dx^2-y^2 1 -0.004476268 -0.004476268 -0.008952536 0.000000000
dxy 1 0.015340008 0.015340008 0.030680016 0.000000000
dxz 1 0.003489873 0.003489873 0.006979746 0.000000000
dyz 1 0.003489582 0.003489582 0.006979164 0.000000000
sum over m 0.021318434 0.021318434 0.042636868 0.000000000
sum over m+mul 1.207073441 1.207073441 2.414146881 0.000000000
632 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778689 1.000778689 2.001557378 0.000000000
sum over m 1.000778689 1.000778689 2.001557378 0.000000000
s 1 0.207427937 0.207427937 0.414855874 0.000000000
sum over m 0.207427937 0.207427937 0.414855874 0.000000000
s 2 0.014724840 0.014724840 0.029449681 0.000000000
sum over m 0.014724840 0.014724840 0.029449681 0.000000000
sum over m+mul 1.222931467 1.222931467 2.445862933 0.000000000
px 0 1.006362938 1.006362938 2.012725875 0.000000000
py 0 1.006378244 1.006378244 2.012756488 0.000000000
pz 0 1.006192808 1.006192808 2.012385617 0.000000000
sum over m 3.018933990 3.018933990 6.037867980 0.000000000
px 1 0.065445106 0.065445106 0.130890212 0.000000000
py 1 0.065430970 0.065430970 0.130861940 0.000000000
pz 1 0.040376747 0.040376747 0.080753493 0.000000000
sum over m 0.171252823 0.171252823 0.342505645 0.000000000
sum over m+mul 3.190186813 3.190186813 6.380373626 0.000000000
d3z^2-r^2 0 0.196306657 0.196306657 0.392613314 0.000000000
dx^2-y^2 0 0.201501412 0.201501412 0.403002824 0.000000000
dxy 0 0.250950786 0.250950786 0.501901571 0.000000000
dxz 0 0.268511716 0.268511716 0.537023433 0.000000000
dyz 0 0.268477950 0.268477950 0.536955900 0.000000000
sum over m 1.185748521 1.185748521 2.371497042 0.000000000
d3z^2-r^2 1 0.003474151 0.003474151 0.006948302 0.000000000
dx^2-y^2 1 -0.004476884 -0.004476884 -0.008953767 0.000000000
dxy 1 0.015339214 0.015339214 0.030678429 0.000000000
dxz 1 0.003491773 0.003491773 0.006983546 0.000000000
dyz 1 0.003488727 0.003488727 0.006977455 0.000000000
sum over m 0.021316982 0.021316982 0.042633964 0.000000000
sum over m+mul 1.207065503 1.207065503 2.414131006 0.000000000
633 O Up spin Down spin Sum Diff
multiple
s 0 0.893895019 0.893895019 1.787790038 0.000000000
sum over m 0.893895019 0.893895019 1.787790038 0.000000000
s 1 -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m+mul 0.890852483 0.890852483 1.781704966 0.000000000
px 0 0.786966454 0.786966454 1.573932908 0.000000000
py 0 0.787056712 0.787056712 1.574113423 0.000000000
pz 0 0.779743447 0.779743447 1.559486894 0.000000000
sum over m 2.353766613 2.353766613 4.707533225 0.000000000
px 1 -0.008730480 -0.008730480 -0.017460960 0.000000000
py 1 -0.008739472 -0.008739472 -0.017478944 0.000000000
pz 1 -0.006458433 -0.006458433 -0.012916866 0.000000000
sum over m -0.023928385 -0.023928385 -0.047856770 0.000000000
sum over m+mul 2.329838228 2.329838228 4.659676455 0.000000000
d3z^2-r^2 0 -0.006389905 -0.006389905 -0.012779810 0.000000000
dx^2-y^2 0 -0.005056718 -0.005056718 -0.010113437 0.000000000
dxy 0 -0.005434763 -0.005434763 -0.010869526 0.000000000
dxz 0 -0.006929867 -0.006929867 -0.013859734 0.000000000
dyz 0 -0.006925027 -0.006925027 -0.013850053 0.000000000
sum over m -0.030736281 -0.030736281 -0.061472561 0.000000000
sum over m+mul -0.030736281 -0.030736281 -0.061472561 0.000000000
634 O Up spin Down spin Sum Diff
multiple
s 0 0.893874732 0.893874732 1.787749464 0.000000000
sum over m 0.893874732 0.893874732 1.787749464 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m+mul 0.890832556 0.890832556 1.781665113 0.000000000
px 0 0.786910520 0.786910520 1.573821039 0.000000000
py 0 0.787008076 0.787008076 1.574016153 0.000000000
pz 0 0.779811493 0.779811493 1.559622987 0.000000000
sum over m 2.353730089 2.353730089 4.707460179 0.000000000
px 1 -0.008727624 -0.008727624 -0.017455248 0.000000000
py 1 -0.008738822 -0.008738822 -0.017477644 0.000000000
pz 1 -0.006463367 -0.006463367 -0.012926734 0.000000000
sum over m -0.023929813 -0.023929813 -0.047859626 0.000000000
sum over m+mul 2.329800277 2.329800277 4.659600553 0.000000000
d3z^2-r^2 0 -0.006389922 -0.006389922 -0.012779845 0.000000000
dx^2-y^2 0 -0.005059210 -0.005059210 -0.010118420 0.000000000
dxy 0 -0.005433824 -0.005433824 -0.010867647 0.000000000
dxz 0 -0.006932427 -0.006932427 -0.013864854 0.000000000
dyz 0 -0.006928883 -0.006928883 -0.013857765 0.000000000
sum over m -0.030744266 -0.030744266 -0.061488531 0.000000000
sum over m+mul -0.030744266 -0.030744266 -0.061488531 0.000000000
635 O Up spin Down spin Sum Diff
multiple
s 0 0.893886339 0.893886339 1.787772678 0.000000000
sum over m 0.893886339 0.893886339 1.787772678 0.000000000
s 1 -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m+mul 0.890843777 0.890843777 1.781687554 0.000000000
px 0 0.787069304 0.787069304 1.574138608 0.000000000
py 0 0.786877517 0.786877517 1.573755034 0.000000000
pz 0 0.779775813 0.779775813 1.559551627 0.000000000
sum over m 2.353722634 2.353722634 4.707445268 0.000000000
px 1 -0.008737633 -0.008737633 -0.017475265 0.000000000
py 1 -0.008739259 -0.008739259 -0.017478518 0.000000000
pz 1 -0.006463379 -0.006463379 -0.012926759 0.000000000
sum over m -0.023940271 -0.023940271 -0.047880542 0.000000000
sum over m+mul 2.329782363 2.329782363 4.659564726 0.000000000
d3z^2-r^2 0 -0.006389979 -0.006389979 -0.012779958 0.000000000
dx^2-y^2 0 -0.005057691 -0.005057691 -0.010115383 0.000000000
dxy 0 -0.005433292 -0.005433292 -0.010866584 0.000000000
dxz 0 -0.006928514 -0.006928514 -0.013857028 0.000000000
dyz 0 -0.006930501 -0.006930501 -0.013861002 0.000000000
sum over m -0.030739977 -0.030739977 -0.061479954 0.000000000
sum over m+mul -0.030739977 -0.030739977 -0.061479954 0.000000000
636 O Up spin Down spin Sum Diff
multiple
s 0 0.893881298 0.893881298 1.787762596 0.000000000
sum over m 0.893881298 0.893881298 1.787762596 0.000000000
s 1 -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m+mul 0.890838813 0.890838813 1.781677626 0.000000000
px 0 0.786977266 0.786977266 1.573954532 0.000000000
py 0 0.786978394 0.786978394 1.573956787 0.000000000
pz 0 0.779778276 0.779778276 1.559556551 0.000000000
sum over m 2.353733935 2.353733935 4.707467870 0.000000000
px 1 -0.008729574 -0.008729574 -0.017459148 0.000000000
py 1 -0.008737772 -0.008737772 -0.017475543 0.000000000
pz 1 -0.006460567 -0.006460567 -0.012921134 0.000000000
sum over m -0.023927913 -0.023927913 -0.047855826 0.000000000
sum over m+mul 2.329806022 2.329806022 4.659612045 0.000000000
d3z^2-r^2 0 -0.006389700 -0.006389700 -0.012779401 0.000000000
dx^2-y^2 0 -0.005057871 -0.005057871 -0.010115741 0.000000000
dxy 0 -0.005433956 -0.005433956 -0.010867912 0.000000000
dxz 0 -0.006930158 -0.006930158 -0.013860316 0.000000000
dyz 0 -0.006927692 -0.006927692 -0.013855384 0.000000000
sum over m -0.030739377 -0.030739377 -0.061478754 0.000000000
sum over m+mul -0.030739377 -0.030739377 -0.061478754 0.000000000
637 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000770732 1.000770732 2.001541464 0.000000000
sum over m 1.000770732 1.000770732 2.001541464 0.000000000
s 1 0.207415353 0.207415353 0.414830707 0.000000000
sum over m 0.207415353 0.207415353 0.414830707 0.000000000
s 2 0.014725018 0.014725018 0.029450037 0.000000000
sum over m 0.014725018 0.014725018 0.029450037 0.000000000
sum over m+mul 1.222911104 1.222911104 2.445822207 0.000000000
px 0 1.006363497 1.006363497 2.012726994 0.000000000
py 0 1.006377070 1.006377070 2.012754140 0.000000000
pz 0 1.006197348 1.006197348 2.012394695 0.000000000
sum over m 3.018937914 3.018937914 6.037875829 0.000000000
px 1 0.065430544 0.065430544 0.130861088 0.000000000
py 1 0.065435974 0.065435974 0.130871948 0.000000000
pz 1 0.040378093 0.040378093 0.080756186 0.000000000
sum over m 0.171244611 0.171244611 0.342489222 0.000000000
sum over m+mul 3.190182525 3.190182525 6.380365051 0.000000000
d3z^2-r^2 0 0.196300924 0.196300924 0.392601848 0.000000000
dx^2-y^2 0 0.201509474 0.201509474 0.403018948 0.000000000
dxy 0 0.250938064 0.250938064 0.501876129 0.000000000
dxz 0 0.268515406 0.268515406 0.537030813 0.000000000
dyz 0 0.268491138 0.268491138 0.536982276 0.000000000
sum over m 1.185755007 1.185755007 2.371510014 0.000000000
d3z^2-r^2 1 0.003475239 0.003475239 0.006950478 0.000000000
dx^2-y^2 1 -0.004476268 -0.004476268 -0.008952536 0.000000000
dxy 1 0.015340008 0.015340008 0.030680016 0.000000000
dxz 1 0.003489873 0.003489873 0.006979746 0.000000000
dyz 1 0.003489582 0.003489582 0.006979164 0.000000000
sum over m 0.021318434 0.021318434 0.042636868 0.000000000
sum over m+mul 1.207073441 1.207073441 2.414146881 0.000000000
638 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778689 1.000778689 2.001557378 0.000000000
sum over m 1.000778689 1.000778689 2.001557378 0.000000000
s 1 0.207427937 0.207427937 0.414855875 0.000000000
sum over m 0.207427937 0.207427937 0.414855875 0.000000000
s 2 0.014724840 0.014724840 0.029449681 0.000000000
sum over m 0.014724840 0.014724840 0.029449681 0.000000000
sum over m+mul 1.222931467 1.222931467 2.445862934 0.000000000
px 0 1.006362938 1.006362938 2.012725875 0.000000000
py 0 1.006378244 1.006378244 2.012756488 0.000000000
pz 0 1.006192809 1.006192809 2.012385617 0.000000000
sum over m 3.018933990 3.018933990 6.037867981 0.000000000
px 1 0.065445106 0.065445106 0.130890212 0.000000000
py 1 0.065430970 0.065430970 0.130861940 0.000000000
pz 1 0.040376746 0.040376746 0.080753493 0.000000000
sum over m 0.171252822 0.171252822 0.342505645 0.000000000
sum over m+mul 3.190186813 3.190186813 6.380373625 0.000000000
d3z^2-r^2 0 0.196306657 0.196306657 0.392613314 0.000000000
dx^2-y^2 0 0.201501412 0.201501412 0.403002824 0.000000000
dxy 0 0.250950786 0.250950786 0.501901571 0.000000000
dxz 0 0.268511716 0.268511716 0.537023433 0.000000000
dyz 0 0.268477950 0.268477950 0.536955900 0.000000000
sum over m 1.185748521 1.185748521 2.371497043 0.000000000
d3z^2-r^2 1 0.003474151 0.003474151 0.006948302 0.000000000
dx^2-y^2 1 -0.004476884 -0.004476884 -0.008953767 0.000000000
dxy 1 0.015339214 0.015339214 0.030678429 0.000000000
dxz 1 0.003491773 0.003491773 0.006983546 0.000000000
dyz 1 0.003488727 0.003488727 0.006977455 0.000000000
sum over m 0.021316982 0.021316982 0.042633964 0.000000000
sum over m+mul 1.207065503 1.207065503 2.414131007 0.000000000
639 O Up spin Down spin Sum Diff
multiple
s 0 0.893895019 0.893895019 1.787790038 0.000000000
sum over m 0.893895019 0.893895019 1.787790038 0.000000000
s 1 -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m+mul 0.890852483 0.890852483 1.781704966 0.000000000
px 0 0.786966454 0.786966454 1.573932907 0.000000000
py 0 0.787056712 0.787056712 1.574113423 0.000000000
pz 0 0.779743447 0.779743447 1.559486894 0.000000000
sum over m 2.353766613 2.353766613 4.707533225 0.000000000
px 1 -0.008730480 -0.008730480 -0.017460960 0.000000000
py 1 -0.008739472 -0.008739472 -0.017478944 0.000000000
pz 1 -0.006458433 -0.006458433 -0.012916867 0.000000000
sum over m -0.023928385 -0.023928385 -0.047856770 0.000000000
sum over m+mul 2.329838227 2.329838227 4.659676455 0.000000000
d3z^2-r^2 0 -0.006389905 -0.006389905 -0.012779810 0.000000000
dx^2-y^2 0 -0.005056718 -0.005056718 -0.010113437 0.000000000
dxy 0 -0.005434763 -0.005434763 -0.010869526 0.000000000
dxz 0 -0.006929867 -0.006929867 -0.013859734 0.000000000
dyz 0 -0.006925027 -0.006925027 -0.013850053 0.000000000
sum over m -0.030736281 -0.030736281 -0.061472561 0.000000000
sum over m+mul -0.030736281 -0.030736281 -0.061472561 0.000000000
640 O Up spin Down spin Sum Diff
multiple
s 0 0.893874732 0.893874732 1.787749464 0.000000000
sum over m 0.893874732 0.893874732 1.787749464 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m+mul 0.890832556 0.890832556 1.781665113 0.000000000
px 0 0.786910520 0.786910520 1.573821040 0.000000000
py 0 0.787008076 0.787008076 1.574016153 0.000000000
pz 0 0.779811493 0.779811493 1.559622986 0.000000000
sum over m 2.353730090 2.353730090 4.707460179 0.000000000
px 1 -0.008727624 -0.008727624 -0.017455248 0.000000000
py 1 -0.008738822 -0.008738822 -0.017477644 0.000000000
pz 1 -0.006463367 -0.006463367 -0.012926734 0.000000000
sum over m -0.023929813 -0.023929813 -0.047859626 0.000000000
sum over m+mul 2.329800277 2.329800277 4.659600553 0.000000000
d3z^2-r^2 0 -0.006389922 -0.006389922 -0.012779845 0.000000000
dx^2-y^2 0 -0.005059210 -0.005059210 -0.010118420 0.000000000
dxy 0 -0.005433824 -0.005433824 -0.010867647 0.000000000
dxz 0 -0.006932427 -0.006932427 -0.013864854 0.000000000
dyz 0 -0.006928883 -0.006928883 -0.013857765 0.000000000
sum over m -0.030744266 -0.030744266 -0.061488531 0.000000000
sum over m+mul -0.030744266 -0.030744266 -0.061488531 0.000000000
641 O Up spin Down spin Sum Diff
multiple
s 0 0.893886339 0.893886339 1.787772678 0.000000000
sum over m 0.893886339 0.893886339 1.787772678 0.000000000
s 1 -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m+mul 0.890843777 0.890843777 1.781687554 0.000000000
px 0 0.787069304 0.787069304 1.574138608 0.000000000
py 0 0.786877517 0.786877517 1.573755034 0.000000000
pz 0 0.779775813 0.779775813 1.559551626 0.000000000
sum over m 2.353722634 2.353722634 4.707445268 0.000000000
px 1 -0.008737633 -0.008737633 -0.017475265 0.000000000
py 1 -0.008739259 -0.008739259 -0.017478518 0.000000000
pz 1 -0.006463379 -0.006463379 -0.012926759 0.000000000
sum over m -0.023940271 -0.023940271 -0.047880542 0.000000000
sum over m+mul 2.329782363 2.329782363 4.659564726 0.000000000
d3z^2-r^2 0 -0.006389979 -0.006389979 -0.012779958 0.000000000
dx^2-y^2 0 -0.005057691 -0.005057691 -0.010115383 0.000000000
dxy 0 -0.005433292 -0.005433292 -0.010866584 0.000000000
dxz 0 -0.006928514 -0.006928514 -0.013857028 0.000000000
dyz 0 -0.006930501 -0.006930501 -0.013861002 0.000000000
sum over m -0.030739977 -0.030739977 -0.061479954 0.000000000
sum over m+mul -0.030739977 -0.030739977 -0.061479954 0.000000000
642 O Up spin Down spin Sum Diff
multiple
s 0 0.893881298 0.893881298 1.787762596 0.000000000
sum over m 0.893881298 0.893881298 1.787762596 0.000000000
s 1 -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m+mul 0.890838813 0.890838813 1.781677626 0.000000000
px 0 0.786977266 0.786977266 1.573954533 0.000000000
py 0 0.786978394 0.786978394 1.573956787 0.000000000
pz 0 0.779778276 0.779778276 1.559556551 0.000000000
sum over m 2.353733936 2.353733936 4.707467871 0.000000000
px 1 -0.008729574 -0.008729574 -0.017459148 0.000000000
py 1 -0.008737772 -0.008737772 -0.017475544 0.000000000
pz 1 -0.006460567 -0.006460567 -0.012921134 0.000000000
sum over m -0.023927913 -0.023927913 -0.047855826 0.000000000
sum over m+mul 2.329806023 2.329806023 4.659612045 0.000000000
d3z^2-r^2 0 -0.006389700 -0.006389700 -0.012779401 0.000000000
dx^2-y^2 0 -0.005057871 -0.005057871 -0.010115741 0.000000000
dxy 0 -0.005433956 -0.005433956 -0.010867912 0.000000000
dxz 0 -0.006930158 -0.006930158 -0.013860316 0.000000000
dyz 0 -0.006927692 -0.006927692 -0.013855384 0.000000000
sum over m -0.030739377 -0.030739377 -0.061478754 0.000000000
sum over m+mul -0.030739377 -0.030739377 -0.061478754 0.000000000
643 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000770732 1.000770732 2.001541464 0.000000000
sum over m 1.000770732 1.000770732 2.001541464 0.000000000
s 1 0.207415353 0.207415353 0.414830707 0.000000000
sum over m 0.207415353 0.207415353 0.414830707 0.000000000
s 2 0.014725018 0.014725018 0.029450037 0.000000000
sum over m 0.014725018 0.014725018 0.029450037 0.000000000
sum over m+mul 1.222911104 1.222911104 2.445822208 0.000000000
px 0 1.006363497 1.006363497 2.012726993 0.000000000
py 0 1.006377070 1.006377070 2.012754140 0.000000000
pz 0 1.006197348 1.006197348 2.012394695 0.000000000
sum over m 3.018937914 3.018937914 6.037875828 0.000000000
px 1 0.065430544 0.065430544 0.130861088 0.000000000
py 1 0.065435974 0.065435974 0.130871948 0.000000000
pz 1 0.040378093 0.040378093 0.080756186 0.000000000
sum over m 0.171244611 0.171244611 0.342489222 0.000000000
sum over m+mul 3.190182525 3.190182525 6.380365050 0.000000000
d3z^2-r^2 0 0.196300924 0.196300924 0.392601848 0.000000000
dx^2-y^2 0 0.201509474 0.201509474 0.403018948 0.000000000
dxy 0 0.250938064 0.250938064 0.501876129 0.000000000
dxz 0 0.268515406 0.268515406 0.537030813 0.000000000
dyz 0 0.268491138 0.268491138 0.536982277 0.000000000
sum over m 1.185755007 1.185755007 2.371510014 0.000000000
d3z^2-r^2 1 0.003475239 0.003475239 0.006950478 0.000000000
dx^2-y^2 1 -0.004476268 -0.004476268 -0.008952536 0.000000000
dxy 1 0.015340008 0.015340008 0.030680016 0.000000000
dxz 1 0.003489873 0.003489873 0.006979746 0.000000000
dyz 1 0.003489582 0.003489582 0.006979164 0.000000000
sum over m 0.021318434 0.021318434 0.042636868 0.000000000
sum over m+mul 1.207073441 1.207073441 2.414146882 0.000000000
644 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778689 1.000778689 2.001557378 0.000000000
sum over m 1.000778689 1.000778689 2.001557378 0.000000000
s 1 0.207427937 0.207427937 0.414855874 0.000000000
sum over m 0.207427937 0.207427937 0.414855874 0.000000000
s 2 0.014724840 0.014724840 0.029449681 0.000000000
sum over m 0.014724840 0.014724840 0.029449681 0.000000000
sum over m+mul 1.222931466 1.222931466 2.445862933 0.000000000
px 0 1.006362938 1.006362938 2.012725875 0.000000000
py 0 1.006378244 1.006378244 2.012756488 0.000000000
pz 0 1.006192809 1.006192809 2.012385617 0.000000000
sum over m 3.018933990 3.018933990 6.037867981 0.000000000
px 1 0.065445106 0.065445106 0.130890212 0.000000000
py 1 0.065430970 0.065430970 0.130861940 0.000000000
pz 1 0.040376747 0.040376747 0.080753493 0.000000000
sum over m 0.171252822 0.171252822 0.342505645 0.000000000
sum over m+mul 3.190186813 3.190186813 6.380373626 0.000000000
d3z^2-r^2 0 0.196306657 0.196306657 0.392613314 0.000000000
dx^2-y^2 0 0.201501412 0.201501412 0.403002824 0.000000000
dxy 0 0.250950786 0.250950786 0.501901572 0.000000000
dxz 0 0.268511716 0.268511716 0.537023433 0.000000000
dyz 0 0.268477950 0.268477950 0.536955900 0.000000000
sum over m 1.185748521 1.185748521 2.371497042 0.000000000
d3z^2-r^2 1 0.003474151 0.003474151 0.006948302 0.000000000
dx^2-y^2 1 -0.004476884 -0.004476884 -0.008953767 0.000000000
dxy 1 0.015339214 0.015339214 0.030678429 0.000000000
dxz 1 0.003491773 0.003491773 0.006983546 0.000000000
dyz 1 0.003488727 0.003488727 0.006977455 0.000000000
sum over m 0.021316982 0.021316982 0.042633964 0.000000000
sum over m+mul 1.207065503 1.207065503 2.414131006 0.000000000
645 O Up spin Down spin Sum Diff
multiple
s 0 0.893895019 0.893895019 1.787790038 0.000000000
sum over m 0.893895019 0.893895019 1.787790038 0.000000000
s 1 -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m+mul 0.890852483 0.890852483 1.781704965 0.000000000
px 0 0.786966454 0.786966454 1.573932907 0.000000000
py 0 0.787056712 0.787056712 1.574113423 0.000000000
pz 0 0.779743447 0.779743447 1.559486895 0.000000000
sum over m 2.353766613 2.353766613 4.707533225 0.000000000
px 1 -0.008730480 -0.008730480 -0.017460960 0.000000000
py 1 -0.008739472 -0.008739472 -0.017478944 0.000000000
pz 1 -0.006458433 -0.006458433 -0.012916867 0.000000000
sum over m -0.023928385 -0.023928385 -0.047856770 0.000000000
sum over m+mul 2.329838227 2.329838227 4.659676455 0.000000000
d3z^2-r^2 0 -0.006389905 -0.006389905 -0.012779810 0.000000000
dx^2-y^2 0 -0.005056718 -0.005056718 -0.010113437 0.000000000
dxy 0 -0.005434763 -0.005434763 -0.010869526 0.000000000
dxz 0 -0.006929867 -0.006929867 -0.013859734 0.000000000
dyz 0 -0.006925027 -0.006925027 -0.013850053 0.000000000
sum over m -0.030736281 -0.030736281 -0.061472561 0.000000000
sum over m+mul -0.030736281 -0.030736281 -0.061472561 0.000000000
646 O Up spin Down spin Sum Diff
multiple
s 0 0.893874732 0.893874732 1.787749463 0.000000000
sum over m 0.893874732 0.893874732 1.787749463 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m+mul 0.890832556 0.890832556 1.781665113 0.000000000
px 0 0.786910520 0.786910520 1.573821040 0.000000000
py 0 0.787008076 0.787008076 1.574016153 0.000000000
pz 0 0.779811493 0.779811493 1.559622987 0.000000000
sum over m 2.353730090 2.353730090 4.707460180 0.000000000
px 1 -0.008727624 -0.008727624 -0.017455248 0.000000000
py 1 -0.008738822 -0.008738822 -0.017477644 0.000000000
pz 1 -0.006463367 -0.006463367 -0.012926734 0.000000000
sum over m -0.023929813 -0.023929813 -0.047859626 0.000000000
sum over m+mul 2.329800277 2.329800277 4.659600554 0.000000000
d3z^2-r^2 0 -0.006389922 -0.006389922 -0.012779845 0.000000000
dx^2-y^2 0 -0.005059210 -0.005059210 -0.010118420 0.000000000
dxy 0 -0.005433824 -0.005433824 -0.010867647 0.000000000
dxz 0 -0.006932427 -0.006932427 -0.013864854 0.000000000
dyz 0 -0.006928883 -0.006928883 -0.013857765 0.000000000
sum over m -0.030744266 -0.030744266 -0.061488531 0.000000000
sum over m+mul -0.030744266 -0.030744266 -0.061488531 0.000000000
647 O Up spin Down spin Sum Diff
multiple
s 0 0.893886339 0.893886339 1.787772678 0.000000000
sum over m 0.893886339 0.893886339 1.787772678 0.000000000
s 1 -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m+mul 0.890843777 0.890843777 1.781687554 0.000000000
px 0 0.787069304 0.787069304 1.574138608 0.000000000
py 0 0.786877517 0.786877517 1.573755035 0.000000000
pz 0 0.779775813 0.779775813 1.559551627 0.000000000
sum over m 2.353722634 2.353722634 4.707445269 0.000000000
px 1 -0.008737633 -0.008737633 -0.017475265 0.000000000
py 1 -0.008739259 -0.008739259 -0.017478518 0.000000000
pz 1 -0.006463379 -0.006463379 -0.012926759 0.000000000
sum over m -0.023940271 -0.023940271 -0.047880542 0.000000000
sum over m+mul 2.329782363 2.329782363 4.659564727 0.000000000
d3z^2-r^2 0 -0.006389979 -0.006389979 -0.012779958 0.000000000
dx^2-y^2 0 -0.005057691 -0.005057691 -0.010115383 0.000000000
dxy 0 -0.005433292 -0.005433292 -0.010866584 0.000000000
dxz 0 -0.006928514 -0.006928514 -0.013857028 0.000000000
dyz 0 -0.006930501 -0.006930501 -0.013861002 0.000000000
sum over m -0.030739977 -0.030739977 -0.061479954 0.000000000
sum over m+mul -0.030739977 -0.030739977 -0.061479954 0.000000000
648 O Up spin Down spin Sum Diff
multiple
s 0 0.893881298 0.893881298 1.787762596 0.000000000
sum over m 0.893881298 0.893881298 1.787762596 0.000000000
s 1 -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m+mul 0.890838813 0.890838813 1.781677626 0.000000000
px 0 0.786977266 0.786977266 1.573954533 0.000000000
py 0 0.786978394 0.786978394 1.573956787 0.000000000
pz 0 0.779778276 0.779778276 1.559556552 0.000000000
sum over m 2.353733936 2.353733936 4.707467871 0.000000000
px 1 -0.008729574 -0.008729574 -0.017459148 0.000000000
py 1 -0.008737772 -0.008737772 -0.017475544 0.000000000
pz 1 -0.006460567 -0.006460567 -0.012921134 0.000000000
sum over m -0.023927913 -0.023927913 -0.047855826 0.000000000
sum over m+mul 2.329806022 2.329806022 4.659612045 0.000000000
d3z^2-r^2 0 -0.006389700 -0.006389700 -0.012779401 0.000000000
dx^2-y^2 0 -0.005057871 -0.005057871 -0.010115741 0.000000000
dxy 0 -0.005433956 -0.005433956 -0.010867912 0.000000000
dxz 0 -0.006930158 -0.006930158 -0.013860316 0.000000000
dyz 0 -0.006927692 -0.006927692 -0.013855384 0.000000000
sum over m -0.030739377 -0.030739377 -0.061478754 0.000000000
sum over m+mul -0.030739377 -0.030739377 -0.061478754 0.000000000
649 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000770732 1.000770732 2.001541465 0.000000000
sum over m 1.000770732 1.000770732 2.001541465 0.000000000
s 1 0.207415353 0.207415353 0.414830706 0.000000000
sum over m 0.207415353 0.207415353 0.414830706 0.000000000
s 2 0.014725018 0.014725018 0.029450037 0.000000000
sum over m 0.014725018 0.014725018 0.029450037 0.000000000
sum over m+mul 1.222911104 1.222911104 2.445822207 0.000000000
px 0 1.006363497 1.006363497 2.012726993 0.000000000
py 0 1.006377070 1.006377070 2.012754140 0.000000000
pz 0 1.006197347 1.006197347 2.012394695 0.000000000
sum over m 3.018937914 3.018937914 6.037875828 0.000000000
px 1 0.065430544 0.065430544 0.130861088 0.000000000
py 1 0.065435974 0.065435974 0.130871948 0.000000000
pz 1 0.040378093 0.040378093 0.080756186 0.000000000
sum over m 0.171244611 0.171244611 0.342489222 0.000000000
sum over m+mul 3.190182525 3.190182525 6.380365050 0.000000000
d3z^2-r^2 0 0.196300924 0.196300924 0.392601848 0.000000000
dx^2-y^2 0 0.201509474 0.201509474 0.403018949 0.000000000
dxy 0 0.250938064 0.250938064 0.501876129 0.000000000
dxz 0 0.268515406 0.268515406 0.537030812 0.000000000
dyz 0 0.268491138 0.268491138 0.536982276 0.000000000
sum over m 1.185755007 1.185755007 2.371510014 0.000000000
d3z^2-r^2 1 0.003475239 0.003475239 0.006950478 0.000000000
dx^2-y^2 1 -0.004476268 -0.004476268 -0.008952536 0.000000000
dxy 1 0.015340008 0.015340008 0.030680016 0.000000000
dxz 1 0.003489873 0.003489873 0.006979746 0.000000000
dyz 1 0.003489582 0.003489582 0.006979164 0.000000000
sum over m 0.021318434 0.021318434 0.042636868 0.000000000
sum over m+mul 1.207073441 1.207073441 2.414146882 0.000000000
650 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778689 1.000778689 2.001557378 0.000000000
sum over m 1.000778689 1.000778689 2.001557378 0.000000000
s 1 0.207427937 0.207427937 0.414855874 0.000000000
sum over m 0.207427937 0.207427937 0.414855874 0.000000000
s 2 0.014724840 0.014724840 0.029449681 0.000000000
sum over m 0.014724840 0.014724840 0.029449681 0.000000000
sum over m+mul 1.222931466 1.222931466 2.445862933 0.000000000
px 0 1.006362938 1.006362938 2.012725875 0.000000000
py 0 1.006378244 1.006378244 2.012756488 0.000000000
pz 0 1.006192809 1.006192809 2.012385618 0.000000000
sum over m 3.018933990 3.018933990 6.037867981 0.000000000
px 1 0.065445106 0.065445106 0.130890212 0.000000000
py 1 0.065430970 0.065430970 0.130861939 0.000000000
pz 1 0.040376747 0.040376747 0.080753493 0.000000000
sum over m 0.171252822 0.171252822 0.342505645 0.000000000
sum over m+mul 3.190186813 3.190186813 6.380373625 0.000000000
d3z^2-r^2 0 0.196306657 0.196306657 0.392613314 0.000000000
dx^2-y^2 0 0.201501412 0.201501412 0.403002824 0.000000000
dxy 0 0.250950786 0.250950786 0.501901572 0.000000000
dxz 0 0.268511716 0.268511716 0.537023433 0.000000000
dyz 0 0.268477950 0.268477950 0.536955900 0.000000000
sum over m 1.185748521 1.185748521 2.371497042 0.000000000
d3z^2-r^2 1 0.003474151 0.003474151 0.006948302 0.000000000
dx^2-y^2 1 -0.004476884 -0.004476884 -0.008953767 0.000000000
dxy 1 0.015339214 0.015339214 0.030678429 0.000000000
dxz 1 0.003491773 0.003491773 0.006983546 0.000000000
dyz 1 0.003488727 0.003488727 0.006977455 0.000000000
sum over m 0.021316982 0.021316982 0.042633964 0.000000000
sum over m+mul 1.207065503 1.207065503 2.414131006 0.000000000
651 O Up spin Down spin Sum Diff
multiple
s 0 0.893895019 0.893895019 1.787790038 0.000000000
sum over m 0.893895019 0.893895019 1.787790038 0.000000000
s 1 -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m+mul 0.890852483 0.890852483 1.781704966 0.000000000
px 0 0.786966454 0.786966454 1.573932907 0.000000000
py 0 0.787056712 0.787056712 1.574113423 0.000000000
pz 0 0.779743447 0.779743447 1.559486895 0.000000000
sum over m 2.353766613 2.353766613 4.707533225 0.000000000
px 1 -0.008730480 -0.008730480 -0.017460960 0.000000000
py 1 -0.008739472 -0.008739472 -0.017478944 0.000000000
pz 1 -0.006458433 -0.006458433 -0.012916866 0.000000000
sum over m -0.023928385 -0.023928385 -0.047856770 0.000000000
sum over m+mul 2.329838227 2.329838227 4.659676455 0.000000000
d3z^2-r^2 0 -0.006389905 -0.006389905 -0.012779810 0.000000000
dx^2-y^2 0 -0.005056718 -0.005056718 -0.010113437 0.000000000
dxy 0 -0.005434763 -0.005434763 -0.010869526 0.000000000
dxz 0 -0.006929867 -0.006929867 -0.013859734 0.000000000
dyz 0 -0.006925027 -0.006925027 -0.013850053 0.000000000
sum over m -0.030736281 -0.030736281 -0.061472561 0.000000000
sum over m+mul -0.030736281 -0.030736281 -0.061472561 0.000000000
652 O Up spin Down spin Sum Diff
multiple
s 0 0.893874732 0.893874732 1.787749463 0.000000000
sum over m 0.893874732 0.893874732 1.787749463 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m+mul 0.890832556 0.890832556 1.781665113 0.000000000
px 0 0.786910520 0.786910520 1.573821040 0.000000000
py 0 0.787008076 0.787008076 1.574016153 0.000000000
pz 0 0.779811493 0.779811493 1.559622987 0.000000000
sum over m 2.353730090 2.353730090 4.707460179 0.000000000
px 1 -0.008727624 -0.008727624 -0.017455248 0.000000000
py 1 -0.008738822 -0.008738822 -0.017477644 0.000000000
pz 1 -0.006463367 -0.006463367 -0.012926734 0.000000000
sum over m -0.023929813 -0.023929813 -0.047859626 0.000000000
sum over m+mul 2.329800277 2.329800277 4.659600554 0.000000000
d3z^2-r^2 0 -0.006389922 -0.006389922 -0.012779845 0.000000000
dx^2-y^2 0 -0.005059210 -0.005059210 -0.010118420 0.000000000
dxy 0 -0.005433824 -0.005433824 -0.010867647 0.000000000
dxz 0 -0.006932427 -0.006932427 -0.013864854 0.000000000
dyz 0 -0.006928883 -0.006928883 -0.013857765 0.000000000
sum over m -0.030744266 -0.030744266 -0.061488531 0.000000000
sum over m+mul -0.030744266 -0.030744266 -0.061488531 0.000000000
653 O Up spin Down spin Sum Diff
multiple
s 0 0.893886339 0.893886339 1.787772678 0.000000000
sum over m 0.893886339 0.893886339 1.787772678 0.000000000
s 1 -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m+mul 0.890843777 0.890843777 1.781687554 0.000000000
px 0 0.787069304 0.787069304 1.574138608 0.000000000
py 0 0.786877517 0.786877517 1.573755034 0.000000000
pz 0 0.779775813 0.779775813 1.559551626 0.000000000
sum over m 2.353722634 2.353722634 4.707445268 0.000000000
px 1 -0.008737633 -0.008737633 -0.017475265 0.000000000
py 1 -0.008739259 -0.008739259 -0.017478518 0.000000000
pz 1 -0.006463379 -0.006463379 -0.012926759 0.000000000
sum over m -0.023940271 -0.023940271 -0.047880542 0.000000000
sum over m+mul 2.329782363 2.329782363 4.659564726 0.000000000
d3z^2-r^2 0 -0.006389979 -0.006389979 -0.012779958 0.000000000
dx^2-y^2 0 -0.005057691 -0.005057691 -0.010115383 0.000000000
dxy 0 -0.005433292 -0.005433292 -0.010866584 0.000000000
dxz 0 -0.006928514 -0.006928514 -0.013857028 0.000000000
dyz 0 -0.006930501 -0.006930501 -0.013861002 0.000000000
sum over m -0.030739977 -0.030739977 -0.061479954 0.000000000
sum over m+mul -0.030739977 -0.030739977 -0.061479954 0.000000000
654 O Up spin Down spin Sum Diff
multiple
s 0 0.893881298 0.893881298 1.787762596 0.000000000
sum over m 0.893881298 0.893881298 1.787762596 0.000000000
s 1 -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m+mul 0.890838813 0.890838813 1.781677626 0.000000000
px 0 0.786977266 0.786977266 1.573954533 0.000000000
py 0 0.786978394 0.786978394 1.573956787 0.000000000
pz 0 0.779778276 0.779778276 1.559556552 0.000000000
sum over m 2.353733936 2.353733936 4.707467872 0.000000000
px 1 -0.008729574 -0.008729574 -0.017459148 0.000000000
py 1 -0.008737772 -0.008737772 -0.017475544 0.000000000
pz 1 -0.006460567 -0.006460567 -0.012921134 0.000000000
sum over m -0.023927913 -0.023927913 -0.047855826 0.000000000
sum over m+mul 2.329806023 2.329806023 4.659612046 0.000000000
d3z^2-r^2 0 -0.006389700 -0.006389700 -0.012779401 0.000000000
dx^2-y^2 0 -0.005057871 -0.005057871 -0.010115741 0.000000000
dxy 0 -0.005433956 -0.005433956 -0.010867912 0.000000000
dxz 0 -0.006930158 -0.006930158 -0.013860316 0.000000000
dyz 0 -0.006927692 -0.006927692 -0.013855384 0.000000000
sum over m -0.030739377 -0.030739377 -0.061478754 0.000000000
sum over m+mul -0.030739377 -0.030739377 -0.061478754 0.000000000
655 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000770732 1.000770732 2.001541465 0.000000000
sum over m 1.000770732 1.000770732 2.001541465 0.000000000
s 1 0.207415353 0.207415353 0.414830707 0.000000000
sum over m 0.207415353 0.207415353 0.414830707 0.000000000
s 2 0.014725018 0.014725018 0.029450037 0.000000000
sum over m 0.014725018 0.014725018 0.029450037 0.000000000
sum over m+mul 1.222911104 1.222911104 2.445822208 0.000000000
px 0 1.006363497 1.006363497 2.012726994 0.000000000
py 0 1.006377070 1.006377070 2.012754140 0.000000000
pz 0 1.006197348 1.006197348 2.012394695 0.000000000
sum over m 3.018937914 3.018937914 6.037875829 0.000000000
px 1 0.065430544 0.065430544 0.130861088 0.000000000
py 1 0.065435974 0.065435974 0.130871948 0.000000000
pz 1 0.040378093 0.040378093 0.080756186 0.000000000
sum over m 0.171244611 0.171244611 0.342489222 0.000000000
sum over m+mul 3.190182525 3.190182525 6.380365051 0.000000000
d3z^2-r^2 0 0.196300924 0.196300924 0.392601848 0.000000000
dx^2-y^2 0 0.201509474 0.201509474 0.403018948 0.000000000
dxy 0 0.250938064 0.250938064 0.501876129 0.000000000
dxz 0 0.268515406 0.268515406 0.537030813 0.000000000
dyz 0 0.268491138 0.268491138 0.536982277 0.000000000
sum over m 1.185755007 1.185755007 2.371510014 0.000000000
d3z^2-r^2 1 0.003475239 0.003475239 0.006950478 0.000000000
dx^2-y^2 1 -0.004476268 -0.004476268 -0.008952536 0.000000000
dxy 1 0.015340008 0.015340008 0.030680016 0.000000000
dxz 1 0.003489873 0.003489873 0.006979746 0.000000000
dyz 1 0.003489582 0.003489582 0.006979164 0.000000000
sum over m 0.021318434 0.021318434 0.042636868 0.000000000
sum over m+mul 1.207073441 1.207073441 2.414146882 0.000000000
656 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778689 1.000778689 2.001557378 0.000000000
sum over m 1.000778689 1.000778689 2.001557378 0.000000000
s 1 0.207427937 0.207427937 0.414855874 0.000000000
sum over m 0.207427937 0.207427937 0.414855874 0.000000000
s 2 0.014724840 0.014724840 0.029449681 0.000000000
sum over m 0.014724840 0.014724840 0.029449681 0.000000000
sum over m+mul 1.222931466 1.222931466 2.445862933 0.000000000
px 0 1.006362938 1.006362938 2.012725875 0.000000000
py 0 1.006378244 1.006378244 2.012756488 0.000000000
pz 0 1.006192809 1.006192809 2.012385618 0.000000000
sum over m 3.018933991 3.018933991 6.037867981 0.000000000
px 1 0.065445106 0.065445106 0.130890212 0.000000000
py 1 0.065430970 0.065430970 0.130861940 0.000000000
pz 1 0.040376746 0.040376746 0.080753493 0.000000000
sum over m 0.171252822 0.171252822 0.342505644 0.000000000
sum over m+mul 3.190186813 3.190186813 6.380373625 0.000000000
d3z^2-r^2 0 0.196306657 0.196306657 0.392613314 0.000000000
dx^2-y^2 0 0.201501412 0.201501412 0.403002824 0.000000000
dxy 0 0.250950786 0.250950786 0.501901572 0.000000000
dxz 0 0.268511717 0.268511717 0.537023433 0.000000000
dyz 0 0.268477950 0.268477950 0.536955900 0.000000000
sum over m 1.185748521 1.185748521 2.371497043 0.000000000
d3z^2-r^2 1 0.003474151 0.003474151 0.006948302 0.000000000
dx^2-y^2 1 -0.004476884 -0.004476884 -0.008953767 0.000000000
dxy 1 0.015339214 0.015339214 0.030678429 0.000000000
dxz 1 0.003491773 0.003491773 0.006983546 0.000000000
dyz 1 0.003488727 0.003488727 0.006977455 0.000000000
sum over m 0.021316982 0.021316982 0.042633964 0.000000000
sum over m+mul 1.207065503 1.207065503 2.414131007 0.000000000
657 O Up spin Down spin Sum Diff
multiple
s 0 0.893895019 0.893895019 1.787790038 0.000000000
sum over m 0.893895019 0.893895019 1.787790038 0.000000000
s 1 -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m+mul 0.890852483 0.890852483 1.781704966 0.000000000
px 0 0.786966454 0.786966454 1.573932907 0.000000000
py 0 0.787056712 0.787056712 1.574113423 0.000000000
pz 0 0.779743447 0.779743447 1.559486894 0.000000000
sum over m 2.353766612 2.353766612 4.707533225 0.000000000
px 1 -0.008730480 -0.008730480 -0.017460960 0.000000000
py 1 -0.008739472 -0.008739472 -0.017478944 0.000000000
pz 1 -0.006458433 -0.006458433 -0.012916867 0.000000000
sum over m -0.023928385 -0.023928385 -0.047856770 0.000000000
sum over m+mul 2.329838227 2.329838227 4.659676454 0.000000000
d3z^2-r^2 0 -0.006389905 -0.006389905 -0.012779810 0.000000000
dx^2-y^2 0 -0.005056718 -0.005056718 -0.010113437 0.000000000
dxy 0 -0.005434763 -0.005434763 -0.010869526 0.000000000
dxz 0 -0.006929867 -0.006929867 -0.013859734 0.000000000
dyz 0 -0.006925027 -0.006925027 -0.013850053 0.000000000
sum over m -0.030736281 -0.030736281 -0.061472561 0.000000000
sum over m+mul -0.030736281 -0.030736281 -0.061472561 0.000000000
658 O Up spin Down spin Sum Diff
multiple
s 0 0.893874732 0.893874732 1.787749463 0.000000000
sum over m 0.893874732 0.893874732 1.787749463 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m+mul 0.890832556 0.890832556 1.781665113 0.000000000
px 0 0.786910520 0.786910520 1.573821039 0.000000000
py 0 0.787008076 0.787008076 1.574016153 0.000000000
pz 0 0.779811493 0.779811493 1.559622986 0.000000000
sum over m 2.353730089 2.353730089 4.707460179 0.000000000
px 1 -0.008727624 -0.008727624 -0.017455248 0.000000000
py 1 -0.008738822 -0.008738822 -0.017477644 0.000000000
pz 1 -0.006463367 -0.006463367 -0.012926734 0.000000000
sum over m -0.023929813 -0.023929813 -0.047859626 0.000000000
sum over m+mul 2.329800276 2.329800276 4.659600553 0.000000000
d3z^2-r^2 0 -0.006389922 -0.006389922 -0.012779845 0.000000000
dx^2-y^2 0 -0.005059210 -0.005059210 -0.010118420 0.000000000
dxy 0 -0.005433824 -0.005433824 -0.010867647 0.000000000
dxz 0 -0.006932427 -0.006932427 -0.013864854 0.000000000
dyz 0 -0.006928883 -0.006928883 -0.013857765 0.000000000
sum over m -0.030744266 -0.030744266 -0.061488531 0.000000000
sum over m+mul -0.030744266 -0.030744266 -0.061488531 0.000000000
659 O Up spin Down spin Sum Diff
multiple
s 0 0.893886339 0.893886339 1.787772678 0.000000000
sum over m 0.893886339 0.893886339 1.787772678 0.000000000
s 1 -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m+mul 0.890843777 0.890843777 1.781687554 0.000000000
px 0 0.787069304 0.787069304 1.574138608 0.000000000
py 0 0.786877517 0.786877517 1.573755034 0.000000000
pz 0 0.779775813 0.779775813 1.559551626 0.000000000
sum over m 2.353722634 2.353722634 4.707445268 0.000000000
px 1 -0.008737633 -0.008737633 -0.017475265 0.000000000
py 1 -0.008739259 -0.008739259 -0.017478518 0.000000000
pz 1 -0.006463379 -0.006463379 -0.012926759 0.000000000
sum over m -0.023940271 -0.023940271 -0.047880542 0.000000000
sum over m+mul 2.329782363 2.329782363 4.659564726 0.000000000
d3z^2-r^2 0 -0.006389979 -0.006389979 -0.012779958 0.000000000
dx^2-y^2 0 -0.005057691 -0.005057691 -0.010115383 0.000000000
dxy 0 -0.005433292 -0.005433292 -0.010866584 0.000000000
dxz 0 -0.006928514 -0.006928514 -0.013857028 0.000000000
dyz 0 -0.006930501 -0.006930501 -0.013861002 0.000000000
sum over m -0.030739977 -0.030739977 -0.061479954 0.000000000
sum over m+mul -0.030739977 -0.030739977 -0.061479954 0.000000000
660 O Up spin Down spin Sum Diff
multiple
s 0 0.893881298 0.893881298 1.787762596 0.000000000
sum over m 0.893881298 0.893881298 1.787762596 0.000000000
s 1 -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m+mul 0.890838813 0.890838813 1.781677625 0.000000000
px 0 0.786977266 0.786977266 1.573954532 0.000000000
py 0 0.786978393 0.786978393 1.573956787 0.000000000
pz 0 0.779778276 0.779778276 1.559556552 0.000000000
sum over m 2.353733936 2.353733936 4.707467871 0.000000000
px 1 -0.008729574 -0.008729574 -0.017459148 0.000000000
py 1 -0.008737772 -0.008737772 -0.017475544 0.000000000
pz 1 -0.006460567 -0.006460567 -0.012921134 0.000000000
sum over m -0.023927913 -0.023927913 -0.047855826 0.000000000
sum over m+mul 2.329806022 2.329806022 4.659612045 0.000000000
d3z^2-r^2 0 -0.006389700 -0.006389700 -0.012779401 0.000000000
dx^2-y^2 0 -0.005057871 -0.005057871 -0.010115741 0.000000000
dxy 0 -0.005433956 -0.005433956 -0.010867912 0.000000000
dxz 0 -0.006930158 -0.006930158 -0.013860316 0.000000000
dyz 0 -0.006927692 -0.006927692 -0.013855384 0.000000000
sum over m -0.030739377 -0.030739377 -0.061478754 0.000000000
sum over m+mul -0.030739377 -0.030739377 -0.061478754 0.000000000
661 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000770732 1.000770732 2.001541464 0.000000000
sum over m 1.000770732 1.000770732 2.001541464 0.000000000
s 1 0.207415353 0.207415353 0.414830707 0.000000000
sum over m 0.207415353 0.207415353 0.414830707 0.000000000
s 2 0.014725018 0.014725018 0.029450037 0.000000000
sum over m 0.014725018 0.014725018 0.029450037 0.000000000
sum over m+mul 1.222911104 1.222911104 2.445822208 0.000000000
px 0 1.006363497 1.006363497 2.012726994 0.000000000
py 0 1.006377070 1.006377070 2.012754140 0.000000000
pz 0 1.006197348 1.006197348 2.012394695 0.000000000
sum over m 3.018937914 3.018937914 6.037875829 0.000000000
px 1 0.065430544 0.065430544 0.130861088 0.000000000
py 1 0.065435974 0.065435974 0.130871948 0.000000000
pz 1 0.040378093 0.040378093 0.080756186 0.000000000
sum over m 0.171244611 0.171244611 0.342489222 0.000000000
sum over m+mul 3.190182525 3.190182525 6.380365051 0.000000000
d3z^2-r^2 0 0.196300924 0.196300924 0.392601848 0.000000000
dx^2-y^2 0 0.201509474 0.201509474 0.403018948 0.000000000
dxy 0 0.250938065 0.250938065 0.501876129 0.000000000
dxz 0 0.268515406 0.268515406 0.537030813 0.000000000
dyz 0 0.268491138 0.268491138 0.536982276 0.000000000
sum over m 1.185755007 1.185755007 2.371510014 0.000000000
d3z^2-r^2 1 0.003475239 0.003475239 0.006950478 0.000000000
dx^2-y^2 1 -0.004476268 -0.004476268 -0.008952536 0.000000000
dxy 1 0.015340008 0.015340008 0.030680016 0.000000000
dxz 1 0.003489873 0.003489873 0.006979746 0.000000000
dyz 1 0.003489582 0.003489582 0.006979164 0.000000000
sum over m 0.021318434 0.021318434 0.042636868 0.000000000
sum over m+mul 1.207073441 1.207073441 2.414146882 0.000000000
662 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778689 1.000778689 2.001557378 0.000000000
sum over m 1.000778689 1.000778689 2.001557378 0.000000000
s 1 0.207427937 0.207427937 0.414855875 0.000000000
sum over m 0.207427937 0.207427937 0.414855875 0.000000000
s 2 0.014724840 0.014724840 0.029449681 0.000000000
sum over m 0.014724840 0.014724840 0.029449681 0.000000000
sum over m+mul 1.222931466 1.222931466 2.445862933 0.000000000
px 0 1.006362938 1.006362938 2.012725875 0.000000000
py 0 1.006378244 1.006378244 2.012756488 0.000000000
pz 0 1.006192809 1.006192809 2.012385617 0.000000000
sum over m 3.018933990 3.018933990 6.037867981 0.000000000
px 1 0.065445106 0.065445106 0.130890212 0.000000000
py 1 0.065430970 0.065430970 0.130861940 0.000000000
pz 1 0.040376747 0.040376747 0.080753493 0.000000000
sum over m 0.171252823 0.171252823 0.342505645 0.000000000
sum over m+mul 3.190186813 3.190186813 6.380373626 0.000000000
d3z^2-r^2 0 0.196306657 0.196306657 0.392613314 0.000000000
dx^2-y^2 0 0.201501412 0.201501412 0.403002824 0.000000000
dxy 0 0.250950786 0.250950786 0.501901572 0.000000000
dxz 0 0.268511716 0.268511716 0.537023433 0.000000000
dyz 0 0.268477950 0.268477950 0.536955900 0.000000000
sum over m 1.185748521 1.185748521 2.371497043 0.000000000
d3z^2-r^2 1 0.003474151 0.003474151 0.006948302 0.000000000
dx^2-y^2 1 -0.004476884 -0.004476884 -0.008953767 0.000000000
dxy 1 0.015339214 0.015339214 0.030678429 0.000000000
dxz 1 0.003491773 0.003491773 0.006983546 0.000000000
dyz 1 0.003488727 0.003488727 0.006977455 0.000000000
sum over m 0.021316982 0.021316982 0.042633964 0.000000000
sum over m+mul 1.207065503 1.207065503 2.414131007 0.000000000
663 O Up spin Down spin Sum Diff
multiple
s 0 0.893895019 0.893895019 1.787790038 0.000000000
sum over m 0.893895019 0.893895019 1.787790038 0.000000000
s 1 -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m+mul 0.890852483 0.890852483 1.781704966 0.000000000
px 0 0.786966454 0.786966454 1.573932907 0.000000000
py 0 0.787056712 0.787056712 1.574113423 0.000000000
pz 0 0.779743447 0.779743447 1.559486894 0.000000000
sum over m 2.353766612 2.353766612 4.707533225 0.000000000
px 1 -0.008730480 -0.008730480 -0.017460960 0.000000000
py 1 -0.008739472 -0.008739472 -0.017478944 0.000000000
pz 1 -0.006458433 -0.006458433 -0.012916866 0.000000000
sum over m -0.023928385 -0.023928385 -0.047856770 0.000000000
sum over m+mul 2.329838227 2.329838227 4.659676454 0.000000000
d3z^2-r^2 0 -0.006389905 -0.006389905 -0.012779810 0.000000000
dx^2-y^2 0 -0.005056718 -0.005056718 -0.010113437 0.000000000
dxy 0 -0.005434763 -0.005434763 -0.010869526 0.000000000
dxz 0 -0.006929867 -0.006929867 -0.013859734 0.000000000
dyz 0 -0.006925027 -0.006925027 -0.013850053 0.000000000
sum over m -0.030736281 -0.030736281 -0.061472561 0.000000000
sum over m+mul -0.030736281 -0.030736281 -0.061472561 0.000000000
664 O Up spin Down spin Sum Diff
multiple
s 0 0.893874732 0.893874732 1.787749464 0.000000000
sum over m 0.893874732 0.893874732 1.787749464 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m+mul 0.890832556 0.890832556 1.781665113 0.000000000
px 0 0.786910520 0.786910520 1.573821040 0.000000000
py 0 0.787008076 0.787008076 1.574016153 0.000000000
pz 0 0.779811493 0.779811493 1.559622987 0.000000000
sum over m 2.353730090 2.353730090 4.707460179 0.000000000
px 1 -0.008727624 -0.008727624 -0.017455248 0.000000000
py 1 -0.008738822 -0.008738822 -0.017477644 0.000000000
pz 1 -0.006463367 -0.006463367 -0.012926734 0.000000000
sum over m -0.023929813 -0.023929813 -0.047859626 0.000000000
sum over m+mul 2.329800277 2.329800277 4.659600554 0.000000000
d3z^2-r^2 0 -0.006389922 -0.006389922 -0.012779845 0.000000000
dx^2-y^2 0 -0.005059210 -0.005059210 -0.010118420 0.000000000
dxy 0 -0.005433824 -0.005433824 -0.010867647 0.000000000
dxz 0 -0.006932427 -0.006932427 -0.013864854 0.000000000
dyz 0 -0.006928883 -0.006928883 -0.013857765 0.000000000
sum over m -0.030744266 -0.030744266 -0.061488531 0.000000000
sum over m+mul -0.030744266 -0.030744266 -0.061488531 0.000000000
665 O Up spin Down spin Sum Diff
multiple
s 0 0.893886339 0.893886339 1.787772678 0.000000000
sum over m 0.893886339 0.893886339 1.787772678 0.000000000
s 1 -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m+mul 0.890843777 0.890843777 1.781687554 0.000000000
px 0 0.787069304 0.787069304 1.574138608 0.000000000
py 0 0.786877517 0.786877517 1.573755034 0.000000000
pz 0 0.779775813 0.779775813 1.559551627 0.000000000
sum over m 2.353722635 2.353722635 4.707445269 0.000000000
px 1 -0.008737633 -0.008737633 -0.017475265 0.000000000
py 1 -0.008739259 -0.008739259 -0.017478518 0.000000000
pz 1 -0.006463379 -0.006463379 -0.012926759 0.000000000
sum over m -0.023940271 -0.023940271 -0.047880542 0.000000000
sum over m+mul 2.329782364 2.329782364 4.659564727 0.000000000
d3z^2-r^2 0 -0.006389979 -0.006389979 -0.012779958 0.000000000
dx^2-y^2 0 -0.005057691 -0.005057691 -0.010115383 0.000000000
dxy 0 -0.005433292 -0.005433292 -0.010866584 0.000000000
dxz 0 -0.006928514 -0.006928514 -0.013857028 0.000000000
dyz 0 -0.006930501 -0.006930501 -0.013861002 0.000000000
sum over m -0.030739977 -0.030739977 -0.061479954 0.000000000
sum over m+mul -0.030739977 -0.030739977 -0.061479954 0.000000000
666 O Up spin Down spin Sum Diff
multiple
s 0 0.893881298 0.893881298 1.787762596 0.000000000
sum over m 0.893881298 0.893881298 1.787762596 0.000000000
s 1 -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m+mul 0.890838813 0.890838813 1.781677626 0.000000000
px 0 0.786977266 0.786977266 1.573954533 0.000000000
py 0 0.786978393 0.786978393 1.573956787 0.000000000
pz 0 0.779778276 0.779778276 1.559556552 0.000000000
sum over m 2.353733936 2.353733936 4.707467872 0.000000000
px 1 -0.008729574 -0.008729574 -0.017459148 0.000000000
py 1 -0.008737772 -0.008737772 -0.017475544 0.000000000
pz 1 -0.006460567 -0.006460567 -0.012921134 0.000000000
sum over m -0.023927913 -0.023927913 -0.047855826 0.000000000
sum over m+mul 2.329806023 2.329806023 4.659612046 0.000000000
d3z^2-r^2 0 -0.006389700 -0.006389700 -0.012779401 0.000000000
dx^2-y^2 0 -0.005057871 -0.005057871 -0.010115741 0.000000000
dxy 0 -0.005433956 -0.005433956 -0.010867912 0.000000000
dxz 0 -0.006930158 -0.006930158 -0.013860316 0.000000000
dyz 0 -0.006927692 -0.006927692 -0.013855384 0.000000000
sum over m -0.030739377 -0.030739377 -0.061478754 0.000000000
sum over m+mul -0.030739377 -0.030739377 -0.061478754 0.000000000
667 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000770732 1.000770732 2.001541464 0.000000000
sum over m 1.000770732 1.000770732 2.001541464 0.000000000
s 1 0.207415353 0.207415353 0.414830707 0.000000000
sum over m 0.207415353 0.207415353 0.414830707 0.000000000
s 2 0.014725018 0.014725018 0.029450037 0.000000000
sum over m 0.014725018 0.014725018 0.029450037 0.000000000
sum over m+mul 1.222911104 1.222911104 2.445822208 0.000000000
px 0 1.006363497 1.006363497 2.012726994 0.000000000
py 0 1.006377070 1.006377070 2.012754140 0.000000000
pz 0 1.006197348 1.006197348 2.012394695 0.000000000
sum over m 3.018937914 3.018937914 6.037875829 0.000000000
px 1 0.065430544 0.065430544 0.130861088 0.000000000
py 1 0.065435974 0.065435974 0.130871948 0.000000000
pz 1 0.040378093 0.040378093 0.080756186 0.000000000
sum over m 0.171244611 0.171244611 0.342489222 0.000000000
sum over m+mul 3.190182525 3.190182525 6.380365051 0.000000000
d3z^2-r^2 0 0.196300924 0.196300924 0.392601848 0.000000000
dx^2-y^2 0 0.201509474 0.201509474 0.403018948 0.000000000
dxy 0 0.250938065 0.250938065 0.501876129 0.000000000
dxz 0 0.268515406 0.268515406 0.537030812 0.000000000
dyz 0 0.268491138 0.268491138 0.536982276 0.000000000
sum over m 1.185755007 1.185755007 2.371510014 0.000000000
d3z^2-r^2 1 0.003475239 0.003475239 0.006950478 0.000000000
dx^2-y^2 1 -0.004476268 -0.004476268 -0.008952536 0.000000000
dxy 1 0.015340008 0.015340008 0.030680016 0.000000000
dxz 1 0.003489873 0.003489873 0.006979746 0.000000000
dyz 1 0.003489582 0.003489582 0.006979164 0.000000000
sum over m 0.021318434 0.021318434 0.042636868 0.000000000
sum over m+mul 1.207073441 1.207073441 2.414146881 0.000000000
668 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778689 1.000778689 2.001557378 0.000000000
sum over m 1.000778689 1.000778689 2.001557378 0.000000000
s 1 0.207427937 0.207427937 0.414855875 0.000000000
sum over m 0.207427937 0.207427937 0.414855875 0.000000000
s 2 0.014724840 0.014724840 0.029449681 0.000000000
sum over m 0.014724840 0.014724840 0.029449681 0.000000000
sum over m+mul 1.222931467 1.222931467 2.445862933 0.000000000
px 0 1.006362937 1.006362937 2.012725875 0.000000000
py 0 1.006378244 1.006378244 2.012756488 0.000000000
pz 0 1.006192809 1.006192809 2.012385617 0.000000000
sum over m 3.018933990 3.018933990 6.037867980 0.000000000
px 1 0.065445106 0.065445106 0.130890212 0.000000000
py 1 0.065430970 0.065430970 0.130861940 0.000000000
pz 1 0.040376747 0.040376747 0.080753494 0.000000000
sum over m 0.171252823 0.171252823 0.342505646 0.000000000
sum over m+mul 3.190186813 3.190186813 6.380373626 0.000000000
d3z^2-r^2 0 0.196306657 0.196306657 0.392613314 0.000000000
dx^2-y^2 0 0.201501412 0.201501412 0.403002823 0.000000000
dxy 0 0.250950786 0.250950786 0.501901571 0.000000000
dxz 0 0.268511716 0.268511716 0.537023433 0.000000000
dyz 0 0.268477950 0.268477950 0.536955900 0.000000000
sum over m 1.185748521 1.185748521 2.371497041 0.000000000
d3z^2-r^2 1 0.003474151 0.003474151 0.006948302 0.000000000
dx^2-y^2 1 -0.004476884 -0.004476884 -0.008953767 0.000000000
dxy 1 0.015339214 0.015339214 0.030678429 0.000000000
dxz 1 0.003491773 0.003491773 0.006983546 0.000000000
dyz 1 0.003488727 0.003488727 0.006977455 0.000000000
sum over m 0.021316982 0.021316982 0.042633964 0.000000000
sum over m+mul 1.207065503 1.207065503 2.414131006 0.000000000
669 O Up spin Down spin Sum Diff
multiple
s 0 0.893895019 0.893895019 1.787790038 0.000000000
sum over m 0.893895019 0.893895019 1.787790038 0.000000000
s 1 -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m -0.003042536 -0.003042536 -0.006085072 0.000000000
sum over m+mul 0.890852483 0.890852483 1.781704966 0.000000000
px 0 0.786966454 0.786966454 1.573932907 0.000000000
py 0 0.787056712 0.787056712 1.574113423 0.000000000
pz 0 0.779743447 0.779743447 1.559486895 0.000000000
sum over m 2.353766613 2.353766613 4.707533225 0.000000000
px 1 -0.008730480 -0.008730480 -0.017460960 0.000000000
py 1 -0.008739472 -0.008739472 -0.017478944 0.000000000
pz 1 -0.006458433 -0.006458433 -0.012916866 0.000000000
sum over m -0.023928385 -0.023928385 -0.047856770 0.000000000
sum over m+mul 2.329838228 2.329838228 4.659676455 0.000000000
d3z^2-r^2 0 -0.006389905 -0.006389905 -0.012779810 0.000000000
dx^2-y^2 0 -0.005056718 -0.005056718 -0.010113437 0.000000000
dxy 0 -0.005434763 -0.005434763 -0.010869526 0.000000000
dxz 0 -0.006929867 -0.006929867 -0.013859734 0.000000000
dyz 0 -0.006925027 -0.006925027 -0.013850053 0.000000000
sum over m -0.030736281 -0.030736281 -0.061472561 0.000000000
sum over m+mul -0.030736281 -0.030736281 -0.061472561 0.000000000
670 O Up spin Down spin Sum Diff
multiple
s 0 0.893874732 0.893874732 1.787749464 0.000000000
sum over m 0.893874732 0.893874732 1.787749464 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084351 0.000000000
sum over m+mul 0.890832556 0.890832556 1.781665113 0.000000000
px 0 0.786910520 0.786910520 1.573821039 0.000000000
py 0 0.787008076 0.787008076 1.574016153 0.000000000
pz 0 0.779811493 0.779811493 1.559622987 0.000000000
sum over m 2.353730089 2.353730089 4.707460179 0.000000000
px 1 -0.008727624 -0.008727624 -0.017455248 0.000000000
py 1 -0.008738822 -0.008738822 -0.017477644 0.000000000
pz 1 -0.006463367 -0.006463367 -0.012926734 0.000000000
sum over m -0.023929813 -0.023929813 -0.047859626 0.000000000
sum over m+mul 2.329800276 2.329800276 4.659600553 0.000000000
d3z^2-r^2 0 -0.006389922 -0.006389922 -0.012779845 0.000000000
dx^2-y^2 0 -0.005059210 -0.005059210 -0.010118420 0.000000000
dxy 0 -0.005433824 -0.005433824 -0.010867647 0.000000000
dxz 0 -0.006932427 -0.006932427 -0.013864854 0.000000000
dyz 0 -0.006928883 -0.006928883 -0.013857765 0.000000000
sum over m -0.030744266 -0.030744266 -0.061488531 0.000000000
sum over m+mul -0.030744266 -0.030744266 -0.061488531 0.000000000
671 O Up spin Down spin Sum Diff
multiple
s 0 0.893886339 0.893886339 1.787772678 0.000000000
sum over m 0.893886339 0.893886339 1.787772678 0.000000000
s 1 -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m -0.003042562 -0.003042562 -0.006085124 0.000000000
sum over m+mul 0.890843777 0.890843777 1.781687554 0.000000000
px 0 0.787069304 0.787069304 1.574138607 0.000000000
py 0 0.786877517 0.786877517 1.573755034 0.000000000
pz 0 0.779775814 0.779775814 1.559551627 0.000000000
sum over m 2.353722634 2.353722634 4.707445268 0.000000000
px 1 -0.008737633 -0.008737633 -0.017475265 0.000000000
py 1 -0.008739259 -0.008739259 -0.017478518 0.000000000
pz 1 -0.006463379 -0.006463379 -0.012926759 0.000000000
sum over m -0.023940271 -0.023940271 -0.047880542 0.000000000
sum over m+mul 2.329782363 2.329782363 4.659564727 0.000000000
d3z^2-r^2 0 -0.006389979 -0.006389979 -0.012779958 0.000000000
dx^2-y^2 0 -0.005057691 -0.005057691 -0.010115383 0.000000000
dxy 0 -0.005433292 -0.005433292 -0.010866584 0.000000000
dxz 0 -0.006928514 -0.006928514 -0.013857028 0.000000000
dyz 0 -0.006930501 -0.006930501 -0.013861002 0.000000000
sum over m -0.030739977 -0.030739977 -0.061479954 0.000000000
sum over m+mul -0.030739977 -0.030739977 -0.061479954 0.000000000
672 O Up spin Down spin Sum Diff
multiple
s 0 0.893881298 0.893881298 1.787762596 0.000000000
sum over m 0.893881298 0.893881298 1.787762596 0.000000000
s 1 -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m -0.003042485 -0.003042485 -0.006084970 0.000000000
sum over m+mul 0.890838813 0.890838813 1.781677626 0.000000000
px 0 0.786977266 0.786977266 1.573954532 0.000000000
py 0 0.786978393 0.786978393 1.573956787 0.000000000
pz 0 0.779778276 0.779778276 1.559556552 0.000000000
sum over m 2.353733935 2.353733935 4.707467871 0.000000000
px 1 -0.008729574 -0.008729574 -0.017459148 0.000000000
py 1 -0.008737772 -0.008737772 -0.017475544 0.000000000
pz 1 -0.006460567 -0.006460567 -0.012921134 0.000000000
sum over m -0.023927913 -0.023927913 -0.047855826 0.000000000
sum over m+mul 2.329806022 2.329806022 4.659612045 0.000000000
d3z^2-r^2 0 -0.006389700 -0.006389700 -0.012779401 0.000000000
dx^2-y^2 0 -0.005057871 -0.005057871 -0.010115741 0.000000000
dxy 0 -0.005433956 -0.005433956 -0.010867912 0.000000000
dxz 0 -0.006930158 -0.006930158 -0.013860316 0.000000000
dyz 0 -0.006927692 -0.006927692 -0.013855384 0.000000000
sum over m -0.030739377 -0.030739377 -0.061478754 0.000000000
sum over m+mul -0.030739377 -0.030739377 -0.061478754 0.000000000
673 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779577 1.000779577 2.001559154 0.000000000
sum over m 1.000779577 1.000779577 2.001559154 0.000000000
s 1 0.207425039 0.207425039 0.414850079 0.000000000
sum over m 0.207425039 0.207425039 0.414850079 0.000000000
s 2 0.014724726 0.014724726 0.029449451 0.000000000
sum over m 0.014724726 0.014724726 0.029449451 0.000000000
sum over m+mul 1.222929342 1.222929342 2.445858684 0.000000000
px 0 1.006359477 1.006359477 2.012718954 0.000000000
py 0 1.006375717 1.006375717 2.012751433 0.000000000
pz 0 1.006191803 1.006191803 2.012383606 0.000000000
sum over m 3.018926997 3.018926997 6.037853994 0.000000000
px 1 0.065452492 0.065452492 0.130904985 0.000000000
py 1 0.065430210 0.065430210 0.130860420 0.000000000
pz 1 0.040372940 0.040372940 0.080745880 0.000000000
sum over m 0.171255642 0.171255642 0.342511284 0.000000000
sum over m+mul 3.190182639 3.190182639 6.380365278 0.000000000
d3z^2-r^2 0 0.196309784 0.196309784 0.392619567 0.000000000
dx^2-y^2 0 0.201500798 0.201500798 0.403001596 0.000000000
dxy 0 0.250952188 0.250952188 0.501904376 0.000000000
dxz 0 0.268509958 0.268509958 0.537019915 0.000000000
dyz 0 0.268478659 0.268478659 0.536957319 0.000000000
sum over m 1.185751386 1.185751386 2.371502773 0.000000000
d3z^2-r^2 1 0.003473749 0.003473749 0.006947498 0.000000000
dx^2-y^2 1 -0.004477316 -0.004477316 -0.008954633 0.000000000
dxy 1 0.015338915 0.015338915 0.030677830 0.000000000
dxz 1 0.003492566 0.003492566 0.006985132 0.000000000
dyz 1 0.003489870 0.003489870 0.006979740 0.000000000
sum over m 0.021317783 0.021317783 0.042635567 0.000000000
sum over m+mul 1.207069170 1.207069170 2.414138340 0.000000000
674 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000772532 1.000772532 2.001545063 0.000000000
sum over m 1.000772532 1.000772532 2.001545063 0.000000000
s 1 0.207415904 0.207415904 0.414831807 0.000000000
sum over m 0.207415904 0.207415904 0.414831807 0.000000000
s 2 0.014725570 0.014725570 0.029451141 0.000000000
sum over m 0.014725570 0.014725570 0.029451141 0.000000000
sum over m+mul 1.222914006 1.222914006 2.445828011 0.000000000
px 0 1.006362969 1.006362969 2.012725937 0.000000000
py 0 1.006375748 1.006375748 2.012751496 0.000000000
pz 0 1.006206692 1.006206692 2.012413384 0.000000000
sum over m 3.018945409 3.018945409 6.037890818 0.000000000
px 1 0.065445106 0.065445106 0.130890212 0.000000000
py 1 0.065437315 0.065437315 0.130874630 0.000000000
pz 1 0.040372054 0.040372054 0.080744108 0.000000000
sum over m 0.171254475 0.171254475 0.342508950 0.000000000
sum over m+mul 3.190199884 3.190199884 6.380399768 0.000000000
d3z^2-r^2 0 0.196309061 0.196309061 0.392618122 0.000000000
dx^2-y^2 0 0.201508894 0.201508894 0.403017788 0.000000000
dxy 0 0.250944584 0.250944584 0.501889169 0.000000000
dxz 0 0.268511824 0.268511824 0.537023649 0.000000000
dyz 0 0.268487265 0.268487265 0.536974531 0.000000000
sum over m 1.185761629 1.185761629 2.371523259 0.000000000
d3z^2-r^2 1 0.003476755 0.003476755 0.006953511 0.000000000
dx^2-y^2 1 -0.004475955 -0.004475955 -0.008951910 0.000000000
dxy 1 0.015341110 0.015341110 0.030682220 0.000000000
dxz 1 0.003494011 0.003494011 0.006988021 0.000000000
dyz 1 0.003491944 0.003491944 0.006983887 0.000000000
sum over m 0.021327865 0.021327865 0.042655730 0.000000000
sum over m+mul 1.207089494 1.207089494 2.414178989 0.000000000
675 O Up spin Down spin Sum Diff
multiple
s 0 0.893870943 0.893870943 1.787741885 0.000000000
sum over m 0.893870943 0.893870943 1.787741885 0.000000000
s 1 -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m+mul 0.890828330 0.890828330 1.781656659 0.000000000
px 0 0.786994693 0.786994693 1.573989386 0.000000000
py 0 0.786897584 0.786897584 1.573795169 0.000000000
pz 0 0.779811673 0.779811673 1.559623345 0.000000000
sum over m 2.353703950 2.353703950 4.707407900 0.000000000
px 1 -0.008732950 -0.008732950 -0.017465899 0.000000000
py 1 -0.008737807 -0.008737807 -0.017475614 0.000000000
pz 1 -0.006463991 -0.006463991 -0.012927982 0.000000000
sum over m -0.023934748 -0.023934748 -0.047869495 0.000000000
sum over m+mul 2.329769202 2.329769202 4.659538405 0.000000000
d3z^2-r^2 0 -0.006389251 -0.006389251 -0.012778503 0.000000000
dx^2-y^2 0 -0.005059228 -0.005059228 -0.010118457 0.000000000
dxy 0 -0.005432622 -0.005432622 -0.010865243 0.000000000
dxz 0 -0.006930964 -0.006930964 -0.013861928 0.000000000
dyz 0 -0.006931230 -0.006931230 -0.013862459 0.000000000
sum over m -0.030743295 -0.030743295 -0.061486591 0.000000000
sum over m+mul -0.030743295 -0.030743295 -0.061486591 0.000000000
676 O Up spin Down spin Sum Diff
multiple
s 0 0.893906891 0.893906891 1.787813783 0.000000000
sum over m 0.893906891 0.893906891 1.787813783 0.000000000
s 1 -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m+mul 0.890864516 0.890864516 1.781729032 0.000000000
px 0 0.786887384 0.786887384 1.573774769 0.000000000
py 0 0.787136278 0.787136278 1.574272556 0.000000000
pz 0 0.779756985 0.779756985 1.559513971 0.000000000
sum over m 2.353780648 2.353780648 4.707561295 0.000000000
px 1 -0.008733754 -0.008733754 -0.017467508 0.000000000
py 1 -0.008746839 -0.008746839 -0.017493677 0.000000000
pz 1 -0.006460947 -0.006460947 -0.012921894 0.000000000
sum over m -0.023941540 -0.023941540 -0.047883080 0.000000000
sum over m+mul 2.329839108 2.329839108 4.659678215 0.000000000
d3z^2-r^2 0 -0.006390928 -0.006390928 -0.012781856 0.000000000
dx^2-y^2 0 -0.005057555 -0.005057555 -0.010115110 0.000000000
dxy 0 -0.005435139 -0.005435139 -0.010870279 0.000000000
dxz 0 -0.006932324 -0.006932324 -0.013864649 0.000000000
dyz 0 -0.006925167 -0.006925167 -0.013850334 0.000000000
sum over m -0.030741114 -0.030741114 -0.061482228 0.000000000
sum over m+mul -0.030741114 -0.030741114 -0.061482228 0.000000000
677 O Up spin Down spin Sum Diff
multiple
s 0 0.893899160 0.893899160 1.787798320 0.000000000
sum over m 0.893899160 0.893899160 1.787798320 0.000000000
s 1 -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m+mul 0.890856653 0.890856653 1.781713306 0.000000000
px 0 0.787024779 0.787024779 1.574049559 0.000000000
py 0 0.787022915 0.787022915 1.574045830 0.000000000
pz 0 0.779715302 0.779715302 1.559430605 0.000000000
sum over m 2.353762997 2.353762997 4.707525993 0.000000000
px 1 -0.008731049 -0.008731049 -0.017462099 0.000000000
py 1 -0.008735679 -0.008735679 -0.017471359 0.000000000
pz 1 -0.006456233 -0.006456233 -0.012912467 0.000000000
sum over m -0.023922962 -0.023922962 -0.047845924 0.000000000
sum over m+mul 2.329840034 2.329840034 4.659680069 0.000000000
d3z^2-r^2 0 -0.006389845 -0.006389845 -0.012779690 0.000000000
dx^2-y^2 0 -0.005054724 -0.005054724 -0.010109447 0.000000000
dxy 0 -0.005435254 -0.005435254 -0.010870509 0.000000000
dxz 0 -0.006927007 -0.006927007 -0.013854014 0.000000000
dyz 0 -0.006924412 -0.006924412 -0.013848825 0.000000000
sum over m -0.030731242 -0.030731242 -0.061462485 0.000000000
sum over m+mul -0.030731242 -0.030731242 -0.061462485 0.000000000
678 O Up spin Down spin Sum Diff
multiple
s 0 0.893867015 0.893867015 1.787734031 0.000000000
sum over m 0.893867015 0.893867015 1.787734031 0.000000000
s 1 -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m+mul 0.890824536 0.890824536 1.781649071 0.000000000
px 0 0.787005556 0.787005556 1.574011111 0.000000000
py 0 0.786842943 0.786842943 1.573685885 0.000000000
pz 0 0.779835771 0.779835771 1.559671543 0.000000000
sum over m 2.353684270 2.353684270 4.707368539 0.000000000
px 1 -0.008736009 -0.008736009 -0.017472019 0.000000000
py 1 -0.008738660 -0.008738660 -0.017477321 0.000000000
pz 1 -0.006464666 -0.006464666 -0.012929333 0.000000000
sum over m -0.023939336 -0.023939336 -0.047878672 0.000000000
sum over m+mul 2.329744934 2.329744934 4.659489867 0.000000000
d3z^2-r^2 0 -0.006389283 -0.006389283 -0.012778566 0.000000000
dx^2-y^2 0 -0.005060255 -0.005060255 -0.010120510 0.000000000
dxy 0 -0.005432451 -0.005432451 -0.010864901 0.000000000
dxz 0 -0.006931778 -0.006931778 -0.013863555 0.000000000
dyz 0 -0.006933671 -0.006933671 -0.013867342 0.000000000
sum over m -0.030747437 -0.030747437 -0.061494875 0.000000000
sum over m+mul -0.030747437 -0.030747437 -0.061494875 0.000000000
679 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779577 1.000779577 2.001559154 0.000000000
sum over m 1.000779577 1.000779577 2.001559154 0.000000000
s 1 0.207425039 0.207425039 0.414850079 0.000000000
sum over m 0.207425039 0.207425039 0.414850079 0.000000000
s 2 0.014724726 0.014724726 0.029449451 0.000000000
sum over m 0.014724726 0.014724726 0.029449451 0.000000000
sum over m+mul 1.222929342 1.222929342 2.445858684 0.000000000
px 0 1.006359477 1.006359477 2.012718954 0.000000000
py 0 1.006375717 1.006375717 2.012751433 0.000000000
pz 0 1.006191803 1.006191803 2.012383607 0.000000000
sum over m 3.018926997 3.018926997 6.037853994 0.000000000
px 1 0.065452492 0.065452492 0.130904985 0.000000000
py 1 0.065430210 0.065430210 0.130860420 0.000000000
pz 1 0.040372939 0.040372939 0.080745878 0.000000000
sum over m 0.171255641 0.171255641 0.342511283 0.000000000
sum over m+mul 3.190182638 3.190182638 6.380365277 0.000000000
d3z^2-r^2 0 0.196309784 0.196309784 0.392619567 0.000000000
dx^2-y^2 0 0.201500798 0.201500798 0.403001596 0.000000000
dxy 0 0.250952188 0.250952188 0.501904376 0.000000000
dxz 0 0.268509958 0.268509958 0.537019915 0.000000000
dyz 0 0.268478659 0.268478659 0.536957319 0.000000000
sum over m 1.185751386 1.185751386 2.371502773 0.000000000
d3z^2-r^2 1 0.003473749 0.003473749 0.006947498 0.000000000
dx^2-y^2 1 -0.004477316 -0.004477316 -0.008954633 0.000000000
dxy 1 0.015338915 0.015338915 0.030677830 0.000000000
dxz 1 0.003492566 0.003492566 0.006985132 0.000000000
dyz 1 0.003489870 0.003489870 0.006979740 0.000000000
sum over m 0.021317783 0.021317783 0.042635567 0.000000000
sum over m+mul 1.207069170 1.207069170 2.414138339 0.000000000
680 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000772532 1.000772532 2.001545063 0.000000000
sum over m 1.000772532 1.000772532 2.001545063 0.000000000
s 1 0.207415904 0.207415904 0.414831807 0.000000000
sum over m 0.207415904 0.207415904 0.414831807 0.000000000
s 2 0.014725570 0.014725570 0.029451141 0.000000000
sum over m 0.014725570 0.014725570 0.029451141 0.000000000
sum over m+mul 1.222914006 1.222914006 2.445828011 0.000000000
px 0 1.006362969 1.006362969 2.012725938 0.000000000
py 0 1.006375748 1.006375748 2.012751496 0.000000000
pz 0 1.006206692 1.006206692 2.012413384 0.000000000
sum over m 3.018945409 3.018945409 6.037890817 0.000000000
px 1 0.065445106 0.065445106 0.130890212 0.000000000
py 1 0.065437315 0.065437315 0.130874630 0.000000000
pz 1 0.040372054 0.040372054 0.080744108 0.000000000
sum over m 0.171254475 0.171254475 0.342508951 0.000000000
sum over m+mul 3.190199884 3.190199884 6.380399768 0.000000000
d3z^2-r^2 0 0.196309061 0.196309061 0.392618122 0.000000000
dx^2-y^2 0 0.201508894 0.201508894 0.403017789 0.000000000
dxy 0 0.250944584 0.250944584 0.501889168 0.000000000
dxz 0 0.268511824 0.268511824 0.537023648 0.000000000
dyz 0 0.268487265 0.268487265 0.536974531 0.000000000
sum over m 1.185761629 1.185761629 2.371523258 0.000000000
d3z^2-r^2 1 0.003476755 0.003476755 0.006953511 0.000000000
dx^2-y^2 1 -0.004475955 -0.004475955 -0.008951910 0.000000000
dxy 1 0.015341110 0.015341110 0.030682220 0.000000000
dxz 1 0.003494011 0.003494011 0.006988021 0.000000000
dyz 1 0.003491944 0.003491944 0.006983887 0.000000000
sum over m 0.021327865 0.021327865 0.042655730 0.000000000
sum over m+mul 1.207089494 1.207089494 2.414178988 0.000000000
681 O Up spin Down spin Sum Diff
multiple
s 0 0.893870943 0.893870943 1.787741885 0.000000000
sum over m 0.893870943 0.893870943 1.787741885 0.000000000
s 1 -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m+mul 0.890828330 0.890828330 1.781656659 0.000000000
px 0 0.786994693 0.786994693 1.573989387 0.000000000
py 0 0.786897585 0.786897585 1.573795169 0.000000000
pz 0 0.779811673 0.779811673 1.559623345 0.000000000
sum over m 2.353703950 2.353703950 4.707407901 0.000000000
px 1 -0.008732950 -0.008732950 -0.017465899 0.000000000
py 1 -0.008737807 -0.008737807 -0.017475614 0.000000000
pz 1 -0.006463991 -0.006463991 -0.012927982 0.000000000
sum over m -0.023934748 -0.023934748 -0.047869495 0.000000000
sum over m+mul 2.329769203 2.329769203 4.659538406 0.000000000
d3z^2-r^2 0 -0.006389251 -0.006389251 -0.012778503 0.000000000
dx^2-y^2 0 -0.005059228 -0.005059228 -0.010118457 0.000000000
dxy 0 -0.005432622 -0.005432622 -0.010865243 0.000000000
dxz 0 -0.006930964 -0.006930964 -0.013861928 0.000000000
dyz 0 -0.006931230 -0.006931230 -0.013862459 0.000000000
sum over m -0.030743295 -0.030743295 -0.061486591 0.000000000
sum over m+mul -0.030743295 -0.030743295 -0.061486591 0.000000000
682 O Up spin Down spin Sum Diff
multiple
s 0 0.893906891 0.893906891 1.787813783 0.000000000
sum over m 0.893906891 0.893906891 1.787813783 0.000000000
s 1 -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m+mul 0.890864516 0.890864516 1.781729032 0.000000000
px 0 0.786887385 0.786887385 1.573774769 0.000000000
py 0 0.787136278 0.787136278 1.574272556 0.000000000
pz 0 0.779756985 0.779756985 1.559513970 0.000000000
sum over m 2.353780648 2.353780648 4.707561295 0.000000000
px 1 -0.008733754 -0.008733754 -0.017467508 0.000000000
py 1 -0.008746839 -0.008746839 -0.017493677 0.000000000
pz 1 -0.006460947 -0.006460947 -0.012921894 0.000000000
sum over m -0.023941540 -0.023941540 -0.047883080 0.000000000
sum over m+mul 2.329839108 2.329839108 4.659678216 0.000000000
d3z^2-r^2 0 -0.006390928 -0.006390928 -0.012781856 0.000000000
dx^2-y^2 0 -0.005057555 -0.005057555 -0.010115110 0.000000000
dxy 0 -0.005435139 -0.005435139 -0.010870279 0.000000000
dxz 0 -0.006932324 -0.006932324 -0.013864649 0.000000000
dyz 0 -0.006925167 -0.006925167 -0.013850334 0.000000000
sum over m -0.030741114 -0.030741114 -0.061482228 0.000000000
sum over m+mul -0.030741114 -0.030741114 -0.061482228 0.000000000
683 O Up spin Down spin Sum Diff
multiple
s 0 0.893899160 0.893899160 1.787798320 0.000000000
sum over m 0.893899160 0.893899160 1.787798320 0.000000000
s 1 -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m+mul 0.890856653 0.890856653 1.781713306 0.000000000
px 0 0.787024779 0.787024779 1.574049559 0.000000000
py 0 0.787022915 0.787022915 1.574045829 0.000000000
pz 0 0.779715302 0.779715302 1.559430605 0.000000000
sum over m 2.353762996 2.353762996 4.707525993 0.000000000
px 1 -0.008731050 -0.008731050 -0.017462099 0.000000000
py 1 -0.008735679 -0.008735679 -0.017471358 0.000000000
pz 1 -0.006456233 -0.006456233 -0.012912467 0.000000000
sum over m -0.023922962 -0.023922962 -0.047845924 0.000000000
sum over m+mul 2.329840034 2.329840034 4.659680068 0.000000000
d3z^2-r^2 0 -0.006389845 -0.006389845 -0.012779690 0.000000000
dx^2-y^2 0 -0.005054724 -0.005054724 -0.010109447 0.000000000
dxy 0 -0.005435254 -0.005435254 -0.010870509 0.000000000
dxz 0 -0.006927007 -0.006927007 -0.013854014 0.000000000
dyz 0 -0.006924412 -0.006924412 -0.013848825 0.000000000
sum over m -0.030731242 -0.030731242 -0.061462485 0.000000000
sum over m+mul -0.030731242 -0.030731242 -0.061462485 0.000000000
684 O Up spin Down spin Sum Diff
multiple
s 0 0.893867015 0.893867015 1.787734031 0.000000000
sum over m 0.893867015 0.893867015 1.787734031 0.000000000
s 1 -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m+mul 0.890824536 0.890824536 1.781649071 0.000000000
px 0 0.787005555 0.787005555 1.574011110 0.000000000
py 0 0.786842943 0.786842943 1.573685886 0.000000000
pz 0 0.779835771 0.779835771 1.559671543 0.000000000
sum over m 2.353684269 2.353684269 4.707368539 0.000000000
px 1 -0.008736009 -0.008736009 -0.017472019 0.000000000
py 1 -0.008738661 -0.008738661 -0.017477321 0.000000000
pz 1 -0.006464666 -0.006464666 -0.012929332 0.000000000
sum over m -0.023939336 -0.023939336 -0.047878672 0.000000000
sum over m+mul 2.329744933 2.329744933 4.659489866 0.000000000
d3z^2-r^2 0 -0.006389283 -0.006389283 -0.012778566 0.000000000
dx^2-y^2 0 -0.005060255 -0.005060255 -0.010120509 0.000000000
dxy 0 -0.005432451 -0.005432451 -0.010864901 0.000000000
dxz 0 -0.006931778 -0.006931778 -0.013863555 0.000000000
dyz 0 -0.006933671 -0.006933671 -0.013867342 0.000000000
sum over m -0.030747437 -0.030747437 -0.061494874 0.000000000
sum over m+mul -0.030747437 -0.030747437 -0.061494874 0.000000000
685 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779577 1.000779577 2.001559154 0.000000000
sum over m 1.000779577 1.000779577 2.001559154 0.000000000
s 1 0.207425039 0.207425039 0.414850078 0.000000000
sum over m 0.207425039 0.207425039 0.414850078 0.000000000
s 2 0.014724726 0.014724726 0.029449451 0.000000000
sum over m 0.014724726 0.014724726 0.029449451 0.000000000
sum over m+mul 1.222929342 1.222929342 2.445858684 0.000000000
px 0 1.006359477 1.006359477 2.012718954 0.000000000
py 0 1.006375717 1.006375717 2.012751433 0.000000000
pz 0 1.006191803 1.006191803 2.012383606 0.000000000
sum over m 3.018926997 3.018926997 6.037853994 0.000000000
px 1 0.065452492 0.065452492 0.130904985 0.000000000
py 1 0.065430210 0.065430210 0.130860420 0.000000000
pz 1 0.040372939 0.040372939 0.080745879 0.000000000
sum over m 0.171255642 0.171255642 0.342511283 0.000000000
sum over m+mul 3.190182639 3.190182639 6.380365277 0.000000000
d3z^2-r^2 0 0.196309784 0.196309784 0.392619567 0.000000000
dx^2-y^2 0 0.201500798 0.201500798 0.403001596 0.000000000
dxy 0 0.250952188 0.250952188 0.501904376 0.000000000
dxz 0 0.268509958 0.268509958 0.537019915 0.000000000
dyz 0 0.268478659 0.268478659 0.536957318 0.000000000
sum over m 1.185751386 1.185751386 2.371502772 0.000000000
d3z^2-r^2 1 0.003473749 0.003473749 0.006947498 0.000000000
dx^2-y^2 1 -0.004477316 -0.004477316 -0.008954633 0.000000000
dxy 1 0.015338915 0.015338915 0.030677830 0.000000000
dxz 1 0.003492566 0.003492566 0.006985132 0.000000000
dyz 1 0.003489870 0.003489870 0.006979740 0.000000000
sum over m 0.021317783 0.021317783 0.042635567 0.000000000
sum over m+mul 1.207069170 1.207069170 2.414138339 0.000000000
686 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000772532 1.000772532 2.001545063 0.000000000
sum over m 1.000772532 1.000772532 2.001545063 0.000000000
s 1 0.207415904 0.207415904 0.414831807 0.000000000
sum over m 0.207415904 0.207415904 0.414831807 0.000000000
s 2 0.014725570 0.014725570 0.029451141 0.000000000
sum over m 0.014725570 0.014725570 0.029451141 0.000000000
sum over m+mul 1.222914006 1.222914006 2.445828011 0.000000000
px 0 1.006362969 1.006362969 2.012725938 0.000000000
py 0 1.006375748 1.006375748 2.012751496 0.000000000
pz 0 1.006206692 1.006206692 2.012413384 0.000000000
sum over m 3.018945409 3.018945409 6.037890817 0.000000000
px 1 0.065445106 0.065445106 0.130890212 0.000000000
py 1 0.065437315 0.065437315 0.130874631 0.000000000
pz 1 0.040372054 0.040372054 0.080744108 0.000000000
sum over m 0.171254475 0.171254475 0.342508951 0.000000000
sum over m+mul 3.190199884 3.190199884 6.380399768 0.000000000
d3z^2-r^2 0 0.196309061 0.196309061 0.392618121 0.000000000
dx^2-y^2 0 0.201508894 0.201508894 0.403017788 0.000000000
dxy 0 0.250944584 0.250944584 0.501889168 0.000000000
dxz 0 0.268511824 0.268511824 0.537023648 0.000000000
dyz 0 0.268487265 0.268487265 0.536974531 0.000000000
sum over m 1.185761629 1.185761629 2.371523257 0.000000000
d3z^2-r^2 1 0.003476755 0.003476755 0.006953511 0.000000000
dx^2-y^2 1 -0.004475955 -0.004475955 -0.008951910 0.000000000
dxy 1 0.015341110 0.015341110 0.030682220 0.000000000
dxz 1 0.003494011 0.003494011 0.006988021 0.000000000
dyz 1 0.003491944 0.003491944 0.006983887 0.000000000
sum over m 0.021327865 0.021327865 0.042655730 0.000000000
sum over m+mul 1.207089493 1.207089493 2.414178987 0.000000000
687 O Up spin Down spin Sum Diff
multiple
s 0 0.893870943 0.893870943 1.787741885 0.000000000
sum over m 0.893870943 0.893870943 1.787741885 0.000000000
s 1 -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m+mul 0.890828329 0.890828329 1.781656659 0.000000000
px 0 0.786994694 0.786994694 1.573989387 0.000000000
py 0 0.786897584 0.786897584 1.573795169 0.000000000
pz 0 0.779811672 0.779811672 1.559623345 0.000000000
sum over m 2.353703950 2.353703950 4.707407901 0.000000000
px 1 -0.008732950 -0.008732950 -0.017465899 0.000000000
py 1 -0.008737807 -0.008737807 -0.017475614 0.000000000
pz 1 -0.006463991 -0.006463991 -0.012927982 0.000000000
sum over m -0.023934748 -0.023934748 -0.047869495 0.000000000
sum over m+mul 2.329769203 2.329769203 4.659538406 0.000000000
d3z^2-r^2 0 -0.006389251 -0.006389251 -0.012778503 0.000000000
dx^2-y^2 0 -0.005059228 -0.005059228 -0.010118457 0.000000000
dxy 0 -0.005432622 -0.005432622 -0.010865243 0.000000000
dxz 0 -0.006930964 -0.006930964 -0.013861928 0.000000000
dyz 0 -0.006931230 -0.006931230 -0.013862459 0.000000000
sum over m -0.030743295 -0.030743295 -0.061486591 0.000000000
sum over m+mul -0.030743295 -0.030743295 -0.061486591 0.000000000
688 O Up spin Down spin Sum Diff
multiple
s 0 0.893906891 0.893906891 1.787813783 0.000000000
sum over m 0.893906891 0.893906891 1.787813783 0.000000000
s 1 -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m+mul 0.890864516 0.890864516 1.781729032 0.000000000
px 0 0.786887385 0.786887385 1.573774769 0.000000000
py 0 0.787136278 0.787136278 1.574272556 0.000000000
pz 0 0.779756985 0.779756985 1.559513971 0.000000000
sum over m 2.353780648 2.353780648 4.707561296 0.000000000
px 1 -0.008733754 -0.008733754 -0.017467508 0.000000000
py 1 -0.008746839 -0.008746839 -0.017493677 0.000000000
pz 1 -0.006460947 -0.006460947 -0.012921894 0.000000000
sum over m -0.023941540 -0.023941540 -0.047883080 0.000000000
sum over m+mul 2.329839108 2.329839108 4.659678216 0.000000000
d3z^2-r^2 0 -0.006390928 -0.006390928 -0.012781856 0.000000000
dx^2-y^2 0 -0.005057555 -0.005057555 -0.010115110 0.000000000
dxy 0 -0.005435139 -0.005435139 -0.010870279 0.000000000
dxz 0 -0.006932324 -0.006932324 -0.013864649 0.000000000
dyz 0 -0.006925167 -0.006925167 -0.013850334 0.000000000
sum over m -0.030741114 -0.030741114 -0.061482228 0.000000000
sum over m+mul -0.030741114 -0.030741114 -0.061482228 0.000000000
689 O Up spin Down spin Sum Diff
multiple
s 0 0.893899160 0.893899160 1.787798320 0.000000000
sum over m 0.893899160 0.893899160 1.787798320 0.000000000
s 1 -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m+mul 0.890856653 0.890856653 1.781713306 0.000000000
px 0 0.787024779 0.787024779 1.574049559 0.000000000
py 0 0.787022915 0.787022915 1.574045829 0.000000000
pz 0 0.779715302 0.779715302 1.559430605 0.000000000
sum over m 2.353762996 2.353762996 4.707525993 0.000000000
px 1 -0.008731049 -0.008731049 -0.017462099 0.000000000
py 1 -0.008735679 -0.008735679 -0.017471358 0.000000000
pz 1 -0.006456234 -0.006456234 -0.012912467 0.000000000
sum over m -0.023922962 -0.023922962 -0.047845924 0.000000000
sum over m+mul 2.329840034 2.329840034 4.659680068 0.000000000
d3z^2-r^2 0 -0.006389845 -0.006389845 -0.012779690 0.000000000
dx^2-y^2 0 -0.005054724 -0.005054724 -0.010109447 0.000000000
dxy 0 -0.005435254 -0.005435254 -0.010870509 0.000000000
dxz 0 -0.006927007 -0.006927007 -0.013854014 0.000000000
dyz 0 -0.006924412 -0.006924412 -0.013848825 0.000000000
sum over m -0.030731242 -0.030731242 -0.061462485 0.000000000
sum over m+mul -0.030731242 -0.030731242 -0.061462485 0.000000000
690 O Up spin Down spin Sum Diff
multiple
s 0 0.893867015 0.893867015 1.787734031 0.000000000
sum over m 0.893867015 0.893867015 1.787734031 0.000000000
s 1 -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m+mul 0.890824536 0.890824536 1.781649071 0.000000000
px 0 0.787005555 0.787005555 1.574011110 0.000000000
py 0 0.786842943 0.786842943 1.573685885 0.000000000
pz 0 0.779835771 0.779835771 1.559671543 0.000000000
sum over m 2.353684269 2.353684269 4.707368538 0.000000000
px 1 -0.008736009 -0.008736009 -0.017472019 0.000000000
py 1 -0.008738661 -0.008738661 -0.017477321 0.000000000
pz 1 -0.006464666 -0.006464666 -0.012929332 0.000000000
sum over m -0.023939336 -0.023939336 -0.047878673 0.000000000
sum over m+mul 2.329744933 2.329744933 4.659489865 0.000000000
d3z^2-r^2 0 -0.006389283 -0.006389283 -0.012778566 0.000000000
dx^2-y^2 0 -0.005060255 -0.005060255 -0.010120509 0.000000000
dxy 0 -0.005432451 -0.005432451 -0.010864901 0.000000000
dxz 0 -0.006931778 -0.006931778 -0.013863555 0.000000000
dyz 0 -0.006933671 -0.006933671 -0.013867342 0.000000000
sum over m -0.030747437 -0.030747437 -0.061494875 0.000000000
sum over m+mul -0.030747437 -0.030747437 -0.061494875 0.000000000
691 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779577 1.000779577 2.001559154 0.000000000
sum over m 1.000779577 1.000779577 2.001559154 0.000000000
s 1 0.207425039 0.207425039 0.414850078 0.000000000
sum over m 0.207425039 0.207425039 0.414850078 0.000000000
s 2 0.014724726 0.014724726 0.029449451 0.000000000
sum over m 0.014724726 0.014724726 0.029449451 0.000000000
sum over m+mul 1.222929342 1.222929342 2.445858684 0.000000000
px 0 1.006359477 1.006359477 2.012718954 0.000000000
py 0 1.006375717 1.006375717 2.012751433 0.000000000
pz 0 1.006191803 1.006191803 2.012383606 0.000000000
sum over m 3.018926997 3.018926997 6.037853994 0.000000000
px 1 0.065452492 0.065452492 0.130904985 0.000000000
py 1 0.065430210 0.065430210 0.130860420 0.000000000
pz 1 0.040372939 0.040372939 0.080745879 0.000000000
sum over m 0.171255642 0.171255642 0.342511284 0.000000000
sum over m+mul 3.190182639 3.190182639 6.380365278 0.000000000
d3z^2-r^2 0 0.196309784 0.196309784 0.392619568 0.000000000
dx^2-y^2 0 0.201500798 0.201500798 0.403001596 0.000000000
dxy 0 0.250952188 0.250952188 0.501904376 0.000000000
dxz 0 0.268509958 0.268509958 0.537019916 0.000000000
dyz 0 0.268478659 0.268478659 0.536957318 0.000000000
sum over m 1.185751386 1.185751386 2.371502773 0.000000000
d3z^2-r^2 1 0.003473749 0.003473749 0.006947498 0.000000000
dx^2-y^2 1 -0.004477316 -0.004477316 -0.008954633 0.000000000
dxy 1 0.015338915 0.015338915 0.030677830 0.000000000
dxz 1 0.003492566 0.003492566 0.006985132 0.000000000
dyz 1 0.003489870 0.003489870 0.006979740 0.000000000
sum over m 0.021317783 0.021317783 0.042635567 0.000000000
sum over m+mul 1.207069170 1.207069170 2.414138340 0.000000000
692 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000772531 1.000772531 2.001545063 0.000000000
sum over m 1.000772531 1.000772531 2.001545063 0.000000000
s 1 0.207415904 0.207415904 0.414831807 0.000000000
sum over m 0.207415904 0.207415904 0.414831807 0.000000000
s 2 0.014725570 0.014725570 0.029451141 0.000000000
sum over m 0.014725570 0.014725570 0.029451141 0.000000000
sum over m+mul 1.222914006 1.222914006 2.445828011 0.000000000
px 0 1.006362969 1.006362969 2.012725938 0.000000000
py 0 1.006375748 1.006375748 2.012751496 0.000000000
pz 0 1.006206692 1.006206692 2.012413384 0.000000000
sum over m 3.018945409 3.018945409 6.037890818 0.000000000
px 1 0.065445106 0.065445106 0.130890212 0.000000000
py 1 0.065437315 0.065437315 0.130874631 0.000000000
pz 1 0.040372054 0.040372054 0.080744108 0.000000000
sum over m 0.171254475 0.171254475 0.342508951 0.000000000
sum over m+mul 3.190199884 3.190199884 6.380399769 0.000000000
d3z^2-r^2 0 0.196309061 0.196309061 0.392618122 0.000000000
dx^2-y^2 0 0.201508894 0.201508894 0.403017788 0.000000000
dxy 0 0.250944584 0.250944584 0.501889169 0.000000000
dxz 0 0.268511824 0.268511824 0.537023648 0.000000000
dyz 0 0.268487265 0.268487265 0.536974531 0.000000000
sum over m 1.185761629 1.185761629 2.371523257 0.000000000
d3z^2-r^2 1 0.003476756 0.003476756 0.006953511 0.000000000
dx^2-y^2 1 -0.004475955 -0.004475955 -0.008951910 0.000000000
dxy 1 0.015341110 0.015341110 0.030682220 0.000000000
dxz 1 0.003494011 0.003494011 0.006988021 0.000000000
dyz 1 0.003491944 0.003491944 0.006983887 0.000000000
sum over m 0.021327865 0.021327865 0.042655730 0.000000000
sum over m+mul 1.207089493 1.207089493 2.414178987 0.000000000
693 O Up spin Down spin Sum Diff
multiple
s 0 0.893870943 0.893870943 1.787741885 0.000000000
sum over m 0.893870943 0.893870943 1.787741885 0.000000000
s 1 -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m+mul 0.890828329 0.890828329 1.781656659 0.000000000
px 0 0.786994693 0.786994693 1.573989387 0.000000000
py 0 0.786897585 0.786897585 1.573795169 0.000000000
pz 0 0.779811672 0.779811672 1.559623345 0.000000000
sum over m 2.353703950 2.353703950 4.707407901 0.000000000
px 1 -0.008732950 -0.008732950 -0.017465899 0.000000000
py 1 -0.008737807 -0.008737807 -0.017475614 0.000000000
pz 1 -0.006463991 -0.006463991 -0.012927982 0.000000000
sum over m -0.023934748 -0.023934748 -0.047869495 0.000000000
sum over m+mul 2.329769203 2.329769203 4.659538406 0.000000000
d3z^2-r^2 0 -0.006389251 -0.006389251 -0.012778503 0.000000000
dx^2-y^2 0 -0.005059228 -0.005059228 -0.010118457 0.000000000
dxy 0 -0.005432622 -0.005432622 -0.010865243 0.000000000
dxz 0 -0.006930964 -0.006930964 -0.013861928 0.000000000
dyz 0 -0.006931230 -0.006931230 -0.013862459 0.000000000
sum over m -0.030743295 -0.030743295 -0.061486591 0.000000000
sum over m+mul -0.030743295 -0.030743295 -0.061486591 0.000000000
694 O Up spin Down spin Sum Diff
multiple
s 0 0.893906891 0.893906891 1.787813783 0.000000000
sum over m 0.893906891 0.893906891 1.787813783 0.000000000
s 1 -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m+mul 0.890864516 0.890864516 1.781729032 0.000000000
px 0 0.786887385 0.786887385 1.573774769 0.000000000
py 0 0.787136278 0.787136278 1.574272556 0.000000000
pz 0 0.779756985 0.779756985 1.559513971 0.000000000
sum over m 2.353780648 2.353780648 4.707561296 0.000000000
px 1 -0.008733754 -0.008733754 -0.017467508 0.000000000
py 1 -0.008746839 -0.008746839 -0.017493677 0.000000000
pz 1 -0.006460947 -0.006460947 -0.012921894 0.000000000
sum over m -0.023941540 -0.023941540 -0.047883080 0.000000000
sum over m+mul 2.329839108 2.329839108 4.659678216 0.000000000
d3z^2-r^2 0 -0.006390928 -0.006390928 -0.012781856 0.000000000
dx^2-y^2 0 -0.005057555 -0.005057555 -0.010115110 0.000000000
dxy 0 -0.005435139 -0.005435139 -0.010870279 0.000000000
dxz 0 -0.006932324 -0.006932324 -0.013864649 0.000000000
dyz 0 -0.006925167 -0.006925167 -0.013850334 0.000000000
sum over m -0.030741114 -0.030741114 -0.061482228 0.000000000
sum over m+mul -0.030741114 -0.030741114 -0.061482228 0.000000000
695 O Up spin Down spin Sum Diff
multiple
s 0 0.893899160 0.893899160 1.787798320 0.000000000
sum over m 0.893899160 0.893899160 1.787798320 0.000000000
s 1 -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m+mul 0.890856653 0.890856653 1.781713306 0.000000000
px 0 0.787024779 0.787024779 1.574049559 0.000000000
py 0 0.787022915 0.787022915 1.574045829 0.000000000
pz 0 0.779715302 0.779715302 1.559430605 0.000000000
sum over m 2.353762997 2.353762997 4.707525993 0.000000000
px 1 -0.008731050 -0.008731050 -0.017462099 0.000000000
py 1 -0.008735679 -0.008735679 -0.017471358 0.000000000
pz 1 -0.006456233 -0.006456233 -0.012912467 0.000000000
sum over m -0.023922962 -0.023922962 -0.047845924 0.000000000
sum over m+mul 2.329840034 2.329840034 4.659680069 0.000000000
d3z^2-r^2 0 -0.006389845 -0.006389845 -0.012779690 0.000000000
dx^2-y^2 0 -0.005054724 -0.005054724 -0.010109447 0.000000000
dxy 0 -0.005435254 -0.005435254 -0.010870509 0.000000000
dxz 0 -0.006927007 -0.006927007 -0.013854014 0.000000000
dyz 0 -0.006924412 -0.006924412 -0.013848825 0.000000000
sum over m -0.030731242 -0.030731242 -0.061462485 0.000000000
sum over m+mul -0.030731242 -0.030731242 -0.061462485 0.000000000
696 O Up spin Down spin Sum Diff
multiple
s 0 0.893867015 0.893867015 1.787734031 0.000000000
sum over m 0.893867015 0.893867015 1.787734031 0.000000000
s 1 -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m+mul 0.890824536 0.890824536 1.781649071 0.000000000
px 0 0.787005555 0.787005555 1.574011111 0.000000000
py 0 0.786842943 0.786842943 1.573685885 0.000000000
pz 0 0.779835771 0.779835771 1.559671543 0.000000000
sum over m 2.353684269 2.353684269 4.707368539 0.000000000
px 1 -0.008736010 -0.008736010 -0.017472019 0.000000000
py 1 -0.008738660 -0.008738660 -0.017477321 0.000000000
pz 1 -0.006464666 -0.006464666 -0.012929332 0.000000000
sum over m -0.023939336 -0.023939336 -0.047878672 0.000000000
sum over m+mul 2.329744933 2.329744933 4.659489866 0.000000000
d3z^2-r^2 0 -0.006389283 -0.006389283 -0.012778566 0.000000000
dx^2-y^2 0 -0.005060255 -0.005060255 -0.010120509 0.000000000
dxy 0 -0.005432451 -0.005432451 -0.010864901 0.000000000
dxz 0 -0.006931778 -0.006931778 -0.013863555 0.000000000
dyz 0 -0.006933671 -0.006933671 -0.013867342 0.000000000
sum over m -0.030747437 -0.030747437 -0.061494874 0.000000000
sum over m+mul -0.030747437 -0.030747437 -0.061494874 0.000000000
697 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779577 1.000779577 2.001559155 0.000000000
sum over m 1.000779577 1.000779577 2.001559155 0.000000000
s 1 0.207425039 0.207425039 0.414850078 0.000000000
sum over m 0.207425039 0.207425039 0.414850078 0.000000000
s 2 0.014724726 0.014724726 0.029449451 0.000000000
sum over m 0.014724726 0.014724726 0.029449451 0.000000000
sum over m+mul 1.222929342 1.222929342 2.445858684 0.000000000
px 0 1.006359477 1.006359477 2.012718954 0.000000000
py 0 1.006375717 1.006375717 2.012751433 0.000000000
pz 0 1.006191803 1.006191803 2.012383607 0.000000000
sum over m 3.018926997 3.018926997 6.037853994 0.000000000
px 1 0.065452492 0.065452492 0.130904985 0.000000000
py 1 0.065430210 0.065430210 0.130860420 0.000000000
pz 1 0.040372939 0.040372939 0.080745879 0.000000000
sum over m 0.171255642 0.171255642 0.342511284 0.000000000
sum over m+mul 3.190182639 3.190182639 6.380365278 0.000000000
d3z^2-r^2 0 0.196309784 0.196309784 0.392619567 0.000000000
dx^2-y^2 0 0.201500798 0.201500798 0.403001595 0.000000000
dxy 0 0.250952188 0.250952188 0.501904376 0.000000000
dxz 0 0.268509958 0.268509958 0.537019916 0.000000000
dyz 0 0.268478659 0.268478659 0.536957319 0.000000000
sum over m 1.185751386 1.185751386 2.371502773 0.000000000
d3z^2-r^2 1 0.003473749 0.003473749 0.006947498 0.000000000
dx^2-y^2 1 -0.004477316 -0.004477316 -0.008954633 0.000000000
dxy 1 0.015338915 0.015338915 0.030677830 0.000000000
dxz 1 0.003492566 0.003492566 0.006985132 0.000000000
dyz 1 0.003489870 0.003489870 0.006979740 0.000000000
sum over m 0.021317783 0.021317783 0.042635567 0.000000000
sum over m+mul 1.207069170 1.207069170 2.414138340 0.000000000
698 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000772531 1.000772531 2.001545063 0.000000000
sum over m 1.000772531 1.000772531 2.001545063 0.000000000
s 1 0.207415904 0.207415904 0.414831808 0.000000000
sum over m 0.207415904 0.207415904 0.414831808 0.000000000
s 2 0.014725570 0.014725570 0.029451141 0.000000000
sum over m 0.014725570 0.014725570 0.029451141 0.000000000
sum over m+mul 1.222914006 1.222914006 2.445828011 0.000000000
px 0 1.006362969 1.006362969 2.012725937 0.000000000
py 0 1.006375748 1.006375748 2.012751496 0.000000000
pz 0 1.006206692 1.006206692 2.012413384 0.000000000
sum over m 3.018945409 3.018945409 6.037890817 0.000000000
px 1 0.065445106 0.065445106 0.130890212 0.000000000
py 1 0.065437315 0.065437315 0.130874631 0.000000000
pz 1 0.040372054 0.040372054 0.080744108 0.000000000
sum over m 0.171254476 0.171254476 0.342508952 0.000000000
sum over m+mul 3.190199885 3.190199885 6.380399769 0.000000000
d3z^2-r^2 0 0.196309061 0.196309061 0.392618122 0.000000000
dx^2-y^2 0 0.201508894 0.201508894 0.403017788 0.000000000
dxy 0 0.250944584 0.250944584 0.501889168 0.000000000
dxz 0 0.268511824 0.268511824 0.537023648 0.000000000
dyz 0 0.268487266 0.268487266 0.536974531 0.000000000
sum over m 1.185761629 1.185761629 2.371523258 0.000000000
d3z^2-r^2 1 0.003476755 0.003476755 0.006953511 0.000000000
dx^2-y^2 1 -0.004475955 -0.004475955 -0.008951910 0.000000000
dxy 1 0.015341110 0.015341110 0.030682220 0.000000000
dxz 1 0.003494011 0.003494011 0.006988021 0.000000000
dyz 1 0.003491944 0.003491944 0.006983887 0.000000000
sum over m 0.021327865 0.021327865 0.042655730 0.000000000
sum over m+mul 1.207089494 1.207089494 2.414178988 0.000000000
699 O Up spin Down spin Sum Diff
multiple
s 0 0.893870942 0.893870942 1.787741885 0.000000000
sum over m 0.893870942 0.893870942 1.787741885 0.000000000
s 1 -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m+mul 0.890828329 0.890828329 1.781656659 0.000000000
px 0 0.786994693 0.786994693 1.573989387 0.000000000
py 0 0.786897585 0.786897585 1.573795169 0.000000000
pz 0 0.779811672 0.779811672 1.559623345 0.000000000
sum over m 2.353703951 2.353703951 4.707407901 0.000000000
px 1 -0.008732950 -0.008732950 -0.017465899 0.000000000
py 1 -0.008737807 -0.008737807 -0.017475614 0.000000000
pz 1 -0.006463991 -0.006463991 -0.012927982 0.000000000
sum over m -0.023934748 -0.023934748 -0.047869495 0.000000000
sum over m+mul 2.329769203 2.329769203 4.659538406 0.000000000
d3z^2-r^2 0 -0.006389251 -0.006389251 -0.012778503 0.000000000
dx^2-y^2 0 -0.005059228 -0.005059228 -0.010118457 0.000000000
dxy 0 -0.005432622 -0.005432622 -0.010865243 0.000000000
dxz 0 -0.006930964 -0.006930964 -0.013861928 0.000000000
dyz 0 -0.006931230 -0.006931230 -0.013862459 0.000000000
sum over m -0.030743295 -0.030743295 -0.061486591 0.000000000
sum over m+mul -0.030743295 -0.030743295 -0.061486591 0.000000000
700 O Up spin Down spin Sum Diff
multiple
s 0 0.893906891 0.893906891 1.787813783 0.000000000
sum over m 0.893906891 0.893906891 1.787813783 0.000000000
s 1 -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m+mul 0.890864516 0.890864516 1.781729032 0.000000000
px 0 0.786887385 0.786887385 1.573774770 0.000000000
py 0 0.787136278 0.787136278 1.574272556 0.000000000
pz 0 0.779756985 0.779756985 1.559513970 0.000000000
sum over m 2.353780648 2.353780648 4.707561296 0.000000000
px 1 -0.008733754 -0.008733754 -0.017467508 0.000000000
py 1 -0.008746839 -0.008746839 -0.017493677 0.000000000
pz 1 -0.006460947 -0.006460947 -0.012921894 0.000000000
sum over m -0.023941540 -0.023941540 -0.047883080 0.000000000
sum over m+mul 2.329839108 2.329839108 4.659678216 0.000000000
d3z^2-r^2 0 -0.006390928 -0.006390928 -0.012781856 0.000000000
dx^2-y^2 0 -0.005057555 -0.005057555 -0.010115110 0.000000000
dxy 0 -0.005435139 -0.005435139 -0.010870279 0.000000000
dxz 0 -0.006932324 -0.006932324 -0.013864649 0.000000000
dyz 0 -0.006925167 -0.006925167 -0.013850334 0.000000000
sum over m -0.030741114 -0.030741114 -0.061482228 0.000000000
sum over m+mul -0.030741114 -0.030741114 -0.061482228 0.000000000
701 O Up spin Down spin Sum Diff
multiple
s 0 0.893899160 0.893899160 1.787798320 0.000000000
sum over m 0.893899160 0.893899160 1.787798320 0.000000000
s 1 -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m+mul 0.890856653 0.890856653 1.781713306 0.000000000
px 0 0.787024779 0.787024779 1.574049559 0.000000000
py 0 0.787022915 0.787022915 1.574045829 0.000000000
pz 0 0.779715302 0.779715302 1.559430604 0.000000000
sum over m 2.353762996 2.353762996 4.707525993 0.000000000
px 1 -0.008731049 -0.008731049 -0.017462099 0.000000000
py 1 -0.008735679 -0.008735679 -0.017471358 0.000000000
pz 1 -0.006456234 -0.006456234 -0.012912467 0.000000000
sum over m -0.023922962 -0.023922962 -0.047845924 0.000000000
sum over m+mul 2.329840034 2.329840034 4.659680068 0.000000000
d3z^2-r^2 0 -0.006389845 -0.006389845 -0.012779690 0.000000000
dx^2-y^2 0 -0.005054724 -0.005054724 -0.010109447 0.000000000
dxy 0 -0.005435254 -0.005435254 -0.010870509 0.000000000
dxz 0 -0.006927007 -0.006927007 -0.013854014 0.000000000
dyz 0 -0.006924412 -0.006924412 -0.013848825 0.000000000
sum over m -0.030731242 -0.030731242 -0.061462485 0.000000000
sum over m+mul -0.030731242 -0.030731242 -0.061462485 0.000000000
702 O Up spin Down spin Sum Diff
multiple
s 0 0.893867015 0.893867015 1.787734031 0.000000000
sum over m 0.893867015 0.893867015 1.787734031 0.000000000
s 1 -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m+mul 0.890824535 0.890824535 1.781649071 0.000000000
px 0 0.787005555 0.787005555 1.574011111 0.000000000
py 0 0.786842943 0.786842943 1.573685885 0.000000000
pz 0 0.779835771 0.779835771 1.559671543 0.000000000
sum over m 2.353684269 2.353684269 4.707368538 0.000000000
px 1 -0.008736009 -0.008736009 -0.017472019 0.000000000
py 1 -0.008738661 -0.008738661 -0.017477321 0.000000000
pz 1 -0.006464666 -0.006464666 -0.012929333 0.000000000
sum over m -0.023939336 -0.023939336 -0.047878672 0.000000000
sum over m+mul 2.329744933 2.329744933 4.659489866 0.000000000
d3z^2-r^2 0 -0.006389283 -0.006389283 -0.012778566 0.000000000
dx^2-y^2 0 -0.005060255 -0.005060255 -0.010120509 0.000000000
dxy 0 -0.005432451 -0.005432451 -0.010864901 0.000000000
dxz 0 -0.006931778 -0.006931778 -0.013863555 0.000000000
dyz 0 -0.006933671 -0.006933671 -0.013867342 0.000000000
sum over m -0.030747437 -0.030747437 -0.061494874 0.000000000
sum over m+mul -0.030747437 -0.030747437 -0.061494874 0.000000000
703 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779577 1.000779577 2.001559154 0.000000000
sum over m 1.000779577 1.000779577 2.001559154 0.000000000
s 1 0.207425039 0.207425039 0.414850078 0.000000000
sum over m 0.207425039 0.207425039 0.414850078 0.000000000
s 2 0.014724726 0.014724726 0.029449451 0.000000000
sum over m 0.014724726 0.014724726 0.029449451 0.000000000
sum over m+mul 1.222929342 1.222929342 2.445858684 0.000000000
px 0 1.006359477 1.006359477 2.012718954 0.000000000
py 0 1.006375717 1.006375717 2.012751433 0.000000000
pz 0 1.006191803 1.006191803 2.012383607 0.000000000
sum over m 3.018926997 3.018926997 6.037853994 0.000000000
px 1 0.065452492 0.065452492 0.130904985 0.000000000
py 1 0.065430210 0.065430210 0.130860420 0.000000000
pz 1 0.040372940 0.040372940 0.080745879 0.000000000
sum over m 0.171255642 0.171255642 0.342511284 0.000000000
sum over m+mul 3.190182639 3.190182639 6.380365278 0.000000000
d3z^2-r^2 0 0.196309784 0.196309784 0.392619567 0.000000000
dx^2-y^2 0 0.201500798 0.201500798 0.403001596 0.000000000
dxy 0 0.250952188 0.250952188 0.501904376 0.000000000
dxz 0 0.268509957 0.268509957 0.537019915 0.000000000
dyz 0 0.268478659 0.268478659 0.536957318 0.000000000
sum over m 1.185751386 1.185751386 2.371502772 0.000000000
d3z^2-r^2 1 0.003473749 0.003473749 0.006947498 0.000000000
dx^2-y^2 1 -0.004477316 -0.004477316 -0.008954633 0.000000000
dxy 1 0.015338915 0.015338915 0.030677830 0.000000000
dxz 1 0.003492566 0.003492566 0.006985132 0.000000000
dyz 1 0.003489870 0.003489870 0.006979740 0.000000000
sum over m 0.021317783 0.021317783 0.042635567 0.000000000
sum over m+mul 1.207069170 1.207069170 2.414138339 0.000000000
704 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000772531 1.000772531 2.001545063 0.000000000
sum over m 1.000772531 1.000772531 2.001545063 0.000000000
s 1 0.207415904 0.207415904 0.414831808 0.000000000
sum over m 0.207415904 0.207415904 0.414831808 0.000000000
s 2 0.014725570 0.014725570 0.029451141 0.000000000
sum over m 0.014725570 0.014725570 0.029451141 0.000000000
sum over m+mul 1.222914006 1.222914006 2.445828011 0.000000000
px 0 1.006362969 1.006362969 2.012725937 0.000000000
py 0 1.006375748 1.006375748 2.012751496 0.000000000
pz 0 1.006206692 1.006206692 2.012413384 0.000000000
sum over m 3.018945409 3.018945409 6.037890817 0.000000000
px 1 0.065445106 0.065445106 0.130890212 0.000000000
py 1 0.065437315 0.065437315 0.130874631 0.000000000
pz 1 0.040372054 0.040372054 0.080744108 0.000000000
sum over m 0.171254476 0.171254476 0.342508951 0.000000000
sum over m+mul 3.190199884 3.190199884 6.380399769 0.000000000
d3z^2-r^2 0 0.196309061 0.196309061 0.392618122 0.000000000
dx^2-y^2 0 0.201508894 0.201508894 0.403017788 0.000000000
dxy 0 0.250944585 0.250944585 0.501889169 0.000000000
dxz 0 0.268511824 0.268511824 0.537023648 0.000000000
dyz 0 0.268487266 0.268487266 0.536974531 0.000000000
sum over m 1.185761629 1.185761629 2.371523259 0.000000000
d3z^2-r^2 1 0.003476755 0.003476755 0.006953511 0.000000000
dx^2-y^2 1 -0.004475955 -0.004475955 -0.008951910 0.000000000
dxy 1 0.015341110 0.015341110 0.030682220 0.000000000
dxz 1 0.003494011 0.003494011 0.006988021 0.000000000
dyz 1 0.003491944 0.003491944 0.006983887 0.000000000
sum over m 0.021327865 0.021327865 0.042655730 0.000000000
sum over m+mul 1.207089494 1.207089494 2.414178988 0.000000000
705 O Up spin Down spin Sum Diff
multiple
s 0 0.893870943 0.893870943 1.787741885 0.000000000
sum over m 0.893870943 0.893870943 1.787741885 0.000000000
s 1 -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m+mul 0.890828329 0.890828329 1.781656659 0.000000000
px 0 0.786994693 0.786994693 1.573989386 0.000000000
py 0 0.786897585 0.786897585 1.573795169 0.000000000
pz 0 0.779811672 0.779811672 1.559623344 0.000000000
sum over m 2.353703950 2.353703950 4.707407900 0.000000000
px 1 -0.008732950 -0.008732950 -0.017465899 0.000000000
py 1 -0.008737807 -0.008737807 -0.017475614 0.000000000
pz 1 -0.006463991 -0.006463991 -0.012927982 0.000000000
sum over m -0.023934748 -0.023934748 -0.047869495 0.000000000
sum over m+mul 2.329769202 2.329769202 4.659538404 0.000000000
d3z^2-r^2 0 -0.006389251 -0.006389251 -0.012778503 0.000000000
dx^2-y^2 0 -0.005059228 -0.005059228 -0.010118457 0.000000000
dxy 0 -0.005432622 -0.005432622 -0.010865243 0.000000000
dxz 0 -0.006930964 -0.006930964 -0.013861928 0.000000000
dyz 0 -0.006931230 -0.006931230 -0.013862459 0.000000000
sum over m -0.030743295 -0.030743295 -0.061486591 0.000000000
sum over m+mul -0.030743295 -0.030743295 -0.061486591 0.000000000
706 O Up spin Down spin Sum Diff
multiple
s 0 0.893906891 0.893906891 1.787813782 0.000000000
sum over m 0.893906891 0.893906891 1.787813782 0.000000000
s 1 -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m+mul 0.890864516 0.890864516 1.781729032 0.000000000
px 0 0.786887385 0.786887385 1.573774769 0.000000000
py 0 0.787136278 0.787136278 1.574272555 0.000000000
pz 0 0.779756985 0.779756985 1.559513970 0.000000000
sum over m 2.353780648 2.353780648 4.707561295 0.000000000
px 1 -0.008733754 -0.008733754 -0.017467508 0.000000000
py 1 -0.008746839 -0.008746839 -0.017493677 0.000000000
pz 1 -0.006460947 -0.006460947 -0.012921894 0.000000000
sum over m -0.023941540 -0.023941540 -0.047883080 0.000000000
sum over m+mul 2.329839108 2.329839108 4.659678215 0.000000000
d3z^2-r^2 0 -0.006390928 -0.006390928 -0.012781856 0.000000000
dx^2-y^2 0 -0.005057555 -0.005057555 -0.010115110 0.000000000
dxy 0 -0.005435139 -0.005435139 -0.010870279 0.000000000
dxz 0 -0.006932324 -0.006932324 -0.013864649 0.000000000
dyz 0 -0.006925167 -0.006925167 -0.013850334 0.000000000
sum over m -0.030741114 -0.030741114 -0.061482227 0.000000000
sum over m+mul -0.030741114 -0.030741114 -0.061482227 0.000000000
707 O Up spin Down spin Sum Diff
multiple
s 0 0.893899160 0.893899160 1.787798320 0.000000000
sum over m 0.893899160 0.893899160 1.787798320 0.000000000
s 1 -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m+mul 0.890856653 0.890856653 1.781713306 0.000000000
px 0 0.787024779 0.787024779 1.574049559 0.000000000
py 0 0.787022915 0.787022915 1.574045829 0.000000000
pz 0 0.779715302 0.779715302 1.559430605 0.000000000
sum over m 2.353762996 2.353762996 4.707525993 0.000000000
px 1 -0.008731050 -0.008731050 -0.017462099 0.000000000
py 1 -0.008735679 -0.008735679 -0.017471358 0.000000000
pz 1 -0.006456233 -0.006456233 -0.012912467 0.000000000
sum over m -0.023922962 -0.023922962 -0.047845924 0.000000000
sum over m+mul 2.329840034 2.329840034 4.659680068 0.000000000
d3z^2-r^2 0 -0.006389845 -0.006389845 -0.012779690 0.000000000
dx^2-y^2 0 -0.005054724 -0.005054724 -0.010109447 0.000000000
dxy 0 -0.005435254 -0.005435254 -0.010870509 0.000000000
dxz 0 -0.006927007 -0.006927007 -0.013854014 0.000000000
dyz 0 -0.006924412 -0.006924412 -0.013848825 0.000000000
sum over m -0.030731242 -0.030731242 -0.061462485 0.000000000
sum over m+mul -0.030731242 -0.030731242 -0.061462485 0.000000000
708 O Up spin Down spin Sum Diff
multiple
s 0 0.893867015 0.893867015 1.787734031 0.000000000
sum over m 0.893867015 0.893867015 1.787734031 0.000000000
s 1 -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m+mul 0.890824536 0.890824536 1.781649071 0.000000000
px 0 0.787005555 0.787005555 1.574011110 0.000000000
py 0 0.786842943 0.786842943 1.573685885 0.000000000
pz 0 0.779835771 0.779835771 1.559671542 0.000000000
sum over m 2.353684269 2.353684269 4.707368538 0.000000000
px 1 -0.008736009 -0.008736009 -0.017472019 0.000000000
py 1 -0.008738660 -0.008738660 -0.017477321 0.000000000
pz 1 -0.006464666 -0.006464666 -0.012929332 0.000000000
sum over m -0.023939336 -0.023939336 -0.047878672 0.000000000
sum over m+mul 2.329744933 2.329744933 4.659489866 0.000000000
d3z^2-r^2 0 -0.006389283 -0.006389283 -0.012778566 0.000000000
dx^2-y^2 0 -0.005060255 -0.005060255 -0.010120509 0.000000000
dxy 0 -0.005432451 -0.005432451 -0.010864901 0.000000000
dxz 0 -0.006931778 -0.006931778 -0.013863555 0.000000000
dyz 0 -0.006933671 -0.006933671 -0.013867342 0.000000000
sum over m -0.030747437 -0.030747437 -0.061494874 0.000000000
sum over m+mul -0.030747437 -0.030747437 -0.061494874 0.000000000
709 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000779577 1.000779577 2.001559154 0.000000000
sum over m 1.000779577 1.000779577 2.001559154 0.000000000
s 1 0.207425039 0.207425039 0.414850078 0.000000000
sum over m 0.207425039 0.207425039 0.414850078 0.000000000
s 2 0.014724726 0.014724726 0.029449451 0.000000000
sum over m 0.014724726 0.014724726 0.029449451 0.000000000
sum over m+mul 1.222929342 1.222929342 2.445858684 0.000000000
px 0 1.006359477 1.006359477 2.012718954 0.000000000
py 0 1.006375717 1.006375717 2.012751433 0.000000000
pz 0 1.006191803 1.006191803 2.012383606 0.000000000
sum over m 3.018926997 3.018926997 6.037853994 0.000000000
px 1 0.065452492 0.065452492 0.130904984 0.000000000
py 1 0.065430210 0.065430210 0.130860420 0.000000000
pz 1 0.040372939 0.040372939 0.080745879 0.000000000
sum over m 0.171255642 0.171255642 0.342511283 0.000000000
sum over m+mul 3.190182639 3.190182639 6.380365277 0.000000000
d3z^2-r^2 0 0.196309784 0.196309784 0.392619567 0.000000000
dx^2-y^2 0 0.201500798 0.201500798 0.403001596 0.000000000
dxy 0 0.250952188 0.250952188 0.501904376 0.000000000
dxz 0 0.268509958 0.268509958 0.537019916 0.000000000
dyz 0 0.268478660 0.268478660 0.536957319 0.000000000
sum over m 1.185751387 1.185751387 2.371502774 0.000000000
d3z^2-r^2 1 0.003473749 0.003473749 0.006947498 0.000000000
dx^2-y^2 1 -0.004477316 -0.004477316 -0.008954633 0.000000000
dxy 1 0.015338915 0.015338915 0.030677830 0.000000000
dxz 1 0.003492566 0.003492566 0.006985132 0.000000000
dyz 1 0.003489870 0.003489870 0.006979740 0.000000000
sum over m 0.021317784 0.021317784 0.042635567 0.000000000
sum over m+mul 1.207069171 1.207069171 2.414138341 0.000000000
710 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000772532 1.000772532 2.001545063 0.000000000
sum over m 1.000772532 1.000772532 2.001545063 0.000000000
s 1 0.207415904 0.207415904 0.414831807 0.000000000
sum over m 0.207415904 0.207415904 0.414831807 0.000000000
s 2 0.014725570 0.014725570 0.029451141 0.000000000
sum over m 0.014725570 0.014725570 0.029451141 0.000000000
sum over m+mul 1.222914006 1.222914006 2.445828012 0.000000000
px 0 1.006362969 1.006362969 2.012725938 0.000000000
py 0 1.006375748 1.006375748 2.012751496 0.000000000
pz 0 1.006206692 1.006206692 2.012413384 0.000000000
sum over m 3.018945409 3.018945409 6.037890818 0.000000000
px 1 0.065445106 0.065445106 0.130890212 0.000000000
py 1 0.065437315 0.065437315 0.130874631 0.000000000
pz 1 0.040372054 0.040372054 0.080744108 0.000000000
sum over m 0.171254475 0.171254475 0.342508951 0.000000000
sum over m+mul 3.190199884 3.190199884 6.380399768 0.000000000
d3z^2-r^2 0 0.196309061 0.196309061 0.392618122 0.000000000
dx^2-y^2 0 0.201508894 0.201508894 0.403017788 0.000000000
dxy 0 0.250944584 0.250944584 0.501889168 0.000000000
dxz 0 0.268511824 0.268511824 0.537023648 0.000000000
dyz 0 0.268487265 0.268487265 0.536974531 0.000000000
sum over m 1.185761629 1.185761629 2.371523258 0.000000000
d3z^2-r^2 1 0.003476755 0.003476755 0.006953511 0.000000000
dx^2-y^2 1 -0.004475955 -0.004475955 -0.008951910 0.000000000
dxy 1 0.015341110 0.015341110 0.030682220 0.000000000
dxz 1 0.003494011 0.003494011 0.006988021 0.000000000
dyz 1 0.003491944 0.003491944 0.006983887 0.000000000
sum over m 0.021327865 0.021327865 0.042655730 0.000000000
sum over m+mul 1.207089494 1.207089494 2.414178987 0.000000000
711 O Up spin Down spin Sum Diff
multiple
s 0 0.893870943 0.893870943 1.787741885 0.000000000
sum over m 0.893870943 0.893870943 1.787741885 0.000000000
s 1 -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m -0.003042613 -0.003042613 -0.006085226 0.000000000
sum over m+mul 0.890828329 0.890828329 1.781656659 0.000000000
px 0 0.786994693 0.786994693 1.573989386 0.000000000
py 0 0.786897585 0.786897585 1.573795169 0.000000000
pz 0 0.779811672 0.779811672 1.559623345 0.000000000
sum over m 2.353703950 2.353703950 4.707407900 0.000000000
px 1 -0.008732950 -0.008732950 -0.017465899 0.000000000
py 1 -0.008737807 -0.008737807 -0.017475614 0.000000000
pz 1 -0.006463991 -0.006463991 -0.012927982 0.000000000
sum over m -0.023934748 -0.023934748 -0.047869495 0.000000000
sum over m+mul 2.329769203 2.329769203 4.659538405 0.000000000
d3z^2-r^2 0 -0.006389251 -0.006389251 -0.012778503 0.000000000
dx^2-y^2 0 -0.005059228 -0.005059228 -0.010118457 0.000000000
dxy 0 -0.005432622 -0.005432622 -0.010865243 0.000000000
dxz 0 -0.006930964 -0.006930964 -0.013861928 0.000000000
dyz 0 -0.006931230 -0.006931230 -0.013862459 0.000000000
sum over m -0.030743295 -0.030743295 -0.061486591 0.000000000
sum over m+mul -0.030743295 -0.030743295 -0.061486591 0.000000000
712 O Up spin Down spin Sum Diff
multiple
s 0 0.893906891 0.893906891 1.787813783 0.000000000
sum over m 0.893906891 0.893906891 1.787813783 0.000000000
s 1 -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m -0.003042375 -0.003042375 -0.006084751 0.000000000
sum over m+mul 0.890864516 0.890864516 1.781729032 0.000000000
px 0 0.786887385 0.786887385 1.573774769 0.000000000
py 0 0.787136278 0.787136278 1.574272556 0.000000000
pz 0 0.779756985 0.779756985 1.559513970 0.000000000
sum over m 2.353780648 2.353780648 4.707561296 0.000000000
px 1 -0.008733754 -0.008733754 -0.017467508 0.000000000
py 1 -0.008746839 -0.008746839 -0.017493677 0.000000000
pz 1 -0.006460947 -0.006460947 -0.012921894 0.000000000
sum over m -0.023941540 -0.023941540 -0.047883080 0.000000000
sum over m+mul 2.329839108 2.329839108 4.659678216 0.000000000
d3z^2-r^2 0 -0.006390928 -0.006390928 -0.012781856 0.000000000
dx^2-y^2 0 -0.005057555 -0.005057555 -0.010115110 0.000000000
dxy 0 -0.005435139 -0.005435139 -0.010870279 0.000000000
dxz 0 -0.006932324 -0.006932324 -0.013864649 0.000000000
dyz 0 -0.006925167 -0.006925167 -0.013850334 0.000000000
sum over m -0.030741114 -0.030741114 -0.061482228 0.000000000
sum over m+mul -0.030741114 -0.030741114 -0.061482228 0.000000000
713 O Up spin Down spin Sum Diff
multiple
s 0 0.893899160 0.893899160 1.787798320 0.000000000
sum over m 0.893899160 0.893899160 1.787798320 0.000000000
s 1 -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m -0.003042507 -0.003042507 -0.006085014 0.000000000
sum over m+mul 0.890856653 0.890856653 1.781713306 0.000000000
px 0 0.787024779 0.787024779 1.574049558 0.000000000
py 0 0.787022915 0.787022915 1.574045829 0.000000000
pz 0 0.779715302 0.779715302 1.559430605 0.000000000
sum over m 2.353762996 2.353762996 4.707525993 0.000000000
px 1 -0.008731050 -0.008731050 -0.017462099 0.000000000
py 1 -0.008735679 -0.008735679 -0.017471359 0.000000000
pz 1 -0.006456234 -0.006456234 -0.012912467 0.000000000
sum over m -0.023922962 -0.023922962 -0.047845925 0.000000000
sum over m+mul 2.329840034 2.329840034 4.659680068 0.000000000
d3z^2-r^2 0 -0.006389845 -0.006389845 -0.012779690 0.000000000
dx^2-y^2 0 -0.005054724 -0.005054724 -0.010109447 0.000000000
dxy 0 -0.005435254 -0.005435254 -0.010870509 0.000000000
dxz 0 -0.006927007 -0.006927007 -0.013854014 0.000000000
dyz 0 -0.006924412 -0.006924412 -0.013848825 0.000000000
sum over m -0.030731242 -0.030731242 -0.061462485 0.000000000
sum over m+mul -0.030731242 -0.030731242 -0.061462485 0.000000000
714 O Up spin Down spin Sum Diff
multiple
s 0 0.893867015 0.893867015 1.787734031 0.000000000
sum over m 0.893867015 0.893867015 1.787734031 0.000000000
s 1 -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m -0.003042480 -0.003042480 -0.006084960 0.000000000
sum over m+mul 0.890824536 0.890824536 1.781649071 0.000000000
px 0 0.787005555 0.787005555 1.574011110 0.000000000
py 0 0.786842943 0.786842943 1.573685885 0.000000000
pz 0 0.779835771 0.779835771 1.559671542 0.000000000
sum over m 2.353684269 2.353684269 4.707368538 0.000000000
px 1 -0.008736009 -0.008736009 -0.017472019 0.000000000
py 1 -0.008738660 -0.008738660 -0.017477321 0.000000000
pz 1 -0.006464666 -0.006464666 -0.012929332 0.000000000
sum over m -0.023939336 -0.023939336 -0.047878672 0.000000000
sum over m+mul 2.329744933 2.329744933 4.659489865 0.000000000
d3z^2-r^2 0 -0.006389283 -0.006389283 -0.012778566 0.000000000
dx^2-y^2 0 -0.005060255 -0.005060255 -0.010120509 0.000000000
dxy 0 -0.005432451 -0.005432451 -0.010864901 0.000000000
dxz 0 -0.006931778 -0.006931778 -0.013863555 0.000000000
dyz 0 -0.006933671 -0.006933671 -0.013867342 0.000000000
sum over m -0.030747437 -0.030747437 -0.061494875 0.000000000
sum over m+mul -0.030747437 -0.030747437 -0.061494875 0.000000000
715 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758580 1.000758580 2.001517159 0.000000000
sum over m 1.000758580 1.000758580 2.001517159 0.000000000
s 1 0.207412087 0.207412087 0.414824174 0.000000000
sum over m 0.207412087 0.207412087 0.414824174 0.000000000
s 2 0.014726635 0.014726635 0.029453270 0.000000000
sum over m 0.014726635 0.014726635 0.029453270 0.000000000
sum over m+mul 1.222897301 1.222897301 2.445794602 0.000000000
px 0 1.006367276 1.006367276 2.012734551 0.000000000
py 0 1.006373430 1.006373430 2.012746861 0.000000000
pz 0 1.006214904 1.006214904 2.012429807 0.000000000
sum over m 3.018955610 3.018955610 6.037911219 0.000000000
px 1 0.065432003 0.065432003 0.130864005 0.000000000
py 1 0.065442149 0.065442149 0.130884299 0.000000000
pz 1 0.040381942 0.040381942 0.080763884 0.000000000
sum over m 0.171256094 0.171256094 0.342512189 0.000000000
sum over m+mul 3.190211704 3.190211704 6.380423408 0.000000000
d3z^2-r^2 0 0.196307095 0.196307095 0.392614189 0.000000000
dx^2-y^2 0 0.201519175 0.201519175 0.403038350 0.000000000
dxy 0 0.250925911 0.250925911 0.501851821 0.000000000
dxz 0 0.268516582 0.268516582 0.537033165 0.000000000
dyz 0 0.268500223 0.268500223 0.537000446 0.000000000
sum over m 1.185768986 1.185768986 2.371537972 0.000000000
d3z^2-r^2 1 0.003480294 0.003480294 0.006960588 0.000000000
dx^2-y^2 1 -0.004472707 -0.004472707 -0.008945415 0.000000000
dxy 1 0.015341260 0.015341260 0.030682519 0.000000000
dxz 1 0.003494934 0.003494934 0.006989868 0.000000000
dyz 1 0.003493777 0.003493777 0.006987555 0.000000000
sum over m 0.021337558 0.021337558 0.042675116 0.000000000
sum over m+mul 1.207106544 1.207106544 2.414213088 0.000000000
716 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742726 1.000742726 2.001485451 0.000000000
sum over m 1.000742726 1.000742726 2.001485451 0.000000000
s 1 0.207416785 0.207416785 0.414833570 0.000000000
sum over m 0.207416785 0.207416785 0.414833570 0.000000000
s 2 0.014727186 0.014727186 0.029454373 0.000000000
sum over m 0.014727186 0.014727186 0.029454373 0.000000000
sum over m+mul 1.222886697 1.222886697 2.445773394 0.000000000
px 0 1.006376184 1.006376184 2.012752368 0.000000000
py 0 1.006382080 1.006382080 2.012764160 0.000000000
pz 0 1.006198775 1.006198775 2.012397550 0.000000000
sum over m 3.018957039 3.018957039 6.037914078 0.000000000
px 1 0.065418224 0.065418224 0.130836448 0.000000000
py 1 0.065428977 0.065428977 0.130857953 0.000000000
pz 1 0.040408116 0.040408116 0.080816232 0.000000000
sum over m 0.171255317 0.171255317 0.342510634 0.000000000
sum over m+mul 3.190212356 3.190212356 6.380424712 0.000000000
d3z^2-r^2 0 0.196303172 0.196303172 0.392606345 0.000000000
dx^2-y^2 0 0.201527816 0.201527816 0.403055632 0.000000000
dxy 0 0.250905702 0.250905702 0.501811404 0.000000000
dxz 0 0.268520733 0.268520733 0.537041465 0.000000000
dyz 0 0.268515396 0.268515396 0.537030791 0.000000000
sum over m 1.185772818 1.185772818 2.371545637 0.000000000
d3z^2-r^2 1 0.003482203 0.003482203 0.006964407 0.000000000
dx^2-y^2 1 -0.004468465 -0.004468465 -0.008936930 0.000000000
dxy 1 0.015338826 0.015338826 0.030677652 0.000000000
dxz 1 0.003494083 0.003494083 0.006988166 0.000000000
dyz 1 0.003495915 0.003495915 0.006991831 0.000000000
sum over m 0.021342563 0.021342563 0.042685126 0.000000000
sum over m+mul 1.207115381 1.207115381 2.414230763 0.000000000
717 O Up spin Down spin Sum Diff
multiple
s 0 0.893872050 0.893872050 1.787744100 0.000000000
sum over m 0.893872050 0.893872050 1.787744100 0.000000000
s 1 -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m+mul 0.890829757 0.890829757 1.781659513 0.000000000
px 0 0.787000793 0.787000793 1.574001587 0.000000000
py 0 0.786838333 0.786838333 1.573676667 0.000000000
pz 0 0.779837016 0.779837016 1.559674032 0.000000000
sum over m 2.353676143 2.353676143 4.707352286 0.000000000
px 1 -0.008738859 -0.008738859 -0.017477718 0.000000000
py 1 -0.008735882 -0.008735882 -0.017471764 0.000000000
pz 1 -0.006464962 -0.006464962 -0.012929924 0.000000000
sum over m -0.023939703 -0.023939703 -0.047879406 0.000000000
sum over m+mul 2.329736440 2.329736440 4.659472879 0.000000000
d3z^2-r^2 0 -0.006389678 -0.006389678 -0.012779356 0.000000000
dx^2-y^2 0 -0.005060152 -0.005060152 -0.010120305 0.000000000
dxy 0 -0.005433238 -0.005433238 -0.010866475 0.000000000
dxz 0 -0.006932198 -0.006932198 -0.013864396 0.000000000
dyz 0 -0.006934550 -0.006934550 -0.013869101 0.000000000
sum over m -0.030749817 -0.030749817 -0.061499633 0.000000000
sum over m+mul -0.030749817 -0.030749817 -0.061499633 0.000000000
718 O Up spin Down spin Sum Diff
multiple
s 0 0.893902719 0.893902719 1.787805439 0.000000000
sum over m 0.893902719 0.893902719 1.787805439 0.000000000
s 1 -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m+mul 0.890860394 0.890860394 1.781720789 0.000000000
px 0 0.786877452 0.786877452 1.573754904 0.000000000
py 0 0.787071019 0.787071019 1.574142038 0.000000000
pz 0 0.779782974 0.779782974 1.559565948 0.000000000
sum over m 2.353731445 2.353731445 4.707462890 0.000000000
px 1 -0.008738305 -0.008738305 -0.017476611 0.000000000
py 1 -0.008744038 -0.008744038 -0.017488076 0.000000000
pz 1 -0.006462860 -0.006462860 -0.012925721 0.000000000
sum over m -0.023945204 -0.023945204 -0.047890408 0.000000000
sum over m+mul 2.329786241 2.329786241 4.659572482 0.000000000
d3z^2-r^2 0 -0.006390819 -0.006390819 -0.012781637 0.000000000
dx^2-y^2 0 -0.005058326 -0.005058326 -0.010116653 0.000000000
dxy 0 -0.005435279 -0.005435279 -0.010870557 0.000000000
dxz 0 -0.006933211 -0.006933211 -0.013866423 0.000000000
dyz 0 -0.006928893 -0.006928893 -0.013857785 0.000000000
sum over m -0.030746527 -0.030746527 -0.061493055 0.000000000
sum over m+mul -0.030746527 -0.030746527 -0.061493055 0.000000000
719 O Up spin Down spin Sum Diff
multiple
s 0 0.893912541 0.893912541 1.787825082 0.000000000
sum over m 0.893912541 0.893912541 1.787825082 0.000000000
s 1 -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m+mul 0.890869972 0.890869972 1.781739944 0.000000000
px 0 0.787021575 0.787021575 1.574043151 0.000000000
py 0 0.787071176 0.787071176 1.574142352 0.000000000
pz 0 0.779696459 0.779696459 1.559392918 0.000000000
sum over m 2.353789210 2.353789210 4.707578421 0.000000000
px 1 -0.008734448 -0.008734448 -0.017468896 0.000000000
py 1 -0.008735385 -0.008735385 -0.017470771 0.000000000
pz 1 -0.006455985 -0.006455985 -0.012911971 0.000000000
sum over m -0.023925819 -0.023925819 -0.047851637 0.000000000
sum over m+mul 2.329863392 2.329863392 4.659726784 0.000000000
d3z^2-r^2 0 -0.006390385 -0.006390385 -0.012780770 0.000000000
dx^2-y^2 0 -0.005053856 -0.005053856 -0.010107711 0.000000000
dxy 0 -0.005436296 -0.005436296 -0.010872593 0.000000000
dxz 0 -0.006927057 -0.006927057 -0.013854114 0.000000000
dyz 0 -0.006924533 -0.006924533 -0.013849065 0.000000000
sum over m -0.030732127 -0.030732127 -0.061464253 0.000000000
sum over m+mul -0.030732127 -0.030732127 -0.061464253 0.000000000
720 O Up spin Down spin Sum Diff
multiple
s 0 0.893885965 0.893885965 1.787771929 0.000000000
sum over m 0.893885965 0.893885965 1.787771929 0.000000000
s 1 -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m+mul 0.890843481 0.890843481 1.781686962 0.000000000
px 0 0.786986432 0.786986432 1.573972864 0.000000000
py 0 0.786888859 0.786888859 1.573777719 0.000000000
pz 0 0.779817968 0.779817968 1.559635936 0.000000000
sum over m 2.353693260 2.353693260 4.707386519 0.000000000
px 1 -0.008740182 -0.008740182 -0.017480364 0.000000000
py 1 -0.008737547 -0.008737547 -0.017475095 0.000000000
pz 1 -0.006464629 -0.006464629 -0.012929258 0.000000000
sum over m -0.023942358 -0.023942358 -0.047884717 0.000000000
sum over m+mul 2.329750901 2.329750901 4.659501802 0.000000000
d3z^2-r^2 0 -0.006390490 -0.006390490 -0.012780980 0.000000000
dx^2-y^2 0 -0.005059495 -0.005059495 -0.010118990 0.000000000
dxy 0 -0.005434167 -0.005434167 -0.010868334 0.000000000
dxz 0 -0.006932257 -0.006932257 -0.013864513 0.000000000
dyz 0 -0.006933943 -0.006933943 -0.013867886 0.000000000
sum over m -0.030750352 -0.030750352 -0.061500704 0.000000000
sum over m+mul -0.030750352 -0.030750352 -0.061500704 0.000000000
721 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758580 1.000758580 2.001517159 0.000000000
sum over m 1.000758580 1.000758580 2.001517159 0.000000000
s 1 0.207412087 0.207412087 0.414824173 0.000000000
sum over m 0.207412087 0.207412087 0.414824173 0.000000000
s 2 0.014726635 0.014726635 0.029453269 0.000000000
sum over m 0.014726635 0.014726635 0.029453269 0.000000000
sum over m+mul 1.222897301 1.222897301 2.445794602 0.000000000
px 0 1.006367276 1.006367276 2.012734551 0.000000000
py 0 1.006373430 1.006373430 2.012746861 0.000000000
pz 0 1.006214904 1.006214904 2.012429807 0.000000000
sum over m 3.018955609 3.018955609 6.037911219 0.000000000
px 1 0.065432003 0.065432003 0.130864006 0.000000000
py 1 0.065442150 0.065442150 0.130884299 0.000000000
pz 1 0.040381942 0.040381942 0.080763884 0.000000000
sum over m 0.171256095 0.171256095 0.342512190 0.000000000
sum over m+mul 3.190211704 3.190211704 6.380423408 0.000000000
d3z^2-r^2 0 0.196307095 0.196307095 0.392614189 0.000000000
dx^2-y^2 0 0.201519175 0.201519175 0.403038350 0.000000000
dxy 0 0.250925910 0.250925910 0.501851820 0.000000000
dxz 0 0.268516582 0.268516582 0.537033165 0.000000000
dyz 0 0.268500223 0.268500223 0.537000446 0.000000000
sum over m 1.185768985 1.185768985 2.371537970 0.000000000
d3z^2-r^2 1 0.003480294 0.003480294 0.006960588 0.000000000
dx^2-y^2 1 -0.004472707 -0.004472707 -0.008945415 0.000000000
dxy 1 0.015341260 0.015341260 0.030682519 0.000000000
dxz 1 0.003494934 0.003494934 0.006989868 0.000000000
dyz 1 0.003493777 0.003493777 0.006987555 0.000000000
sum over m 0.021337558 0.021337558 0.042675116 0.000000000
sum over m+mul 1.207106543 1.207106543 2.414213086 0.000000000
722 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742726 1.000742726 2.001485451 0.000000000
sum over m 1.000742726 1.000742726 2.001485451 0.000000000
s 1 0.207416785 0.207416785 0.414833570 0.000000000
sum over m 0.207416785 0.207416785 0.414833570 0.000000000
s 2 0.014727186 0.014727186 0.029454373 0.000000000
sum over m 0.014727186 0.014727186 0.029454373 0.000000000
sum over m+mul 1.222886697 1.222886697 2.445773394 0.000000000
px 0 1.006376184 1.006376184 2.012752367 0.000000000
py 0 1.006382080 1.006382080 2.012764160 0.000000000
pz 0 1.006198775 1.006198775 2.012397550 0.000000000
sum over m 3.018957039 3.018957039 6.037914078 0.000000000
px 1 0.065418224 0.065418224 0.130836448 0.000000000
py 1 0.065428977 0.065428977 0.130857954 0.000000000
pz 1 0.040408116 0.040408116 0.080816233 0.000000000
sum over m 0.171255317 0.171255317 0.342510635 0.000000000
sum over m+mul 3.190212356 3.190212356 6.380424712 0.000000000
d3z^2-r^2 0 0.196303172 0.196303172 0.392606345 0.000000000
dx^2-y^2 0 0.201527816 0.201527816 0.403055631 0.000000000
dxy 0 0.250905702 0.250905702 0.501811404 0.000000000
dxz 0 0.268520733 0.268520733 0.537041465 0.000000000
dyz 0 0.268515396 0.268515396 0.537030791 0.000000000
sum over m 1.185772819 1.185772819 2.371545637 0.000000000
d3z^2-r^2 1 0.003482203 0.003482203 0.006964407 0.000000000
dx^2-y^2 1 -0.004468465 -0.004468465 -0.008936930 0.000000000
dxy 1 0.015338826 0.015338826 0.030677652 0.000000000
dxz 1 0.003494083 0.003494083 0.006988166 0.000000000
dyz 1 0.003495915 0.003495915 0.006991831 0.000000000
sum over m 0.021342563 0.021342563 0.042685126 0.000000000
sum over m+mul 1.207115381 1.207115381 2.414230763 0.000000000
723 O Up spin Down spin Sum Diff
multiple
s 0 0.893872050 0.893872050 1.787744100 0.000000000
sum over m 0.893872050 0.893872050 1.787744100 0.000000000
s 1 -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m+mul 0.890829757 0.890829757 1.781659513 0.000000000
px 0 0.787000793 0.787000793 1.574001587 0.000000000
py 0 0.786838333 0.786838333 1.573676667 0.000000000
pz 0 0.779837016 0.779837016 1.559674032 0.000000000
sum over m 2.353676143 2.353676143 4.707352286 0.000000000
px 1 -0.008738859 -0.008738859 -0.017477718 0.000000000
py 1 -0.008735882 -0.008735882 -0.017471764 0.000000000
pz 1 -0.006464962 -0.006464962 -0.012929924 0.000000000
sum over m -0.023939703 -0.023939703 -0.047879406 0.000000000
sum over m+mul 2.329736440 2.329736440 4.659472880 0.000000000
d3z^2-r^2 0 -0.006389678 -0.006389678 -0.012779356 0.000000000
dx^2-y^2 0 -0.005060152 -0.005060152 -0.010120305 0.000000000
dxy 0 -0.005433238 -0.005433238 -0.010866475 0.000000000
dxz 0 -0.006932198 -0.006932198 -0.013864396 0.000000000
dyz 0 -0.006934550 -0.006934550 -0.013869101 0.000000000
sum over m -0.030749817 -0.030749817 -0.061499633 0.000000000
sum over m+mul -0.030749817 -0.030749817 -0.061499633 0.000000000
724 O Up spin Down spin Sum Diff
multiple
s 0 0.893902719 0.893902719 1.787805439 0.000000000
sum over m 0.893902719 0.893902719 1.787805439 0.000000000
s 1 -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m+mul 0.890860395 0.890860395 1.781720789 0.000000000
px 0 0.786877452 0.786877452 1.573754904 0.000000000
py 0 0.787071019 0.787071019 1.574142039 0.000000000
pz 0 0.779782974 0.779782974 1.559565948 0.000000000
sum over m 2.353731445 2.353731445 4.707462891 0.000000000
px 1 -0.008738305 -0.008738305 -0.017476611 0.000000000
py 1 -0.008744038 -0.008744038 -0.017488076 0.000000000
pz 1 -0.006462860 -0.006462860 -0.012925721 0.000000000
sum over m -0.023945204 -0.023945204 -0.047890408 0.000000000
sum over m+mul 2.329786241 2.329786241 4.659572483 0.000000000
d3z^2-r^2 0 -0.006390819 -0.006390819 -0.012781637 0.000000000
dx^2-y^2 0 -0.005058326 -0.005058326 -0.010116653 0.000000000
dxy 0 -0.005435279 -0.005435279 -0.010870557 0.000000000
dxz 0 -0.006933211 -0.006933211 -0.013866423 0.000000000
dyz 0 -0.006928893 -0.006928893 -0.013857785 0.000000000
sum over m -0.030746527 -0.030746527 -0.061493055 0.000000000
sum over m+mul -0.030746527 -0.030746527 -0.061493055 0.000000000
725 O Up spin Down spin Sum Diff
multiple
s 0 0.893912541 0.893912541 1.787825082 0.000000000
sum over m 0.893912541 0.893912541 1.787825082 0.000000000
s 1 -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m+mul 0.890869972 0.890869972 1.781739944 0.000000000
px 0 0.787021575 0.787021575 1.574043151 0.000000000
py 0 0.787071176 0.787071176 1.574142352 0.000000000
pz 0 0.779696459 0.779696459 1.559392918 0.000000000
sum over m 2.353789211 2.353789211 4.707578421 0.000000000
px 1 -0.008734448 -0.008734448 -0.017468896 0.000000000
py 1 -0.008735385 -0.008735385 -0.017470771 0.000000000
pz 1 -0.006455985 -0.006455985 -0.012911971 0.000000000
sum over m -0.023925818 -0.023925818 -0.047851637 0.000000000
sum over m+mul 2.329863392 2.329863392 4.659726784 0.000000000
d3z^2-r^2 0 -0.006390385 -0.006390385 -0.012780770 0.000000000
dx^2-y^2 0 -0.005053856 -0.005053856 -0.010107711 0.000000000
dxy 0 -0.005436296 -0.005436296 -0.010872593 0.000000000
dxz 0 -0.006927057 -0.006927057 -0.013854114 0.000000000
dyz 0 -0.006924533 -0.006924533 -0.013849065 0.000000000
sum over m -0.030732127 -0.030732127 -0.061464253 0.000000000
sum over m+mul -0.030732127 -0.030732127 -0.061464253 0.000000000
726 O Up spin Down spin Sum Diff
multiple
s 0 0.893885965 0.893885965 1.787771929 0.000000000
sum over m 0.893885965 0.893885965 1.787771929 0.000000000
s 1 -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m+mul 0.890843481 0.890843481 1.781686962 0.000000000
px 0 0.786986432 0.786986432 1.573972864 0.000000000
py 0 0.786888859 0.786888859 1.573777719 0.000000000
pz 0 0.779817968 0.779817968 1.559635936 0.000000000
sum over m 2.353693260 2.353693260 4.707386519 0.000000000
px 1 -0.008740182 -0.008740182 -0.017480364 0.000000000
py 1 -0.008737547 -0.008737547 -0.017475095 0.000000000
pz 1 -0.006464629 -0.006464629 -0.012929258 0.000000000
sum over m -0.023942358 -0.023942358 -0.047884717 0.000000000
sum over m+mul 2.329750901 2.329750901 4.659501803 0.000000000
d3z^2-r^2 0 -0.006390490 -0.006390490 -0.012780980 0.000000000
dx^2-y^2 0 -0.005059495 -0.005059495 -0.010118990 0.000000000
dxy 0 -0.005434167 -0.005434167 -0.010868334 0.000000000
dxz 0 -0.006932257 -0.006932257 -0.013864513 0.000000000
dyz 0 -0.006933943 -0.006933943 -0.013867886 0.000000000
sum over m -0.030750352 -0.030750352 -0.061500704 0.000000000
sum over m+mul -0.030750352 -0.030750352 -0.061500704 0.000000000
727 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758580 1.000758580 2.001517159 0.000000000
sum over m 1.000758580 1.000758580 2.001517159 0.000000000
s 1 0.207412087 0.207412087 0.414824173 0.000000000
sum over m 0.207412087 0.207412087 0.414824173 0.000000000
s 2 0.014726635 0.014726635 0.029453269 0.000000000
sum over m 0.014726635 0.014726635 0.029453269 0.000000000
sum over m+mul 1.222897301 1.222897301 2.445794602 0.000000000
px 0 1.006367276 1.006367276 2.012734551 0.000000000
py 0 1.006373430 1.006373430 2.012746861 0.000000000
pz 0 1.006214903 1.006214903 2.012429807 0.000000000
sum over m 3.018955609 3.018955609 6.037911219 0.000000000
px 1 0.065432003 0.065432003 0.130864006 0.000000000
py 1 0.065442150 0.065442150 0.130884299 0.000000000
pz 1 0.040381942 0.040381942 0.080763885 0.000000000
sum over m 0.171256095 0.171256095 0.342512190 0.000000000
sum over m+mul 3.190211705 3.190211705 6.380423409 0.000000000
d3z^2-r^2 0 0.196307095 0.196307095 0.392614189 0.000000000
dx^2-y^2 0 0.201519175 0.201519175 0.403038350 0.000000000
dxy 0 0.250925910 0.250925910 0.501851820 0.000000000
dxz 0 0.268516582 0.268516582 0.537033165 0.000000000
dyz 0 0.268500223 0.268500223 0.537000446 0.000000000
sum over m 1.185768985 1.185768985 2.371537971 0.000000000
d3z^2-r^2 1 0.003480294 0.003480294 0.006960588 0.000000000
dx^2-y^2 1 -0.004472707 -0.004472707 -0.008945415 0.000000000
dxy 1 0.015341260 0.015341260 0.030682519 0.000000000
dxz 1 0.003494934 0.003494934 0.006989868 0.000000000
dyz 1 0.003493777 0.003493777 0.006987555 0.000000000
sum over m 0.021337558 0.021337558 0.042675116 0.000000000
sum over m+mul 1.207106543 1.207106543 2.414213087 0.000000000
728 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742725 1.000742725 2.001485451 0.000000000
sum over m 1.000742725 1.000742725 2.001485451 0.000000000
s 1 0.207416785 0.207416785 0.414833569 0.000000000
sum over m 0.207416785 0.207416785 0.414833569 0.000000000
s 2 0.014727186 0.014727186 0.029454373 0.000000000
sum over m 0.014727186 0.014727186 0.029454373 0.000000000
sum over m+mul 1.222886696 1.222886696 2.445773393 0.000000000
px 0 1.006376184 1.006376184 2.012752368 0.000000000
py 0 1.006382080 1.006382080 2.012764160 0.000000000
pz 0 1.006198775 1.006198775 2.012397550 0.000000000
sum over m 3.018957039 3.018957039 6.037914078 0.000000000
px 1 0.065418224 0.065418224 0.130836448 0.000000000
py 1 0.065428977 0.065428977 0.130857954 0.000000000
pz 1 0.040408116 0.040408116 0.080816232 0.000000000
sum over m 0.171255317 0.171255317 0.342510634 0.000000000
sum over m+mul 3.190212356 3.190212356 6.380424712 0.000000000
d3z^2-r^2 0 0.196303172 0.196303172 0.392606345 0.000000000
dx^2-y^2 0 0.201527816 0.201527816 0.403055631 0.000000000
dxy 0 0.250905702 0.250905702 0.501811404 0.000000000
dxz 0 0.268520733 0.268520733 0.537041466 0.000000000
dyz 0 0.268515395 0.268515395 0.537030791 0.000000000
sum over m 1.185772818 1.185772818 2.371545637 0.000000000
d3z^2-r^2 1 0.003482203 0.003482203 0.006964407 0.000000000
dx^2-y^2 1 -0.004468465 -0.004468465 -0.008936930 0.000000000
dxy 1 0.015338826 0.015338826 0.030677652 0.000000000
dxz 1 0.003494083 0.003494083 0.006988166 0.000000000
dyz 1 0.003495915 0.003495915 0.006991831 0.000000000
sum over m 0.021342563 0.021342563 0.042685126 0.000000000
sum over m+mul 1.207115381 1.207115381 2.414230763 0.000000000
729 O Up spin Down spin Sum Diff
multiple
s 0 0.893872050 0.893872050 1.787744100 0.000000000
sum over m 0.893872050 0.893872050 1.787744100 0.000000000
s 1 -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m+mul 0.890829757 0.890829757 1.781659513 0.000000000
px 0 0.787000794 0.787000794 1.574001587 0.000000000
py 0 0.786838334 0.786838334 1.573676667 0.000000000
pz 0 0.779837016 0.779837016 1.559674032 0.000000000
sum over m 2.353676143 2.353676143 4.707352286 0.000000000
px 1 -0.008738859 -0.008738859 -0.017477718 0.000000000
py 1 -0.008735882 -0.008735882 -0.017471764 0.000000000
pz 1 -0.006464962 -0.006464962 -0.012929924 0.000000000
sum over m -0.023939703 -0.023939703 -0.047879406 0.000000000
sum over m+mul 2.329736440 2.329736440 4.659472880 0.000000000
d3z^2-r^2 0 -0.006389678 -0.006389678 -0.012779356 0.000000000
dx^2-y^2 0 -0.005060152 -0.005060152 -0.010120305 0.000000000
dxy 0 -0.005433238 -0.005433238 -0.010866475 0.000000000
dxz 0 -0.006932198 -0.006932198 -0.013864396 0.000000000
dyz 0 -0.006934550 -0.006934550 -0.013869101 0.000000000
sum over m -0.030749817 -0.030749817 -0.061499633 0.000000000
sum over m+mul -0.030749817 -0.030749817 -0.061499633 0.000000000
730 O Up spin Down spin Sum Diff
multiple
s 0 0.893902719 0.893902719 1.787805439 0.000000000
sum over m 0.893902719 0.893902719 1.787805439 0.000000000
s 1 -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m+mul 0.890860394 0.890860394 1.781720789 0.000000000
px 0 0.786877452 0.786877452 1.573754904 0.000000000
py 0 0.787071019 0.787071019 1.574142038 0.000000000
pz 0 0.779782974 0.779782974 1.559565948 0.000000000
sum over m 2.353731445 2.353731445 4.707462889 0.000000000
px 1 -0.008738305 -0.008738305 -0.017476611 0.000000000
py 1 -0.008744038 -0.008744038 -0.017488076 0.000000000
pz 1 -0.006462860 -0.006462860 -0.012925721 0.000000000
sum over m -0.023945204 -0.023945204 -0.047890408 0.000000000
sum over m+mul 2.329786241 2.329786241 4.659572481 0.000000000
d3z^2-r^2 0 -0.006390819 -0.006390819 -0.012781637 0.000000000
dx^2-y^2 0 -0.005058326 -0.005058326 -0.010116653 0.000000000
dxy 0 -0.005435279 -0.005435279 -0.010870557 0.000000000
dxz 0 -0.006933211 -0.006933211 -0.013866423 0.000000000
dyz 0 -0.006928893 -0.006928893 -0.013857785 0.000000000
sum over m -0.030746527 -0.030746527 -0.061493055 0.000000000
sum over m+mul -0.030746527 -0.030746527 -0.061493055 0.000000000
731 O Up spin Down spin Sum Diff
multiple
s 0 0.893912541 0.893912541 1.787825082 0.000000000
sum over m 0.893912541 0.893912541 1.787825082 0.000000000
s 1 -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m+mul 0.890869972 0.890869972 1.781739944 0.000000000
px 0 0.787021575 0.787021575 1.574043151 0.000000000
py 0 0.787071176 0.787071176 1.574142353 0.000000000
pz 0 0.779696459 0.779696459 1.559392918 0.000000000
sum over m 2.353789211 2.353789211 4.707578422 0.000000000
px 1 -0.008734448 -0.008734448 -0.017468896 0.000000000
py 1 -0.008735385 -0.008735385 -0.017470771 0.000000000
pz 1 -0.006455985 -0.006455985 -0.012911971 0.000000000
sum over m -0.023925819 -0.023925819 -0.047851637 0.000000000
sum over m+mul 2.329863392 2.329863392 4.659726784 0.000000000
d3z^2-r^2 0 -0.006390385 -0.006390385 -0.012780770 0.000000000
dx^2-y^2 0 -0.005053856 -0.005053856 -0.010107711 0.000000000
dxy 0 -0.005436296 -0.005436296 -0.010872593 0.000000000
dxz 0 -0.006927057 -0.006927057 -0.013854114 0.000000000
dyz 0 -0.006924533 -0.006924533 -0.013849065 0.000000000
sum over m -0.030732127 -0.030732127 -0.061464253 0.000000000
sum over m+mul -0.030732127 -0.030732127 -0.061464253 0.000000000
732 O Up spin Down spin Sum Diff
multiple
s 0 0.893885965 0.893885965 1.787771929 0.000000000
sum over m 0.893885965 0.893885965 1.787771929 0.000000000
s 1 -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m+mul 0.890843481 0.890843481 1.781686962 0.000000000
px 0 0.786986432 0.786986432 1.573972864 0.000000000
py 0 0.786888859 0.786888859 1.573777718 0.000000000
pz 0 0.779817968 0.779817968 1.559635936 0.000000000
sum over m 2.353693259 2.353693259 4.707386519 0.000000000
px 1 -0.008740182 -0.008740182 -0.017480364 0.000000000
py 1 -0.008737547 -0.008737547 -0.017475095 0.000000000
pz 1 -0.006464629 -0.006464629 -0.012929258 0.000000000
sum over m -0.023942358 -0.023942358 -0.047884717 0.000000000
sum over m+mul 2.329750901 2.329750901 4.659501802 0.000000000
d3z^2-r^2 0 -0.006390490 -0.006390490 -0.012780980 0.000000000
dx^2-y^2 0 -0.005059495 -0.005059495 -0.010118990 0.000000000
dxy 0 -0.005434167 -0.005434167 -0.010868334 0.000000000
dxz 0 -0.006932257 -0.006932257 -0.013864513 0.000000000
dyz 0 -0.006933943 -0.006933943 -0.013867886 0.000000000
sum over m -0.030750352 -0.030750352 -0.061500704 0.000000000
sum over m+mul -0.030750352 -0.030750352 -0.061500704 0.000000000
733 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758579 1.000758579 2.001517159 0.000000000
sum over m 1.000758579 1.000758579 2.001517159 0.000000000
s 1 0.207412087 0.207412087 0.414824174 0.000000000
sum over m 0.207412087 0.207412087 0.414824174 0.000000000
s 2 0.014726635 0.014726635 0.029453270 0.000000000
sum over m 0.014726635 0.014726635 0.029453270 0.000000000
sum over m+mul 1.222897301 1.222897301 2.445794602 0.000000000
px 0 1.006367276 1.006367276 2.012734551 0.000000000
py 0 1.006373430 1.006373430 2.012746861 0.000000000
pz 0 1.006214904 1.006214904 2.012429807 0.000000000
sum over m 3.018955610 3.018955610 6.037911219 0.000000000
px 1 0.065432003 0.065432003 0.130864006 0.000000000
py 1 0.065442150 0.065442150 0.130884299 0.000000000
pz 1 0.040381942 0.040381942 0.080763885 0.000000000
sum over m 0.171256095 0.171256095 0.342512190 0.000000000
sum over m+mul 3.190211705 3.190211705 6.380423410 0.000000000
d3z^2-r^2 0 0.196307095 0.196307095 0.392614189 0.000000000
dx^2-y^2 0 0.201519175 0.201519175 0.403038350 0.000000000
dxy 0 0.250925910 0.250925910 0.501851821 0.000000000
dxz 0 0.268516583 0.268516583 0.537033165 0.000000000
dyz 0 0.268500223 0.268500223 0.537000446 0.000000000
sum over m 1.185768986 1.185768986 2.371537972 0.000000000
d3z^2-r^2 1 0.003480294 0.003480294 0.006960588 0.000000000
dx^2-y^2 1 -0.004472707 -0.004472707 -0.008945415 0.000000000
dxy 1 0.015341260 0.015341260 0.030682519 0.000000000
dxz 1 0.003494934 0.003494934 0.006989868 0.000000000
dyz 1 0.003493777 0.003493777 0.006987555 0.000000000
sum over m 0.021337558 0.021337558 0.042675116 0.000000000
sum over m+mul 1.207106544 1.207106544 2.414213087 0.000000000
734 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742725 1.000742725 2.001485451 0.000000000
sum over m 1.000742725 1.000742725 2.001485451 0.000000000
s 1 0.207416785 0.207416785 0.414833570 0.000000000
sum over m 0.207416785 0.207416785 0.414833570 0.000000000
s 2 0.014727186 0.014727186 0.029454373 0.000000000
sum over m 0.014727186 0.014727186 0.029454373 0.000000000
sum over m+mul 1.222886697 1.222886697 2.445773393 0.000000000
px 0 1.006376184 1.006376184 2.012752368 0.000000000
py 0 1.006382080 1.006382080 2.012764160 0.000000000
pz 0 1.006198775 1.006198775 2.012397550 0.000000000
sum over m 3.018957039 3.018957039 6.037914078 0.000000000
px 1 0.065418224 0.065418224 0.130836449 0.000000000
py 1 0.065428977 0.065428977 0.130857953 0.000000000
pz 1 0.040408116 0.040408116 0.080816233 0.000000000
sum over m 0.171255317 0.171255317 0.342510635 0.000000000
sum over m+mul 3.190212356 3.190212356 6.380424713 0.000000000
d3z^2-r^2 0 0.196303172 0.196303172 0.392606345 0.000000000
dx^2-y^2 0 0.201527816 0.201527816 0.403055631 0.000000000
dxy 0 0.250905702 0.250905702 0.501811404 0.000000000
dxz 0 0.268520733 0.268520733 0.537041465 0.000000000
dyz 0 0.268515395 0.268515395 0.537030791 0.000000000
sum over m 1.185772818 1.185772818 2.371545636 0.000000000
d3z^2-r^2 1 0.003482203 0.003482203 0.006964407 0.000000000
dx^2-y^2 1 -0.004468465 -0.004468465 -0.008936930 0.000000000
dxy 1 0.015338826 0.015338826 0.030677652 0.000000000
dxz 1 0.003494083 0.003494083 0.006988166 0.000000000
dyz 1 0.003495915 0.003495915 0.006991831 0.000000000
sum over m 0.021342563 0.021342563 0.042685126 0.000000000
sum over m+mul 1.207115381 1.207115381 2.414230762 0.000000000
735 O Up spin Down spin Sum Diff
multiple
s 0 0.893872050 0.893872050 1.787744100 0.000000000
sum over m 0.893872050 0.893872050 1.787744100 0.000000000
s 1 -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m+mul 0.890829757 0.890829757 1.781659513 0.000000000
px 0 0.787000793 0.787000793 1.574001587 0.000000000
py 0 0.786838333 0.786838333 1.573676667 0.000000000
pz 0 0.779837016 0.779837016 1.559674032 0.000000000
sum over m 2.353676143 2.353676143 4.707352286 0.000000000
px 1 -0.008738859 -0.008738859 -0.017477718 0.000000000
py 1 -0.008735882 -0.008735882 -0.017471764 0.000000000
pz 1 -0.006464962 -0.006464962 -0.012929924 0.000000000
sum over m -0.023939703 -0.023939703 -0.047879406 0.000000000
sum over m+mul 2.329736440 2.329736440 4.659472880 0.000000000
d3z^2-r^2 0 -0.006389678 -0.006389678 -0.012779356 0.000000000
dx^2-y^2 0 -0.005060152 -0.005060152 -0.010120305 0.000000000
dxy 0 -0.005433238 -0.005433238 -0.010866475 0.000000000
dxz 0 -0.006932198 -0.006932198 -0.013864396 0.000000000
dyz 0 -0.006934550 -0.006934550 -0.013869101 0.000000000
sum over m -0.030749817 -0.030749817 -0.061499633 0.000000000
sum over m+mul -0.030749817 -0.030749817 -0.061499633 0.000000000
736 O Up spin Down spin Sum Diff
multiple
s 0 0.893902719 0.893902719 1.787805438 0.000000000
sum over m 0.893902719 0.893902719 1.787805438 0.000000000
s 1 -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m+mul 0.890860394 0.890860394 1.781720789 0.000000000
px 0 0.786877452 0.786877452 1.573754904 0.000000000
py 0 0.787071019 0.787071019 1.574142038 0.000000000
pz 0 0.779782974 0.779782974 1.559565948 0.000000000
sum over m 2.353731445 2.353731445 4.707462890 0.000000000
px 1 -0.008738305 -0.008738305 -0.017476611 0.000000000
py 1 -0.008744038 -0.008744038 -0.017488076 0.000000000
pz 1 -0.006462860 -0.006462860 -0.012925721 0.000000000
sum over m -0.023945204 -0.023945204 -0.047890408 0.000000000
sum over m+mul 2.329786241 2.329786241 4.659572482 0.000000000
d3z^2-r^2 0 -0.006390819 -0.006390819 -0.012781637 0.000000000
dx^2-y^2 0 -0.005058326 -0.005058326 -0.010116653 0.000000000
dxy 0 -0.005435279 -0.005435279 -0.010870557 0.000000000
dxz 0 -0.006933211 -0.006933211 -0.013866423 0.000000000
dyz 0 -0.006928893 -0.006928893 -0.013857785 0.000000000
sum over m -0.030746527 -0.030746527 -0.061493055 0.000000000
sum over m+mul -0.030746527 -0.030746527 -0.061493055 0.000000000
737 O Up spin Down spin Sum Diff
multiple
s 0 0.893912541 0.893912541 1.787825082 0.000000000
sum over m 0.893912541 0.893912541 1.787825082 0.000000000
s 1 -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m+mul 0.890869972 0.890869972 1.781739944 0.000000000
px 0 0.787021575 0.787021575 1.574043151 0.000000000
py 0 0.787071176 0.787071176 1.574142353 0.000000000
pz 0 0.779696459 0.779696459 1.559392918 0.000000000
sum over m 2.353789210 2.353789210 4.707578421 0.000000000
px 1 -0.008734448 -0.008734448 -0.017468896 0.000000000
py 1 -0.008735385 -0.008735385 -0.017470771 0.000000000
pz 1 -0.006455985 -0.006455985 -0.012911971 0.000000000
sum over m -0.023925819 -0.023925819 -0.047851637 0.000000000
sum over m+mul 2.329863392 2.329863392 4.659726784 0.000000000
d3z^2-r^2 0 -0.006390385 -0.006390385 -0.012780770 0.000000000
dx^2-y^2 0 -0.005053856 -0.005053856 -0.010107711 0.000000000
dxy 0 -0.005436296 -0.005436296 -0.010872593 0.000000000
dxz 0 -0.006927057 -0.006927057 -0.013854114 0.000000000
dyz 0 -0.006924533 -0.006924533 -0.013849065 0.000000000
sum over m -0.030732127 -0.030732127 -0.061464253 0.000000000
sum over m+mul -0.030732127 -0.030732127 -0.061464253 0.000000000
738 O Up spin Down spin Sum Diff
multiple
s 0 0.893885965 0.893885965 1.787771930 0.000000000
sum over m 0.893885965 0.893885965 1.787771930 0.000000000
s 1 -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m+mul 0.890843481 0.890843481 1.781686962 0.000000000
px 0 0.786986432 0.786986432 1.573972864 0.000000000
py 0 0.786888859 0.786888859 1.573777718 0.000000000
pz 0 0.779817968 0.779817968 1.559635936 0.000000000
sum over m 2.353693259 2.353693259 4.707386519 0.000000000
px 1 -0.008740182 -0.008740182 -0.017480364 0.000000000
py 1 -0.008737547 -0.008737547 -0.017475095 0.000000000
pz 1 -0.006464629 -0.006464629 -0.012929258 0.000000000
sum over m -0.023942358 -0.023942358 -0.047884717 0.000000000
sum over m+mul 2.329750901 2.329750901 4.659501802 0.000000000
d3z^2-r^2 0 -0.006390490 -0.006390490 -0.012780980 0.000000000
dx^2-y^2 0 -0.005059495 -0.005059495 -0.010118990 0.000000000
dxy 0 -0.005434167 -0.005434167 -0.010868334 0.000000000
dxz 0 -0.006932257 -0.006932257 -0.013864513 0.000000000
dyz 0 -0.006933943 -0.006933943 -0.013867886 0.000000000
sum over m -0.030750352 -0.030750352 -0.061500704 0.000000000
sum over m+mul -0.030750352 -0.030750352 -0.061500704 0.000000000
739 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758579 1.000758579 2.001517159 0.000000000
sum over m 1.000758579 1.000758579 2.001517159 0.000000000
s 1 0.207412087 0.207412087 0.414824174 0.000000000
sum over m 0.207412087 0.207412087 0.414824174 0.000000000
s 2 0.014726635 0.014726635 0.029453270 0.000000000
sum over m 0.014726635 0.014726635 0.029453270 0.000000000
sum over m+mul 1.222897301 1.222897301 2.445794602 0.000000000
px 0 1.006367276 1.006367276 2.012734551 0.000000000
py 0 1.006373430 1.006373430 2.012746861 0.000000000
pz 0 1.006214904 1.006214904 2.012429807 0.000000000
sum over m 3.018955610 3.018955610 6.037911219 0.000000000
px 1 0.065432003 0.065432003 0.130864006 0.000000000
py 1 0.065442150 0.065442150 0.130884299 0.000000000
pz 1 0.040381942 0.040381942 0.080763884 0.000000000
sum over m 0.171256095 0.171256095 0.342512190 0.000000000
sum over m+mul 3.190211704 3.190211704 6.380423409 0.000000000
d3z^2-r^2 0 0.196307095 0.196307095 0.392614189 0.000000000
dx^2-y^2 0 0.201519175 0.201519175 0.403038351 0.000000000
dxy 0 0.250925910 0.250925910 0.501851821 0.000000000
dxz 0 0.268516583 0.268516583 0.537033165 0.000000000
dyz 0 0.268500223 0.268500223 0.537000446 0.000000000
sum over m 1.185768986 1.185768986 2.371537972 0.000000000
d3z^2-r^2 1 0.003480294 0.003480294 0.006960588 0.000000000
dx^2-y^2 1 -0.004472707 -0.004472707 -0.008945415 0.000000000
dxy 1 0.015341260 0.015341260 0.030682519 0.000000000
dxz 1 0.003494934 0.003494934 0.006989868 0.000000000
dyz 1 0.003493777 0.003493777 0.006987555 0.000000000
sum over m 0.021337558 0.021337558 0.042675116 0.000000000
sum over m+mul 1.207106544 1.207106544 2.414213088 0.000000000
740 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742726 1.000742726 2.001485451 0.000000000
sum over m 1.000742726 1.000742726 2.001485451 0.000000000
s 1 0.207416785 0.207416785 0.414833570 0.000000000
sum over m 0.207416785 0.207416785 0.414833570 0.000000000
s 2 0.014727186 0.014727186 0.029454373 0.000000000
sum over m 0.014727186 0.014727186 0.029454373 0.000000000
sum over m+mul 1.222886697 1.222886697 2.445773394 0.000000000
px 0 1.006376184 1.006376184 2.012752367 0.000000000
py 0 1.006382080 1.006382080 2.012764160 0.000000000
pz 0 1.006198775 1.006198775 2.012397550 0.000000000
sum over m 3.018957039 3.018957039 6.037914078 0.000000000
px 1 0.065418224 0.065418224 0.130836448 0.000000000
py 1 0.065428977 0.065428977 0.130857954 0.000000000
pz 1 0.040408116 0.040408116 0.080816232 0.000000000
sum over m 0.171255317 0.171255317 0.342510634 0.000000000
sum over m+mul 3.190212356 3.190212356 6.380424712 0.000000000
d3z^2-r^2 0 0.196303172 0.196303172 0.392606344 0.000000000
dx^2-y^2 0 0.201527816 0.201527816 0.403055632 0.000000000
dxy 0 0.250905702 0.250905702 0.501811405 0.000000000
dxz 0 0.268520733 0.268520733 0.537041465 0.000000000
dyz 0 0.268515396 0.268515396 0.537030791 0.000000000
sum over m 1.185772819 1.185772819 2.371545638 0.000000000
d3z^2-r^2 1 0.003482203 0.003482203 0.006964407 0.000000000
dx^2-y^2 1 -0.004468465 -0.004468465 -0.008936930 0.000000000
dxy 1 0.015338826 0.015338826 0.030677652 0.000000000
dxz 1 0.003494083 0.003494083 0.006988166 0.000000000
dyz 1 0.003495915 0.003495915 0.006991831 0.000000000
sum over m 0.021342563 0.021342563 0.042685126 0.000000000
sum over m+mul 1.207115382 1.207115382 2.414230763 0.000000000
741 O Up spin Down spin Sum Diff
multiple
s 0 0.893872050 0.893872050 1.787744100 0.000000000
sum over m 0.893872050 0.893872050 1.787744100 0.000000000
s 1 -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m+mul 0.890829757 0.890829757 1.781659513 0.000000000
px 0 0.787000794 0.787000794 1.574001587 0.000000000
py 0 0.786838333 0.786838333 1.573676667 0.000000000
pz 0 0.779837016 0.779837016 1.559674032 0.000000000
sum over m 2.353676143 2.353676143 4.707352286 0.000000000
px 1 -0.008738859 -0.008738859 -0.017477718 0.000000000
py 1 -0.008735882 -0.008735882 -0.017471764 0.000000000
pz 1 -0.006464962 -0.006464962 -0.012929924 0.000000000
sum over m -0.023939703 -0.023939703 -0.047879406 0.000000000
sum over m+mul 2.329736440 2.329736440 4.659472880 0.000000000
d3z^2-r^2 0 -0.006389678 -0.006389678 -0.012779356 0.000000000
dx^2-y^2 0 -0.005060152 -0.005060152 -0.010120305 0.000000000
dxy 0 -0.005433238 -0.005433238 -0.010866475 0.000000000
dxz 0 -0.006932198 -0.006932198 -0.013864396 0.000000000
dyz 0 -0.006934550 -0.006934550 -0.013869101 0.000000000
sum over m -0.030749817 -0.030749817 -0.061499633 0.000000000
sum over m+mul -0.030749817 -0.030749817 -0.061499633 0.000000000
742 O Up spin Down spin Sum Diff
multiple
s 0 0.893902719 0.893902719 1.787805439 0.000000000
sum over m 0.893902719 0.893902719 1.787805439 0.000000000
s 1 -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m+mul 0.890860394 0.890860394 1.781720789 0.000000000
px 0 0.786877452 0.786877452 1.573754904 0.000000000
py 0 0.787071019 0.787071019 1.574142038 0.000000000
pz 0 0.779782974 0.779782974 1.559565948 0.000000000
sum over m 2.353731445 2.353731445 4.707462890 0.000000000
px 1 -0.008738305 -0.008738305 -0.017476611 0.000000000
py 1 -0.008744038 -0.008744038 -0.017488076 0.000000000
pz 1 -0.006462860 -0.006462860 -0.012925721 0.000000000
sum over m -0.023945204 -0.023945204 -0.047890408 0.000000000
sum over m+mul 2.329786241 2.329786241 4.659572482 0.000000000
d3z^2-r^2 0 -0.006390819 -0.006390819 -0.012781637 0.000000000
dx^2-y^2 0 -0.005058326 -0.005058326 -0.010116652 0.000000000
dxy 0 -0.005435279 -0.005435279 -0.010870557 0.000000000
dxz 0 -0.006933211 -0.006933211 -0.013866423 0.000000000
dyz 0 -0.006928893 -0.006928893 -0.013857785 0.000000000
sum over m -0.030746527 -0.030746527 -0.061493055 0.000000000
sum over m+mul -0.030746527 -0.030746527 -0.061493055 0.000000000
743 O Up spin Down spin Sum Diff
multiple
s 0 0.893912541 0.893912541 1.787825082 0.000000000
sum over m 0.893912541 0.893912541 1.787825082 0.000000000
s 1 -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m+mul 0.890869972 0.890869972 1.781739944 0.000000000
px 0 0.787021575 0.787021575 1.574043151 0.000000000
py 0 0.787071176 0.787071176 1.574142353 0.000000000
pz 0 0.779696459 0.779696459 1.559392918 0.000000000
sum over m 2.353789211 2.353789211 4.707578422 0.000000000
px 1 -0.008734448 -0.008734448 -0.017468896 0.000000000
py 1 -0.008735385 -0.008735385 -0.017470771 0.000000000
pz 1 -0.006455985 -0.006455985 -0.012911971 0.000000000
sum over m -0.023925819 -0.023925819 -0.047851637 0.000000000
sum over m+mul 2.329863392 2.329863392 4.659726785 0.000000000
d3z^2-r^2 0 -0.006390385 -0.006390385 -0.012780770 0.000000000
dx^2-y^2 0 -0.005053856 -0.005053856 -0.010107711 0.000000000
dxy 0 -0.005436296 -0.005436296 -0.010872593 0.000000000
dxz 0 -0.006927057 -0.006927057 -0.013854114 0.000000000
dyz 0 -0.006924533 -0.006924533 -0.013849065 0.000000000
sum over m -0.030732127 -0.030732127 -0.061464253 0.000000000
sum over m+mul -0.030732127 -0.030732127 -0.061464253 0.000000000
744 O Up spin Down spin Sum Diff
multiple
s 0 0.893885965 0.893885965 1.787771930 0.000000000
sum over m 0.893885965 0.893885965 1.787771930 0.000000000
s 1 -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m+mul 0.890843481 0.890843481 1.781686962 0.000000000
px 0 0.786986432 0.786986432 1.573972864 0.000000000
py 0 0.786888859 0.786888859 1.573777719 0.000000000
pz 0 0.779817968 0.779817968 1.559635937 0.000000000
sum over m 2.353693260 2.353693260 4.707386519 0.000000000
px 1 -0.008740182 -0.008740182 -0.017480364 0.000000000
py 1 -0.008737547 -0.008737547 -0.017475095 0.000000000
pz 1 -0.006464629 -0.006464629 -0.012929258 0.000000000
sum over m -0.023942358 -0.023942358 -0.047884717 0.000000000
sum over m+mul 2.329750901 2.329750901 4.659501802 0.000000000
d3z^2-r^2 0 -0.006390490 -0.006390490 -0.012780980 0.000000000
dx^2-y^2 0 -0.005059495 -0.005059495 -0.010118990 0.000000000
dxy 0 -0.005434167 -0.005434167 -0.010868334 0.000000000
dxz 0 -0.006932257 -0.006932257 -0.013864513 0.000000000
dyz 0 -0.006933943 -0.006933943 -0.013867886 0.000000000
sum over m -0.030750352 -0.030750352 -0.061500704 0.000000000
sum over m+mul -0.030750352 -0.030750352 -0.061500704 0.000000000
745 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758580 1.000758580 2.001517159 0.000000000
sum over m 1.000758580 1.000758580 2.001517159 0.000000000
s 1 0.207412087 0.207412087 0.414824173 0.000000000
sum over m 0.207412087 0.207412087 0.414824173 0.000000000
s 2 0.014726635 0.014726635 0.029453270 0.000000000
sum over m 0.014726635 0.014726635 0.029453270 0.000000000
sum over m+mul 1.222897301 1.222897301 2.445794602 0.000000000
px 0 1.006367276 1.006367276 2.012734551 0.000000000
py 0 1.006373430 1.006373430 2.012746861 0.000000000
pz 0 1.006214903 1.006214903 2.012429807 0.000000000
sum over m 3.018955609 3.018955609 6.037911219 0.000000000
px 1 0.065432003 0.065432003 0.130864006 0.000000000
py 1 0.065442150 0.065442150 0.130884299 0.000000000
pz 1 0.040381942 0.040381942 0.080763885 0.000000000
sum over m 0.171256095 0.171256095 0.342512190 0.000000000
sum over m+mul 3.190211704 3.190211704 6.380423409 0.000000000
d3z^2-r^2 0 0.196307095 0.196307095 0.392614190 0.000000000
dx^2-y^2 0 0.201519175 0.201519175 0.403038351 0.000000000
dxy 0 0.250925910 0.250925910 0.501851821 0.000000000
dxz 0 0.268516582 0.268516582 0.537033164 0.000000000
dyz 0 0.268500223 0.268500223 0.537000445 0.000000000
sum over m 1.185768986 1.185768986 2.371537971 0.000000000
d3z^2-r^2 1 0.003480294 0.003480294 0.006960588 0.000000000
dx^2-y^2 1 -0.004472707 -0.004472707 -0.008945415 0.000000000
dxy 1 0.015341260 0.015341260 0.030682519 0.000000000
dxz 1 0.003494934 0.003494934 0.006989868 0.000000000
dyz 1 0.003493777 0.003493777 0.006987555 0.000000000
sum over m 0.021337558 0.021337558 0.042675116 0.000000000
sum over m+mul 1.207106543 1.207106543 2.414213087 0.000000000
746 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742725 1.000742725 2.001485451 0.000000000
sum over m 1.000742725 1.000742725 2.001485451 0.000000000
s 1 0.207416785 0.207416785 0.414833569 0.000000000
sum over m 0.207416785 0.207416785 0.414833569 0.000000000
s 2 0.014727186 0.014727186 0.029454373 0.000000000
sum over m 0.014727186 0.014727186 0.029454373 0.000000000
sum over m+mul 1.222886696 1.222886696 2.445773393 0.000000000
px 0 1.006376184 1.006376184 2.012752367 0.000000000
py 0 1.006382080 1.006382080 2.012764160 0.000000000
pz 0 1.006198775 1.006198775 2.012397550 0.000000000
sum over m 3.018957039 3.018957039 6.037914078 0.000000000
px 1 0.065418224 0.065418224 0.130836448 0.000000000
py 1 0.065428977 0.065428977 0.130857953 0.000000000
pz 1 0.040408116 0.040408116 0.080816233 0.000000000
sum over m 0.171255317 0.171255317 0.342510634 0.000000000
sum over m+mul 3.190212356 3.190212356 6.380424712 0.000000000
d3z^2-r^2 0 0.196303172 0.196303172 0.392606345 0.000000000
dx^2-y^2 0 0.201527816 0.201527816 0.403055632 0.000000000
dxy 0 0.250905702 0.250905702 0.501811404 0.000000000
dxz 0 0.268520733 0.268520733 0.537041466 0.000000000
dyz 0 0.268515396 0.268515396 0.537030791 0.000000000
sum over m 1.185772819 1.185772819 2.371545638 0.000000000
d3z^2-r^2 1 0.003482203 0.003482203 0.006964407 0.000000000
dx^2-y^2 1 -0.004468465 -0.004468465 -0.008936930 0.000000000
dxy 1 0.015338826 0.015338826 0.030677652 0.000000000
dxz 1 0.003494083 0.003494083 0.006988166 0.000000000
dyz 1 0.003495915 0.003495915 0.006991831 0.000000000
sum over m 0.021342563 0.021342563 0.042685126 0.000000000
sum over m+mul 1.207115382 1.207115382 2.414230763 0.000000000
747 O Up spin Down spin Sum Diff
multiple
s 0 0.893872050 0.893872050 1.787744100 0.000000000
sum over m 0.893872050 0.893872050 1.787744100 0.000000000
s 1 -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m+mul 0.890829757 0.890829757 1.781659513 0.000000000
px 0 0.787000793 0.787000793 1.574001587 0.000000000
py 0 0.786838333 0.786838333 1.573676667 0.000000000
pz 0 0.779837016 0.779837016 1.559674032 0.000000000
sum over m 2.353676143 2.353676143 4.707352285 0.000000000
px 1 -0.008738859 -0.008738859 -0.017477718 0.000000000
py 1 -0.008735882 -0.008735882 -0.017471764 0.000000000
pz 1 -0.006464962 -0.006464962 -0.012929924 0.000000000
sum over m -0.023939703 -0.023939703 -0.047879406 0.000000000
sum over m+mul 2.329736440 2.329736440 4.659472879 0.000000000
d3z^2-r^2 0 -0.006389678 -0.006389678 -0.012779356 0.000000000
dx^2-y^2 0 -0.005060152 -0.005060152 -0.010120305 0.000000000
dxy 0 -0.005433238 -0.005433238 -0.010866475 0.000000000
dxz 0 -0.006932198 -0.006932198 -0.013864396 0.000000000
dyz 0 -0.006934550 -0.006934550 -0.013869101 0.000000000
sum over m -0.030749817 -0.030749817 -0.061499633 0.000000000
sum over m+mul -0.030749817 -0.030749817 -0.061499633 0.000000000
748 O Up spin Down spin Sum Diff
multiple
s 0 0.893902719 0.893902719 1.787805439 0.000000000
sum over m 0.893902719 0.893902719 1.787805439 0.000000000
s 1 -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m+mul 0.890860394 0.890860394 1.781720789 0.000000000
px 0 0.786877452 0.786877452 1.573754904 0.000000000
py 0 0.787071019 0.787071019 1.574142038 0.000000000
pz 0 0.779782974 0.779782974 1.559565948 0.000000000
sum over m 2.353731445 2.353731445 4.707462890 0.000000000
px 1 -0.008738305 -0.008738305 -0.017476611 0.000000000
py 1 -0.008744038 -0.008744038 -0.017488076 0.000000000
pz 1 -0.006462860 -0.006462860 -0.012925721 0.000000000
sum over m -0.023945204 -0.023945204 -0.047890408 0.000000000
sum over m+mul 2.329786241 2.329786241 4.659572482 0.000000000
d3z^2-r^2 0 -0.006390819 -0.006390819 -0.012781637 0.000000000
dx^2-y^2 0 -0.005058326 -0.005058326 -0.010116653 0.000000000
dxy 0 -0.005435279 -0.005435279 -0.010870557 0.000000000
dxz 0 -0.006933211 -0.006933211 -0.013866423 0.000000000
dyz 0 -0.006928893 -0.006928893 -0.013857785 0.000000000
sum over m -0.030746527 -0.030746527 -0.061493055 0.000000000
sum over m+mul -0.030746527 -0.030746527 -0.061493055 0.000000000
749 O Up spin Down spin Sum Diff
multiple
s 0 0.893912541 0.893912541 1.787825082 0.000000000
sum over m 0.893912541 0.893912541 1.787825082 0.000000000
s 1 -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m+mul 0.890869972 0.890869972 1.781739944 0.000000000
px 0 0.787021575 0.787021575 1.574043151 0.000000000
py 0 0.787071176 0.787071176 1.574142352 0.000000000
pz 0 0.779696459 0.779696459 1.559392918 0.000000000
sum over m 2.353789211 2.353789211 4.707578421 0.000000000
px 1 -0.008734448 -0.008734448 -0.017468896 0.000000000
py 1 -0.008735385 -0.008735385 -0.017470771 0.000000000
pz 1 -0.006455985 -0.006455985 -0.012911971 0.000000000
sum over m -0.023925818 -0.023925818 -0.047851637 0.000000000
sum over m+mul 2.329863392 2.329863392 4.659726784 0.000000000
d3z^2-r^2 0 -0.006390385 -0.006390385 -0.012780770 0.000000000
dx^2-y^2 0 -0.005053856 -0.005053856 -0.010107711 0.000000000
dxy 0 -0.005436296 -0.005436296 -0.010872593 0.000000000
dxz 0 -0.006927057 -0.006927057 -0.013854114 0.000000000
dyz 0 -0.006924533 -0.006924533 -0.013849065 0.000000000
sum over m -0.030732127 -0.030732127 -0.061464253 0.000000000
sum over m+mul -0.030732127 -0.030732127 -0.061464253 0.000000000
750 O Up spin Down spin Sum Diff
multiple
s 0 0.893885965 0.893885965 1.787771929 0.000000000
sum over m 0.893885965 0.893885965 1.787771929 0.000000000
s 1 -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m+mul 0.890843481 0.890843481 1.781686962 0.000000000
px 0 0.786986432 0.786986432 1.573972864 0.000000000
py 0 0.786888859 0.786888859 1.573777719 0.000000000
pz 0 0.779817968 0.779817968 1.559635937 0.000000000
sum over m 2.353693260 2.353693260 4.707386519 0.000000000
px 1 -0.008740182 -0.008740182 -0.017480364 0.000000000
py 1 -0.008737547 -0.008737547 -0.017475095 0.000000000
pz 1 -0.006464629 -0.006464629 -0.012929258 0.000000000
sum over m -0.023942358 -0.023942358 -0.047884717 0.000000000
sum over m+mul 2.329750901 2.329750901 4.659501802 0.000000000
d3z^2-r^2 0 -0.006390490 -0.006390490 -0.012780980 0.000000000
dx^2-y^2 0 -0.005059495 -0.005059495 -0.010118990 0.000000000
dxy 0 -0.005434167 -0.005434167 -0.010868334 0.000000000
dxz 0 -0.006932257 -0.006932257 -0.013864513 0.000000000
dyz 0 -0.006933943 -0.006933943 -0.013867886 0.000000000
sum over m -0.030750352 -0.030750352 -0.061500704 0.000000000
sum over m+mul -0.030750352 -0.030750352 -0.061500704 0.000000000
751 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758579 1.000758579 2.001517159 0.000000000
sum over m 1.000758579 1.000758579 2.001517159 0.000000000
s 1 0.207412087 0.207412087 0.414824173 0.000000000
sum over m 0.207412087 0.207412087 0.414824173 0.000000000
s 2 0.014726635 0.014726635 0.029453269 0.000000000
sum over m 0.014726635 0.014726635 0.029453269 0.000000000
sum over m+mul 1.222897301 1.222897301 2.445794602 0.000000000
px 0 1.006367276 1.006367276 2.012734551 0.000000000
py 0 1.006373430 1.006373430 2.012746861 0.000000000
pz 0 1.006214904 1.006214904 2.012429807 0.000000000
sum over m 3.018955609 3.018955609 6.037911219 0.000000000
px 1 0.065432003 0.065432003 0.130864006 0.000000000
py 1 0.065442149 0.065442149 0.130884299 0.000000000
pz 1 0.040381942 0.040381942 0.080763885 0.000000000
sum over m 0.171256095 0.171256095 0.342512189 0.000000000
sum over m+mul 3.190211704 3.190211704 6.380423408 0.000000000
d3z^2-r^2 0 0.196307095 0.196307095 0.392614189 0.000000000
dx^2-y^2 0 0.201519175 0.201519175 0.403038350 0.000000000
dxy 0 0.250925910 0.250925910 0.501851820 0.000000000
dxz 0 0.268516582 0.268516582 0.537033165 0.000000000
dyz 0 0.268500223 0.268500223 0.537000446 0.000000000
sum over m 1.185768985 1.185768985 2.371537971 0.000000000
d3z^2-r^2 1 0.003480294 0.003480294 0.006960588 0.000000000
dx^2-y^2 1 -0.004472707 -0.004472707 -0.008945415 0.000000000
dxy 1 0.015341260 0.015341260 0.030682519 0.000000000
dxz 1 0.003494934 0.003494934 0.006989868 0.000000000
dyz 1 0.003493777 0.003493777 0.006987555 0.000000000
sum over m 0.021337558 0.021337558 0.042675116 0.000000000
sum over m+mul 1.207106543 1.207106543 2.414213087 0.000000000
752 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742726 1.000742726 2.001485451 0.000000000
sum over m 1.000742726 1.000742726 2.001485451 0.000000000
s 1 0.207416785 0.207416785 0.414833569 0.000000000
sum over m 0.207416785 0.207416785 0.414833569 0.000000000
s 2 0.014727186 0.014727186 0.029454373 0.000000000
sum over m 0.014727186 0.014727186 0.029454373 0.000000000
sum over m+mul 1.222886697 1.222886697 2.445773393 0.000000000
px 0 1.006376184 1.006376184 2.012752367 0.000000000
py 0 1.006382080 1.006382080 2.012764160 0.000000000
pz 0 1.006198775 1.006198775 2.012397550 0.000000000
sum over m 3.018957039 3.018957039 6.037914078 0.000000000
px 1 0.065418224 0.065418224 0.130836448 0.000000000
py 1 0.065428977 0.065428977 0.130857954 0.000000000
pz 1 0.040408116 0.040408116 0.080816232 0.000000000
sum over m 0.171255317 0.171255317 0.342510634 0.000000000
sum over m+mul 3.190212356 3.190212356 6.380424712 0.000000000
d3z^2-r^2 0 0.196303172 0.196303172 0.392606345 0.000000000
dx^2-y^2 0 0.201527816 0.201527816 0.403055631 0.000000000
dxy 0 0.250905702 0.250905702 0.501811404 0.000000000
dxz 0 0.268520733 0.268520733 0.537041465 0.000000000
dyz 0 0.268515396 0.268515396 0.537030791 0.000000000
sum over m 1.185772818 1.185772818 2.371545637 0.000000000
d3z^2-r^2 1 0.003482203 0.003482203 0.006964407 0.000000000
dx^2-y^2 1 -0.004468465 -0.004468465 -0.008936930 0.000000000
dxy 1 0.015338826 0.015338826 0.030677652 0.000000000
dxz 1 0.003494083 0.003494083 0.006988166 0.000000000
dyz 1 0.003495915 0.003495915 0.006991831 0.000000000
sum over m 0.021342563 0.021342563 0.042685126 0.000000000
sum over m+mul 1.207115381 1.207115381 2.414230763 0.000000000
753 O Up spin Down spin Sum Diff
multiple
s 0 0.893872050 0.893872050 1.787744100 0.000000000
sum over m 0.893872050 0.893872050 1.787744100 0.000000000
s 1 -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m -0.003042294 -0.003042294 -0.006084587 0.000000000
sum over m+mul 0.890829757 0.890829757 1.781659513 0.000000000
px 0 0.787000793 0.787000793 1.574001587 0.000000000
py 0 0.786838334 0.786838334 1.573676667 0.000000000
pz 0 0.779837016 0.779837016 1.559674032 0.000000000
sum over m 2.353676143 2.353676143 4.707352286 0.000000000
px 1 -0.008738859 -0.008738859 -0.017477718 0.000000000
py 1 -0.008735882 -0.008735882 -0.017471764 0.000000000
pz 1 -0.006464962 -0.006464962 -0.012929924 0.000000000
sum over m -0.023939703 -0.023939703 -0.047879406 0.000000000
sum over m+mul 2.329736440 2.329736440 4.659472880 0.000000000
d3z^2-r^2 0 -0.006389678 -0.006389678 -0.012779356 0.000000000
dx^2-y^2 0 -0.005060152 -0.005060152 -0.010120305 0.000000000
dxy 0 -0.005433238 -0.005433238 -0.010866475 0.000000000
dxz 0 -0.006932198 -0.006932198 -0.013864396 0.000000000
dyz 0 -0.006934550 -0.006934550 -0.013869101 0.000000000
sum over m -0.030749817 -0.030749817 -0.061499633 0.000000000
sum over m+mul -0.030749817 -0.030749817 -0.061499633 0.000000000
754 O Up spin Down spin Sum Diff
multiple
s 0 0.893902719 0.893902719 1.787805439 0.000000000
sum over m 0.893902719 0.893902719 1.787805439 0.000000000
s 1 -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m -0.003042325 -0.003042325 -0.006084650 0.000000000
sum over m+mul 0.890860394 0.890860394 1.781720789 0.000000000
px 0 0.786877452 0.786877452 1.573754904 0.000000000
py 0 0.787071019 0.787071019 1.574142038 0.000000000
pz 0 0.779782974 0.779782974 1.559565948 0.000000000
sum over m 2.353731445 2.353731445 4.707462890 0.000000000
px 1 -0.008738305 -0.008738305 -0.017476611 0.000000000
py 1 -0.008744038 -0.008744038 -0.017488076 0.000000000
pz 1 -0.006462860 -0.006462860 -0.012925721 0.000000000
sum over m -0.023945204 -0.023945204 -0.047890408 0.000000000
sum over m+mul 2.329786241 2.329786241 4.659572482 0.000000000
d3z^2-r^2 0 -0.006390819 -0.006390819 -0.012781637 0.000000000
dx^2-y^2 0 -0.005058326 -0.005058326 -0.010116652 0.000000000
dxy 0 -0.005435279 -0.005435279 -0.010870557 0.000000000
dxz 0 -0.006933211 -0.006933211 -0.013866423 0.000000000
dyz 0 -0.006928893 -0.006928893 -0.013857785 0.000000000
sum over m -0.030746527 -0.030746527 -0.061493055 0.000000000
sum over m+mul -0.030746527 -0.030746527 -0.061493055 0.000000000
755 O Up spin Down spin Sum Diff
multiple
s 0 0.893912541 0.893912541 1.787825082 0.000000000
sum over m 0.893912541 0.893912541 1.787825082 0.000000000
s 1 -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m+mul 0.890869972 0.890869972 1.781739944 0.000000000
px 0 0.787021575 0.787021575 1.574043151 0.000000000
py 0 0.787071176 0.787071176 1.574142353 0.000000000
pz 0 0.779696459 0.779696459 1.559392918 0.000000000
sum over m 2.353789211 2.353789211 4.707578421 0.000000000
px 1 -0.008734448 -0.008734448 -0.017468896 0.000000000
py 1 -0.008735385 -0.008735385 -0.017470771 0.000000000
pz 1 -0.006455985 -0.006455985 -0.012911970 0.000000000
sum over m -0.023925819 -0.023925819 -0.047851637 0.000000000
sum over m+mul 2.329863392 2.329863392 4.659726784 0.000000000
d3z^2-r^2 0 -0.006390385 -0.006390385 -0.012780770 0.000000000
dx^2-y^2 0 -0.005053856 -0.005053856 -0.010107711 0.000000000
dxy 0 -0.005436296 -0.005436296 -0.010872593 0.000000000
dxz 0 -0.006927057 -0.006927057 -0.013854114 0.000000000
dyz 0 -0.006924533 -0.006924533 -0.013849065 0.000000000
sum over m -0.030732127 -0.030732127 -0.061464253 0.000000000
sum over m+mul -0.030732127 -0.030732127 -0.061464253 0.000000000
756 O Up spin Down spin Sum Diff
multiple
s 0 0.893885965 0.893885965 1.787771929 0.000000000
sum over m 0.893885965 0.893885965 1.787771929 0.000000000
s 1 -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m -0.003042484 -0.003042484 -0.006084967 0.000000000
sum over m+mul 0.890843481 0.890843481 1.781686962 0.000000000
px 0 0.786986432 0.786986432 1.573972864 0.000000000
py 0 0.786888859 0.786888859 1.573777718 0.000000000
pz 0 0.779817968 0.779817968 1.559635936 0.000000000
sum over m 2.353693259 2.353693259 4.707386519 0.000000000
px 1 -0.008740182 -0.008740182 -0.017480364 0.000000000
py 1 -0.008737547 -0.008737547 -0.017475095 0.000000000
pz 1 -0.006464629 -0.006464629 -0.012929258 0.000000000
sum over m -0.023942358 -0.023942358 -0.047884717 0.000000000
sum over m+mul 2.329750901 2.329750901 4.659501802 0.000000000
d3z^2-r^2 0 -0.006390490 -0.006390490 -0.012780980 0.000000000
dx^2-y^2 0 -0.005059495 -0.005059495 -0.010118990 0.000000000
dxy 0 -0.005434167 -0.005434167 -0.010868334 0.000000000
dxz 0 -0.006932257 -0.006932257 -0.013864513 0.000000000
dyz 0 -0.006933943 -0.006933943 -0.013867886 0.000000000
sum over m -0.030750352 -0.030750352 -0.061500704 0.000000000
sum over m+mul -0.030750352 -0.030750352 -0.061500704 0.000000000
757 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000725403 1.000725403 2.001450807 0.000000000
sum over m 1.000725403 1.000725403 2.001450807 0.000000000
s 1 0.207430367 0.207430367 0.414860734 0.000000000
sum over m 0.207430367 0.207430367 0.414860734 0.000000000
s 2 0.014727697 0.014727697 0.029455394 0.000000000
sum over m 0.014727697 0.014727697 0.029455394 0.000000000
sum over m+mul 1.222883468 1.222883468 2.445766935 0.000000000
px 0 1.006393439 1.006393439 2.012786877 0.000000000
py 0 1.006393439 1.006393439 2.012786878 0.000000000
pz 0 1.006195798 1.006195798 2.012391597 0.000000000
sum over m 3.018982676 3.018982676 6.037965352 0.000000000
px 1 0.065412010 0.065412010 0.130824020 0.000000000
py 1 0.065412010 0.065412010 0.130824020 0.000000000
pz 1 0.040415874 0.040415874 0.080831747 0.000000000
sum over m 0.171239894 0.171239894 0.342479788 0.000000000
sum over m+mul 3.190222570 3.190222570 6.380445140 0.000000000
d3z^2-r^2 0 0.196297248 0.196297248 0.392594496 0.000000000
dx^2-y^2 0 0.201531019 0.201531019 0.403062039 0.000000000
dxy 0 0.250894199 0.250894199 0.501788398 0.000000000
dxz 0 0.268524245 0.268524245 0.537048490 0.000000000
dyz 0 0.268524245 0.268524245 0.537048491 0.000000000
sum over m 1.185770957 1.185770957 2.371541914 0.000000000
d3z^2-r^2 1 0.003483096 0.003483096 0.006966192 0.000000000
dx^2-y^2 1 -0.004465302 -0.004465302 -0.008930604 0.000000000
dxy 1 0.015339114 0.015339114 0.030678227 0.000000000
dxz 1 0.003495795 0.003495795 0.006991589 0.000000000
dyz 1 0.003495795 0.003495795 0.006991589 0.000000000
sum over m 0.021348497 0.021348497 0.042696994 0.000000000
sum over m+mul 1.207119454 1.207119454 2.414238908 0.000000000
758 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000725028 1.000725028 2.001450056 0.000000000
sum over m 1.000725028 1.000725028 2.001450056 0.000000000
s 1 0.207427994 0.207427994 0.414855988 0.000000000
sum over m 0.207427994 0.207427994 0.414855988 0.000000000
s 2 0.014726834 0.014726834 0.029453668 0.000000000
sum over m 0.014726834 0.014726834 0.029453668 0.000000000
sum over m+mul 1.222879856 1.222879856 2.445759712 0.000000000
px 0 1.006395557 1.006395557 2.012791113 0.000000000
py 0 1.006395557 1.006395557 2.012791113 0.000000000
pz 0 1.006197002 1.006197002 2.012394003 0.000000000
sum over m 3.018988115 3.018988115 6.037976230 0.000000000
px 1 0.065405251 0.065405251 0.130810502 0.000000000
py 1 0.065405251 0.065405251 0.130810502 0.000000000
pz 1 0.040420965 0.040420965 0.080841930 0.000000000
sum over m 0.171231467 0.171231467 0.342462934 0.000000000
sum over m+mul 3.190219582 3.190219582 6.380439164 0.000000000
d3z^2-r^2 0 0.196294299 0.196294299 0.392588597 0.000000000
dx^2-y^2 0 0.201531222 0.201531222 0.403062443 0.000000000
dxy 0 0.250892165 0.250892165 0.501784330 0.000000000
dxz 0 0.268525633 0.268525633 0.537051266 0.000000000
dyz 0 0.268525633 0.268525633 0.537051266 0.000000000
sum over m 1.185768951 1.185768951 2.371537902 0.000000000
d3z^2-r^2 1 0.003482159 0.003482159 0.006964318 0.000000000
dx^2-y^2 1 -0.004466487 -0.004466487 -0.008932973 0.000000000
dxy 1 0.015337208 0.015337208 0.030674416 0.000000000
dxz 1 0.003493760 0.003493760 0.006987520 0.000000000
dyz 1 0.003493760 0.003493760 0.006987520 0.000000000
sum over m 0.021340400 0.021340400 0.042680800 0.000000000
sum over m+mul 1.207109351 1.207109351 2.414218702 0.000000000
759 O Up spin Down spin Sum Diff
multiple
s 0 0.893899660 0.893899660 1.787799321 0.000000000
sum over m 0.893899660 0.893899660 1.787799321 0.000000000
s 1 -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m+mul 0.890857091 0.890857091 1.781714183 0.000000000
px 0 0.786968798 0.786968798 1.573937595 0.000000000
py 0 0.786968798 0.786968798 1.573937595 0.000000000
pz 0 0.779782868 0.779782868 1.559565735 0.000000000
sum over m 2.353720463 2.353720463 4.707440926 0.000000000
px 1 -0.008740920 -0.008740920 -0.017481841 0.000000000
py 1 -0.008740920 -0.008740920 -0.017481841 0.000000000
pz 1 -0.006464178 -0.006464178 -0.012928355 0.000000000
sum over m -0.023946018 -0.023946018 -0.047892037 0.000000000
sum over m+mul 2.329774444 2.329774444 4.659548889 0.000000000
d3z^2-r^2 0 -0.006390869 -0.006390869 -0.012781739 0.000000000
dx^2-y^2 0 -0.005058116 -0.005058116 -0.010116232 0.000000000
dxy 0 -0.005434961 -0.005434961 -0.010869922 0.000000000
dxz 0 -0.006931544 -0.006931544 -0.013863088 0.000000000
dyz 0 -0.006931544 -0.006931544 -0.013863088 0.000000000
sum over m -0.030747034 -0.030747034 -0.061494068 0.000000000
sum over m+mul -0.030747034 -0.030747034 -0.061494068 0.000000000
760 O Up spin Down spin Sum Diff
multiple
s 0 0.893865736 0.893865736 1.787731473 0.000000000
sum over m 0.893865736 0.893865736 1.787731473 0.000000000
s 1 -0.003042200 -0.003042200 -0.006084399 0.000000000
sum over m -0.003042200 -0.003042200 -0.006084399 0.000000000
sum over m+mul 0.890823537 0.890823537 1.781647073 0.000000000
px 0 0.786905133 0.786905133 1.573810266 0.000000000
py 0 0.786905133 0.786905133 1.573810266 0.000000000
pz 0 0.779849876 0.779849876 1.559699753 0.000000000
sum over m 2.353660143 2.353660143 4.707320286 0.000000000
px 1 -0.008736932 -0.008736932 -0.017473864 0.000000000
py 1 -0.008736932 -0.008736932 -0.017473864 0.000000000
pz 1 -0.006465368 -0.006465368 -0.012930735 0.000000000
sum over m -0.023939231 -0.023939231 -0.047878462 0.000000000
sum over m+mul 2.329720912 2.329720912 4.659441823 0.000000000
d3z^2-r^2 0 -0.006389788 -0.006389788 -0.012779577 0.000000000
dx^2-y^2 0 -0.005060645 -0.005060645 -0.010121291 0.000000000
dxy 0 -0.005432715 -0.005432715 -0.010865429 0.000000000
dxz 0 -0.006934464 -0.006934464 -0.013868928 0.000000000
dyz 0 -0.006934464 -0.006934464 -0.013868928 0.000000000
sum over m -0.030752076 -0.030752076 -0.061504153 0.000000000
sum over m+mul -0.030752076 -0.030752076 -0.061504153 0.000000000
761 O Up spin Down spin Sum Diff
multiple
s 0 0.893909989 0.893909989 1.787819978 0.000000000
sum over m 0.893909989 0.893909989 1.787819978 0.000000000
s 1 -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m+mul 0.890867147 0.890867147 1.781734295 0.000000000
px 0 0.787049515 0.787049515 1.574099030 0.000000000
py 0 0.786958550 0.786958550 1.573917101 0.000000000
pz 0 0.779748985 0.779748985 1.559497971 0.000000000
sum over m 2.353757050 2.353757050 4.707514101 0.000000000
px 1 -0.008743259 -0.008743259 -0.017486519 0.000000000
py 1 -0.008740300 -0.008740300 -0.017480601 0.000000000
pz 1 -0.006461435 -0.006461435 -0.012922870 0.000000000
sum over m -0.023944995 -0.023944995 -0.047889990 0.000000000
sum over m+mul 2.329812056 2.329812056 4.659624111 0.000000000
d3z^2-r^2 0 -0.006390859 -0.006390859 -0.012781718 0.000000000
dx^2-y^2 0 -0.005056833 -0.005056833 -0.010113665 0.000000000
dxy 0 -0.005435510 -0.005435510 -0.010871019 0.000000000
dxz 0 -0.006928479 -0.006928479 -0.013856957 0.000000000
dyz 0 -0.006931103 -0.006931103 -0.013862207 0.000000000
sum over m -0.030742783 -0.030742783 -0.061485567 0.000000000
sum over m+mul -0.030742783 -0.030742783 -0.061485567 0.000000000
762 O Up spin Down spin Sum Diff
multiple
s 0 0.893909989 0.893909989 1.787819978 0.000000000
sum over m 0.893909989 0.893909989 1.787819978 0.000000000
s 1 -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m+mul 0.890867147 0.890867147 1.781734295 0.000000000
px 0 0.786958550 0.786958550 1.573917101 0.000000000
py 0 0.787049515 0.787049515 1.574099029 0.000000000
pz 0 0.779748985 0.779748985 1.559497970 0.000000000
sum over m 2.353757050 2.353757050 4.707514100 0.000000000
px 1 -0.008740300 -0.008740300 -0.017480600 0.000000000
py 1 -0.008743259 -0.008743259 -0.017486519 0.000000000
pz 1 -0.006461435 -0.006461435 -0.012922870 0.000000000
sum over m -0.023944995 -0.023944995 -0.047889990 0.000000000
sum over m+mul 2.329812055 2.329812055 4.659624111 0.000000000
d3z^2-r^2 0 -0.006390859 -0.006390859 -0.012781718 0.000000000
dx^2-y^2 0 -0.005056833 -0.005056833 -0.010113665 0.000000000
dxy 0 -0.005435510 -0.005435510 -0.010871019 0.000000000
dxz 0 -0.006931103 -0.006931103 -0.013862207 0.000000000
dyz 0 -0.006928479 -0.006928479 -0.013856957 0.000000000
sum over m -0.030742783 -0.030742783 -0.061485566 0.000000000
sum over m+mul -0.030742783 -0.030742783 -0.061485566 0.000000000
763 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000725403 1.000725403 2.001450807 0.000000000
sum over m 1.000725403 1.000725403 2.001450807 0.000000000
s 1 0.207430367 0.207430367 0.414860734 0.000000000
sum over m 0.207430367 0.207430367 0.414860734 0.000000000
s 2 0.014727697 0.014727697 0.029455394 0.000000000
sum over m 0.014727697 0.014727697 0.029455394 0.000000000
sum over m+mul 1.222883468 1.222883468 2.445766935 0.000000000
px 0 1.006393439 1.006393439 2.012786878 0.000000000
py 0 1.006393439 1.006393439 2.012786877 0.000000000
pz 0 1.006195798 1.006195798 2.012391597 0.000000000
sum over m 3.018982676 3.018982676 6.037965352 0.000000000
px 1 0.065412010 0.065412010 0.130824020 0.000000000
py 1 0.065412010 0.065412010 0.130824020 0.000000000
pz 1 0.040415874 0.040415874 0.080831748 0.000000000
sum over m 0.171239894 0.171239894 0.342479788 0.000000000
sum over m+mul 3.190222570 3.190222570 6.380445140 0.000000000
d3z^2-r^2 0 0.196297248 0.196297248 0.392594497 0.000000000
dx^2-y^2 0 0.201531020 0.201531020 0.403062039 0.000000000
dxy 0 0.250894199 0.250894199 0.501788398 0.000000000
dxz 0 0.268524245 0.268524245 0.537048491 0.000000000
dyz 0 0.268524245 0.268524245 0.537048490 0.000000000
sum over m 1.185770957 1.185770957 2.371541915 0.000000000
d3z^2-r^2 1 0.003483096 0.003483096 0.006966192 0.000000000
dx^2-y^2 1 -0.004465302 -0.004465302 -0.008930604 0.000000000
dxy 1 0.015339114 0.015339114 0.030678227 0.000000000
dxz 1 0.003495795 0.003495795 0.006991589 0.000000000
dyz 1 0.003495795 0.003495795 0.006991589 0.000000000
sum over m 0.021348497 0.021348497 0.042696994 0.000000000
sum over m+mul 1.207119454 1.207119454 2.414238909 0.000000000
764 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000725028 1.000725028 2.001450056 0.000000000
sum over m 1.000725028 1.000725028 2.001450056 0.000000000
s 1 0.207427994 0.207427994 0.414855988 0.000000000
sum over m 0.207427994 0.207427994 0.414855988 0.000000000
s 2 0.014726834 0.014726834 0.029453668 0.000000000
sum over m 0.014726834 0.014726834 0.029453668 0.000000000
sum over m+mul 1.222879856 1.222879856 2.445759712 0.000000000
px 0 1.006395557 1.006395557 2.012791113 0.000000000
py 0 1.006395557 1.006395557 2.012791113 0.000000000
pz 0 1.006197002 1.006197002 2.012394003 0.000000000
sum over m 3.018988115 3.018988115 6.037976230 0.000000000
px 1 0.065405251 0.065405251 0.130810502 0.000000000
py 1 0.065405251 0.065405251 0.130810502 0.000000000
pz 1 0.040420965 0.040420965 0.080841930 0.000000000
sum over m 0.171231467 0.171231467 0.342462934 0.000000000
sum over m+mul 3.190219582 3.190219582 6.380439164 0.000000000
d3z^2-r^2 0 0.196294299 0.196294299 0.392588598 0.000000000
dx^2-y^2 0 0.201531222 0.201531222 0.403062443 0.000000000
dxy 0 0.250892165 0.250892165 0.501784329 0.000000000
dxz 0 0.268525633 0.268525633 0.537051265 0.000000000
dyz 0 0.268525633 0.268525633 0.537051266 0.000000000
sum over m 1.185768951 1.185768951 2.371537902 0.000000000
d3z^2-r^2 1 0.003482159 0.003482159 0.006964318 0.000000000
dx^2-y^2 1 -0.004466487 -0.004466487 -0.008932973 0.000000000
dxy 1 0.015337208 0.015337208 0.030674416 0.000000000
dxz 1 0.003493760 0.003493760 0.006987520 0.000000000
dyz 1 0.003493760 0.003493760 0.006987520 0.000000000
sum over m 0.021340400 0.021340400 0.042680800 0.000000000
sum over m+mul 1.207109351 1.207109351 2.414218702 0.000000000
765 O Up spin Down spin Sum Diff
multiple
s 0 0.893899660 0.893899660 1.787799321 0.000000000
sum over m 0.893899660 0.893899660 1.787799321 0.000000000
s 1 -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m+mul 0.890857091 0.890857091 1.781714183 0.000000000
px 0 0.786968798 0.786968798 1.573937595 0.000000000
py 0 0.786968798 0.786968798 1.573937596 0.000000000
pz 0 0.779782868 0.779782868 1.559565735 0.000000000
sum over m 2.353720463 2.353720463 4.707440926 0.000000000
px 1 -0.008740920 -0.008740920 -0.017481841 0.000000000
py 1 -0.008740920 -0.008740920 -0.017481841 0.000000000
pz 1 -0.006464178 -0.006464178 -0.012928355 0.000000000
sum over m -0.023946018 -0.023946018 -0.047892037 0.000000000
sum over m+mul 2.329774445 2.329774445 4.659548889 0.000000000
d3z^2-r^2 0 -0.006390869 -0.006390869 -0.012781739 0.000000000
dx^2-y^2 0 -0.005058116 -0.005058116 -0.010116232 0.000000000
dxy 0 -0.005434961 -0.005434961 -0.010869922 0.000000000
dxz 0 -0.006931544 -0.006931544 -0.013863088 0.000000000
dyz 0 -0.006931544 -0.006931544 -0.013863088 0.000000000
sum over m -0.030747034 -0.030747034 -0.061494068 0.000000000
sum over m+mul -0.030747034 -0.030747034 -0.061494068 0.000000000
766 O Up spin Down spin Sum Diff
multiple
s 0 0.893865736 0.893865736 1.787731473 0.000000000
sum over m 0.893865736 0.893865736 1.787731473 0.000000000
s 1 -0.003042200 -0.003042200 -0.006084399 0.000000000
sum over m -0.003042200 -0.003042200 -0.006084399 0.000000000
sum over m+mul 0.890823537 0.890823537 1.781647073 0.000000000
px 0 0.786905133 0.786905133 1.573810266 0.000000000
py 0 0.786905133 0.786905133 1.573810266 0.000000000
pz 0 0.779849876 0.779849876 1.559699753 0.000000000
sum over m 2.353660143 2.353660143 4.707320285 0.000000000
px 1 -0.008736932 -0.008736932 -0.017473863 0.000000000
py 1 -0.008736932 -0.008736932 -0.017473864 0.000000000
pz 1 -0.006465368 -0.006465368 -0.012930735 0.000000000
sum over m -0.023939231 -0.023939231 -0.047878462 0.000000000
sum over m+mul 2.329720911 2.329720911 4.659441823 0.000000000
d3z^2-r^2 0 -0.006389788 -0.006389788 -0.012779577 0.000000000
dx^2-y^2 0 -0.005060645 -0.005060645 -0.010121291 0.000000000
dxy 0 -0.005432715 -0.005432715 -0.010865429 0.000000000
dxz 0 -0.006934464 -0.006934464 -0.013868928 0.000000000
dyz 0 -0.006934464 -0.006934464 -0.013868928 0.000000000
sum over m -0.030752076 -0.030752076 -0.061504153 0.000000000
sum over m+mul -0.030752076 -0.030752076 -0.061504153 0.000000000
767 O Up spin Down spin Sum Diff
multiple
s 0 0.893909989 0.893909989 1.787819978 0.000000000
sum over m 0.893909989 0.893909989 1.787819978 0.000000000
s 1 -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m+mul 0.890867147 0.890867147 1.781734295 0.000000000
px 0 0.787049515 0.787049515 1.574099029 0.000000000
py 0 0.786958550 0.786958550 1.573917101 0.000000000
pz 0 0.779748985 0.779748985 1.559497970 0.000000000
sum over m 2.353757050 2.353757050 4.707514100 0.000000000
px 1 -0.008743259 -0.008743259 -0.017486519 0.000000000
py 1 -0.008740300 -0.008740300 -0.017480601 0.000000000
pz 1 -0.006461435 -0.006461435 -0.012922870 0.000000000
sum over m -0.023944995 -0.023944995 -0.047889989 0.000000000
sum over m+mul 2.329812055 2.329812055 4.659624111 0.000000000
d3z^2-r^2 0 -0.006390859 -0.006390859 -0.012781718 0.000000000
dx^2-y^2 0 -0.005056833 -0.005056833 -0.010113665 0.000000000
dxy 0 -0.005435510 -0.005435510 -0.010871019 0.000000000
dxz 0 -0.006928479 -0.006928479 -0.013856957 0.000000000
dyz 0 -0.006931103 -0.006931103 -0.013862207 0.000000000
sum over m -0.030742783 -0.030742783 -0.061485567 0.000000000
sum over m+mul -0.030742783 -0.030742783 -0.061485567 0.000000000
768 O Up spin Down spin Sum Diff
multiple
s 0 0.893909989 0.893909989 1.787819978 0.000000000
sum over m 0.893909989 0.893909989 1.787819978 0.000000000
s 1 -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m+mul 0.890867147 0.890867147 1.781734295 0.000000000
px 0 0.786958550 0.786958550 1.573917101 0.000000000
py 0 0.787049515 0.787049515 1.574099030 0.000000000
pz 0 0.779748985 0.779748985 1.559497970 0.000000000
sum over m 2.353757050 2.353757050 4.707514101 0.000000000
px 1 -0.008740300 -0.008740300 -0.017480600 0.000000000
py 1 -0.008743259 -0.008743259 -0.017486519 0.000000000
pz 1 -0.006461435 -0.006461435 -0.012922870 0.000000000
sum over m -0.023944995 -0.023944995 -0.047889989 0.000000000
sum over m+mul 2.329812056 2.329812056 4.659624112 0.000000000
d3z^2-r^2 0 -0.006390859 -0.006390859 -0.012781718 0.000000000
dx^2-y^2 0 -0.005056833 -0.005056833 -0.010113665 0.000000000
dxy 0 -0.005435510 -0.005435510 -0.010871019 0.000000000
dxz 0 -0.006931103 -0.006931103 -0.013862207 0.000000000
dyz 0 -0.006928479 -0.006928479 -0.013856957 0.000000000
sum over m -0.030742783 -0.030742783 -0.061485567 0.000000000
sum over m+mul -0.030742783 -0.030742783 -0.061485567 0.000000000
769 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000725403 1.000725403 2.001450807 0.000000000
sum over m 1.000725403 1.000725403 2.001450807 0.000000000
s 1 0.207430367 0.207430367 0.414860734 0.000000000
sum over m 0.207430367 0.207430367 0.414860734 0.000000000
s 2 0.014727697 0.014727697 0.029455394 0.000000000
sum over m 0.014727697 0.014727697 0.029455394 0.000000000
sum over m+mul 1.222883468 1.222883468 2.445766935 0.000000000
px 0 1.006393439 1.006393439 2.012786877 0.000000000
py 0 1.006393439 1.006393439 2.012786877 0.000000000
pz 0 1.006195798 1.006195798 2.012391597 0.000000000
sum over m 3.018982676 3.018982676 6.037965352 0.000000000
px 1 0.065412010 0.065412010 0.130824020 0.000000000
py 1 0.065412010 0.065412010 0.130824020 0.000000000
pz 1 0.040415874 0.040415874 0.080831748 0.000000000
sum over m 0.171239894 0.171239894 0.342479788 0.000000000
sum over m+mul 3.190222570 3.190222570 6.380445140 0.000000000
d3z^2-r^2 0 0.196297248 0.196297248 0.392594497 0.000000000
dx^2-y^2 0 0.201531020 0.201531020 0.403062039 0.000000000
dxy 0 0.250894199 0.250894199 0.501788398 0.000000000
dxz 0 0.268524245 0.268524245 0.537048490 0.000000000
dyz 0 0.268524245 0.268524245 0.537048490 0.000000000
sum over m 1.185770957 1.185770957 2.371541915 0.000000000
d3z^2-r^2 1 0.003483096 0.003483096 0.006966192 0.000000000
dx^2-y^2 1 -0.004465302 -0.004465302 -0.008930604 0.000000000
dxy 1 0.015339114 0.015339114 0.030678227 0.000000000
dxz 1 0.003495795 0.003495795 0.006991589 0.000000000
dyz 1 0.003495795 0.003495795 0.006991589 0.000000000
sum over m 0.021348497 0.021348497 0.042696994 0.000000000
sum over m+mul 1.207119454 1.207119454 2.414238908 0.000000000
770 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000725028 1.000725028 2.001450057 0.000000000
sum over m 1.000725028 1.000725028 2.001450057 0.000000000
s 1 0.207427994 0.207427994 0.414855988 0.000000000
sum over m 0.207427994 0.207427994 0.414855988 0.000000000
s 2 0.014726834 0.014726834 0.029453668 0.000000000
sum over m 0.014726834 0.014726834 0.029453668 0.000000000
sum over m+mul 1.222879856 1.222879856 2.445759712 0.000000000
px 0 1.006395557 1.006395557 2.012791113 0.000000000
py 0 1.006395557 1.006395557 2.012791113 0.000000000
pz 0 1.006197002 1.006197002 2.012394003 0.000000000
sum over m 3.018988115 3.018988115 6.037976230 0.000000000
px 1 0.065405251 0.065405251 0.130810502 0.000000000
py 1 0.065405251 0.065405251 0.130810502 0.000000000
pz 1 0.040420965 0.040420965 0.080841930 0.000000000
sum over m 0.171231467 0.171231467 0.342462933 0.000000000
sum over m+mul 3.190219582 3.190219582 6.380439163 0.000000000
d3z^2-r^2 0 0.196294299 0.196294299 0.392588597 0.000000000
dx^2-y^2 0 0.201531222 0.201531222 0.403062443 0.000000000
dxy 0 0.250892165 0.250892165 0.501784330 0.000000000
dxz 0 0.268525633 0.268525633 0.537051266 0.000000000
dyz 0 0.268525633 0.268525633 0.537051266 0.000000000
sum over m 1.185768951 1.185768951 2.371537902 0.000000000
d3z^2-r^2 1 0.003482159 0.003482159 0.006964318 0.000000000
dx^2-y^2 1 -0.004466487 -0.004466487 -0.008932973 0.000000000
dxy 1 0.015337208 0.015337208 0.030674416 0.000000000
dxz 1 0.003493760 0.003493760 0.006987520 0.000000000
dyz 1 0.003493760 0.003493760 0.006987520 0.000000000
sum over m 0.021340400 0.021340400 0.042680800 0.000000000
sum over m+mul 1.207109351 1.207109351 2.414218702 0.000000000
771 O Up spin Down spin Sum Diff
multiple
s 0 0.893899660 0.893899660 1.787799321 0.000000000
sum over m 0.893899660 0.893899660 1.787799321 0.000000000
s 1 -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m+mul 0.890857091 0.890857091 1.781714183 0.000000000
px 0 0.786968798 0.786968798 1.573937595 0.000000000
py 0 0.786968798 0.786968798 1.573937595 0.000000000
pz 0 0.779782868 0.779782868 1.559565736 0.000000000
sum over m 2.353720463 2.353720463 4.707440926 0.000000000
px 1 -0.008740920 -0.008740920 -0.017481841 0.000000000
py 1 -0.008740920 -0.008740920 -0.017481841 0.000000000
pz 1 -0.006464178 -0.006464178 -0.012928355 0.000000000
sum over m -0.023946018 -0.023946018 -0.047892037 0.000000000
sum over m+mul 2.329774445 2.329774445 4.659548890 0.000000000
d3z^2-r^2 0 -0.006390869 -0.006390869 -0.012781739 0.000000000
dx^2-y^2 0 -0.005058116 -0.005058116 -0.010116232 0.000000000
dxy 0 -0.005434961 -0.005434961 -0.010869922 0.000000000
dxz 0 -0.006931544 -0.006931544 -0.013863088 0.000000000
dyz 0 -0.006931544 -0.006931544 -0.013863088 0.000000000
sum over m -0.030747034 -0.030747034 -0.061494068 0.000000000
sum over m+mul -0.030747034 -0.030747034 -0.061494068 0.000000000
772 O Up spin Down spin Sum Diff
multiple
s 0 0.893865736 0.893865736 1.787731473 0.000000000
sum over m 0.893865736 0.893865736 1.787731473 0.000000000
s 1 -0.003042200 -0.003042200 -0.006084399 0.000000000
sum over m -0.003042200 -0.003042200 -0.006084399 0.000000000
sum over m+mul 0.890823537 0.890823537 1.781647074 0.000000000
px 0 0.786905133 0.786905133 1.573810266 0.000000000
py 0 0.786905133 0.786905133 1.573810266 0.000000000
pz 0 0.779849877 0.779849877 1.559699753 0.000000000
sum over m 2.353660143 2.353660143 4.707320286 0.000000000
px 1 -0.008736932 -0.008736932 -0.017473864 0.000000000
py 1 -0.008736932 -0.008736932 -0.017473864 0.000000000
pz 1 -0.006465368 -0.006465368 -0.012930735 0.000000000
sum over m -0.023939231 -0.023939231 -0.047878462 0.000000000
sum over m+mul 2.329720912 2.329720912 4.659441823 0.000000000
d3z^2-r^2 0 -0.006389788 -0.006389788 -0.012779577 0.000000000
dx^2-y^2 0 -0.005060645 -0.005060645 -0.010121291 0.000000000
dxy 0 -0.005432715 -0.005432715 -0.010865429 0.000000000
dxz 0 -0.006934464 -0.006934464 -0.013868928 0.000000000
dyz 0 -0.006934464 -0.006934464 -0.013868928 0.000000000
sum over m -0.030752076 -0.030752076 -0.061504153 0.000000000
sum over m+mul -0.030752076 -0.030752076 -0.061504153 0.000000000
773 O Up spin Down spin Sum Diff
multiple
s 0 0.893909989 0.893909989 1.787819978 0.000000000
sum over m 0.893909989 0.893909989 1.787819978 0.000000000
s 1 -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m+mul 0.890867147 0.890867147 1.781734295 0.000000000
px 0 0.787049515 0.787049515 1.574099029 0.000000000
py 0 0.786958550 0.786958550 1.573917101 0.000000000
pz 0 0.779748985 0.779748985 1.559497970 0.000000000
sum over m 2.353757050 2.353757050 4.707514100 0.000000000
px 1 -0.008743259 -0.008743259 -0.017486519 0.000000000
py 1 -0.008740300 -0.008740300 -0.017480601 0.000000000
pz 1 -0.006461435 -0.006461435 -0.012922870 0.000000000
sum over m -0.023944995 -0.023944995 -0.047889989 0.000000000
sum over m+mul 2.329812055 2.329812055 4.659624111 0.000000000
d3z^2-r^2 0 -0.006390859 -0.006390859 -0.012781718 0.000000000
dx^2-y^2 0 -0.005056833 -0.005056833 -0.010113665 0.000000000
dxy 0 -0.005435510 -0.005435510 -0.010871019 0.000000000
dxz 0 -0.006928479 -0.006928479 -0.013856957 0.000000000
dyz 0 -0.006931103 -0.006931103 -0.013862207 0.000000000
sum over m -0.030742783 -0.030742783 -0.061485567 0.000000000
sum over m+mul -0.030742783 -0.030742783 -0.061485567 0.000000000
774 O Up spin Down spin Sum Diff
multiple
s 0 0.893909989 0.893909989 1.787819978 0.000000000
sum over m 0.893909989 0.893909989 1.787819978 0.000000000
s 1 -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m+mul 0.890867147 0.890867147 1.781734295 0.000000000
px 0 0.786958550 0.786958550 1.573917101 0.000000000
py 0 0.787049515 0.787049515 1.574099029 0.000000000
pz 0 0.779748985 0.779748985 1.559497970 0.000000000
sum over m 2.353757050 2.353757050 4.707514100 0.000000000
px 1 -0.008740300 -0.008740300 -0.017480600 0.000000000
py 1 -0.008743259 -0.008743259 -0.017486519 0.000000000
pz 1 -0.006461435 -0.006461435 -0.012922870 0.000000000
sum over m -0.023944995 -0.023944995 -0.047889989 0.000000000
sum over m+mul 2.329812055 2.329812055 4.659624111 0.000000000
d3z^2-r^2 0 -0.006390859 -0.006390859 -0.012781718 0.000000000
dx^2-y^2 0 -0.005056833 -0.005056833 -0.010113665 0.000000000
dxy 0 -0.005435510 -0.005435510 -0.010871019 0.000000000
dxz 0 -0.006931103 -0.006931103 -0.013862207 0.000000000
dyz 0 -0.006928479 -0.006928479 -0.013856957 0.000000000
sum over m -0.030742783 -0.030742783 -0.061485567 0.000000000
sum over m+mul -0.030742783 -0.030742783 -0.061485567 0.000000000
775 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000725403 1.000725403 2.001450807 0.000000000
sum over m 1.000725403 1.000725403 2.001450807 0.000000000
s 1 0.207430367 0.207430367 0.414860734 0.000000000
sum over m 0.207430367 0.207430367 0.414860734 0.000000000
s 2 0.014727697 0.014727697 0.029455394 0.000000000
sum over m 0.014727697 0.014727697 0.029455394 0.000000000
sum over m+mul 1.222883467 1.222883467 2.445766935 0.000000000
px 0 1.006393439 1.006393439 2.012786878 0.000000000
py 0 1.006393439 1.006393439 2.012786878 0.000000000
pz 0 1.006195798 1.006195798 2.012391597 0.000000000
sum over m 3.018982676 3.018982676 6.037965352 0.000000000
px 1 0.065412010 0.065412010 0.130824020 0.000000000
py 1 0.065412010 0.065412010 0.130824020 0.000000000
pz 1 0.040415874 0.040415874 0.080831748 0.000000000
sum over m 0.171239894 0.171239894 0.342479788 0.000000000
sum over m+mul 3.190222570 3.190222570 6.380445140 0.000000000
d3z^2-r^2 0 0.196297248 0.196297248 0.392594496 0.000000000
dx^2-y^2 0 0.201531019 0.201531019 0.403062039 0.000000000
dxy 0 0.250894199 0.250894199 0.501788398 0.000000000
dxz 0 0.268524245 0.268524245 0.537048491 0.000000000
dyz 0 0.268524245 0.268524245 0.537048491 0.000000000
sum over m 1.185770957 1.185770957 2.371541914 0.000000000
d3z^2-r^2 1 0.003483096 0.003483096 0.006966192 0.000000000
dx^2-y^2 1 -0.004465302 -0.004465302 -0.008930604 0.000000000
dxy 1 0.015339113 0.015339113 0.030678227 0.000000000
dxz 1 0.003495795 0.003495795 0.006991590 0.000000000
dyz 1 0.003495795 0.003495795 0.006991589 0.000000000
sum over m 0.021348497 0.021348497 0.042696994 0.000000000
sum over m+mul 1.207119454 1.207119454 2.414238908 0.000000000
776 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000725028 1.000725028 2.001450056 0.000000000
sum over m 1.000725028 1.000725028 2.001450056 0.000000000
s 1 0.207427994 0.207427994 0.414855988 0.000000000
sum over m 0.207427994 0.207427994 0.414855988 0.000000000
s 2 0.014726834 0.014726834 0.029453668 0.000000000
sum over m 0.014726834 0.014726834 0.029453668 0.000000000
sum over m+mul 1.222879856 1.222879856 2.445759712 0.000000000
px 0 1.006395557 1.006395557 2.012791113 0.000000000
py 0 1.006395557 1.006395557 2.012791113 0.000000000
pz 0 1.006197002 1.006197002 2.012394003 0.000000000
sum over m 3.018988115 3.018988115 6.037976230 0.000000000
px 1 0.065405251 0.065405251 0.130810502 0.000000000
py 1 0.065405251 0.065405251 0.130810502 0.000000000
pz 1 0.040420965 0.040420965 0.080841930 0.000000000
sum over m 0.171231467 0.171231467 0.342462934 0.000000000
sum over m+mul 3.190219582 3.190219582 6.380439164 0.000000000
d3z^2-r^2 0 0.196294299 0.196294299 0.392588597 0.000000000
dx^2-y^2 0 0.201531222 0.201531222 0.403062444 0.000000000
dxy 0 0.250892165 0.250892165 0.501784329 0.000000000
dxz 0 0.268525633 0.268525633 0.537051266 0.000000000
dyz 0 0.268525633 0.268525633 0.537051266 0.000000000
sum over m 1.185768951 1.185768951 2.371537901 0.000000000
d3z^2-r^2 1 0.003482159 0.003482159 0.006964318 0.000000000
dx^2-y^2 1 -0.004466487 -0.004466487 -0.008932973 0.000000000
dxy 1 0.015337208 0.015337208 0.030674416 0.000000000
dxz 1 0.003493760 0.003493760 0.006987520 0.000000000
dyz 1 0.003493760 0.003493760 0.006987520 0.000000000
sum over m 0.021340400 0.021340400 0.042680800 0.000000000
sum over m+mul 1.207109351 1.207109351 2.414218701 0.000000000
777 O Up spin Down spin Sum Diff
multiple
s 0 0.893899660 0.893899660 1.787799321 0.000000000
sum over m 0.893899660 0.893899660 1.787799321 0.000000000
s 1 -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m+mul 0.890857091 0.890857091 1.781714183 0.000000000
px 0 0.786968798 0.786968798 1.573937595 0.000000000
py 0 0.786968798 0.786968798 1.573937596 0.000000000
pz 0 0.779782868 0.779782868 1.559565736 0.000000000
sum over m 2.353720463 2.353720463 4.707440926 0.000000000
px 1 -0.008740920 -0.008740920 -0.017481841 0.000000000
py 1 -0.008740920 -0.008740920 -0.017481841 0.000000000
pz 1 -0.006464178 -0.006464178 -0.012928355 0.000000000
sum over m -0.023946018 -0.023946018 -0.047892037 0.000000000
sum over m+mul 2.329774445 2.329774445 4.659548890 0.000000000
d3z^2-r^2 0 -0.006390869 -0.006390869 -0.012781739 0.000000000
dx^2-y^2 0 -0.005058116 -0.005058116 -0.010116232 0.000000000
dxy 0 -0.005434961 -0.005434961 -0.010869922 0.000000000
dxz 0 -0.006931544 -0.006931544 -0.013863088 0.000000000
dyz 0 -0.006931544 -0.006931544 -0.013863088 0.000000000
sum over m -0.030747034 -0.030747034 -0.061494068 0.000000000
sum over m+mul -0.030747034 -0.030747034 -0.061494068 0.000000000
778 O Up spin Down spin Sum Diff
multiple
s 0 0.893865736 0.893865736 1.787731473 0.000000000
sum over m 0.893865736 0.893865736 1.787731473 0.000000000
s 1 -0.003042200 -0.003042200 -0.006084399 0.000000000
sum over m -0.003042200 -0.003042200 -0.006084399 0.000000000
sum over m+mul 0.890823537 0.890823537 1.781647074 0.000000000
px 0 0.786905133 0.786905133 1.573810267 0.000000000
py 0 0.786905133 0.786905133 1.573810266 0.000000000
pz 0 0.779849876 0.779849876 1.559699753 0.000000000
sum over m 2.353660143 2.353660143 4.707320286 0.000000000
px 1 -0.008736932 -0.008736932 -0.017473864 0.000000000
py 1 -0.008736932 -0.008736932 -0.017473864 0.000000000
pz 1 -0.006465368 -0.006465368 -0.012930735 0.000000000
sum over m -0.023939231 -0.023939231 -0.047878463 0.000000000
sum over m+mul 2.329720912 2.329720912 4.659441823 0.000000000
d3z^2-r^2 0 -0.006389788 -0.006389788 -0.012779577 0.000000000
dx^2-y^2 0 -0.005060645 -0.005060645 -0.010121291 0.000000000
dxy 0 -0.005432715 -0.005432715 -0.010865429 0.000000000
dxz 0 -0.006934464 -0.006934464 -0.013868928 0.000000000
dyz 0 -0.006934464 -0.006934464 -0.013868928 0.000000000
sum over m -0.030752076 -0.030752076 -0.061504153 0.000000000
sum over m+mul -0.030752076 -0.030752076 -0.061504153 0.000000000
779 O Up spin Down spin Sum Diff
multiple
s 0 0.893909989 0.893909989 1.787819978 0.000000000
sum over m 0.893909989 0.893909989 1.787819978 0.000000000
s 1 -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m+mul 0.890867147 0.890867147 1.781734295 0.000000000
px 0 0.787049515 0.787049515 1.574099029 0.000000000
py 0 0.786958550 0.786958550 1.573917101 0.000000000
pz 0 0.779748985 0.779748985 1.559497970 0.000000000
sum over m 2.353757050 2.353757050 4.707514100 0.000000000
px 1 -0.008743259 -0.008743259 -0.017486519 0.000000000
py 1 -0.008740300 -0.008740300 -0.017480601 0.000000000
pz 1 -0.006461435 -0.006461435 -0.012922870 0.000000000
sum over m -0.023944995 -0.023944995 -0.047889989 0.000000000
sum over m+mul 2.329812055 2.329812055 4.659624111 0.000000000
d3z^2-r^2 0 -0.006390859 -0.006390859 -0.012781718 0.000000000
dx^2-y^2 0 -0.005056833 -0.005056833 -0.010113665 0.000000000
dxy 0 -0.005435510 -0.005435510 -0.010871019 0.000000000
dxz 0 -0.006928479 -0.006928479 -0.013856957 0.000000000
dyz 0 -0.006931103 -0.006931103 -0.013862207 0.000000000
sum over m -0.030742783 -0.030742783 -0.061485567 0.000000000
sum over m+mul -0.030742783 -0.030742783 -0.061485567 0.000000000
780 O Up spin Down spin Sum Diff
multiple
s 0 0.893909989 0.893909989 1.787819978 0.000000000
sum over m 0.893909989 0.893909989 1.787819978 0.000000000
s 1 -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m+mul 0.890867147 0.890867147 1.781734295 0.000000000
px 0 0.786958550 0.786958550 1.573917101 0.000000000
py 0 0.787049515 0.787049515 1.574099030 0.000000000
pz 0 0.779748985 0.779748985 1.559497970 0.000000000
sum over m 2.353757050 2.353757050 4.707514100 0.000000000
px 1 -0.008740300 -0.008740300 -0.017480600 0.000000000
py 1 -0.008743259 -0.008743259 -0.017486519 0.000000000
pz 1 -0.006461435 -0.006461435 -0.012922870 0.000000000
sum over m -0.023944995 -0.023944995 -0.047889989 0.000000000
sum over m+mul 2.329812055 2.329812055 4.659624111 0.000000000
d3z^2-r^2 0 -0.006390859 -0.006390859 -0.012781718 0.000000000
dx^2-y^2 0 -0.005056833 -0.005056833 -0.010113665 0.000000000
dxy 0 -0.005435510 -0.005435510 -0.010871019 0.000000000
dxz 0 -0.006931103 -0.006931103 -0.013862207 0.000000000
dyz 0 -0.006928479 -0.006928479 -0.013856957 0.000000000
sum over m -0.030742783 -0.030742783 -0.061485567 0.000000000
sum over m+mul -0.030742783 -0.030742783 -0.061485567 0.000000000
781 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000725403 1.000725403 2.001450807 0.000000000
sum over m 1.000725403 1.000725403 2.001450807 0.000000000
s 1 0.207430367 0.207430367 0.414860734 0.000000000
sum over m 0.207430367 0.207430367 0.414860734 0.000000000
s 2 0.014727697 0.014727697 0.029455394 0.000000000
sum over m 0.014727697 0.014727697 0.029455394 0.000000000
sum over m+mul 1.222883468 1.222883468 2.445766935 0.000000000
px 0 1.006393439 1.006393439 2.012786877 0.000000000
py 0 1.006393439 1.006393439 2.012786878 0.000000000
pz 0 1.006195798 1.006195798 2.012391597 0.000000000
sum over m 3.018982676 3.018982676 6.037965352 0.000000000
px 1 0.065412010 0.065412010 0.130824021 0.000000000
py 1 0.065412010 0.065412010 0.130824021 0.000000000
pz 1 0.040415874 0.040415874 0.080831748 0.000000000
sum over m 0.171239895 0.171239895 0.342479789 0.000000000
sum over m+mul 3.190222570 3.190222570 6.380445141 0.000000000
d3z^2-r^2 0 0.196297248 0.196297248 0.392594496 0.000000000
dx^2-y^2 0 0.201531019 0.201531019 0.403062039 0.000000000
dxy 0 0.250894199 0.250894199 0.501788398 0.000000000
dxz 0 0.268524245 0.268524245 0.537048491 0.000000000
dyz 0 0.268524245 0.268524245 0.537048491 0.000000000
sum over m 1.185770957 1.185770957 2.371541915 0.000000000
d3z^2-r^2 1 0.003483096 0.003483096 0.006966192 0.000000000
dx^2-y^2 1 -0.004465302 -0.004465302 -0.008930604 0.000000000
dxy 1 0.015339114 0.015339114 0.030678227 0.000000000
dxz 1 0.003495795 0.003495795 0.006991589 0.000000000
dyz 1 0.003495795 0.003495795 0.006991589 0.000000000
sum over m 0.021348497 0.021348497 0.042696994 0.000000000
sum over m+mul 1.207119454 1.207119454 2.414238908 0.000000000
782 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000725028 1.000725028 2.001450056 0.000000000
sum over m 1.000725028 1.000725028 2.001450056 0.000000000
s 1 0.207427994 0.207427994 0.414855988 0.000000000
sum over m 0.207427994 0.207427994 0.414855988 0.000000000
s 2 0.014726834 0.014726834 0.029453668 0.000000000
sum over m 0.014726834 0.014726834 0.029453668 0.000000000
sum over m+mul 1.222879856 1.222879856 2.445759712 0.000000000
px 0 1.006395557 1.006395557 2.012791113 0.000000000
py 0 1.006395557 1.006395557 2.012791113 0.000000000
pz 0 1.006197002 1.006197002 2.012394003 0.000000000
sum over m 3.018988115 3.018988115 6.037976230 0.000000000
px 1 0.065405251 0.065405251 0.130810502 0.000000000
py 1 0.065405251 0.065405251 0.130810502 0.000000000
pz 1 0.040420965 0.040420965 0.080841930 0.000000000
sum over m 0.171231467 0.171231467 0.342462934 0.000000000
sum over m+mul 3.190219582 3.190219582 6.380439164 0.000000000
d3z^2-r^2 0 0.196294299 0.196294299 0.392588597 0.000000000
dx^2-y^2 0 0.201531222 0.201531222 0.403062443 0.000000000
dxy 0 0.250892165 0.250892165 0.501784330 0.000000000
dxz 0 0.268525633 0.268525633 0.537051265 0.000000000
dyz 0 0.268525633 0.268525633 0.537051266 0.000000000
sum over m 1.185768951 1.185768951 2.371537902 0.000000000
d3z^2-r^2 1 0.003482159 0.003482159 0.006964318 0.000000000
dx^2-y^2 1 -0.004466487 -0.004466487 -0.008932973 0.000000000
dxy 1 0.015337208 0.015337208 0.030674416 0.000000000
dxz 1 0.003493760 0.003493760 0.006987520 0.000000000
dyz 1 0.003493760 0.003493760 0.006987520 0.000000000
sum over m 0.021340400 0.021340400 0.042680800 0.000000000
sum over m+mul 1.207109351 1.207109351 2.414218702 0.000000000
783 O Up spin Down spin Sum Diff
multiple
s 0 0.893899660 0.893899660 1.787799321 0.000000000
sum over m 0.893899660 0.893899660 1.787799321 0.000000000
s 1 -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m+mul 0.890857091 0.890857091 1.781714183 0.000000000
px 0 0.786968798 0.786968798 1.573937596 0.000000000
py 0 0.786968798 0.786968798 1.573937596 0.000000000
pz 0 0.779782868 0.779782868 1.559565735 0.000000000
sum over m 2.353720463 2.353720463 4.707440927 0.000000000
px 1 -0.008740920 -0.008740920 -0.017481841 0.000000000
py 1 -0.008740920 -0.008740920 -0.017481841 0.000000000
pz 1 -0.006464178 -0.006464178 -0.012928355 0.000000000
sum over m -0.023946018 -0.023946018 -0.047892037 0.000000000
sum over m+mul 2.329774445 2.329774445 4.659548890 0.000000000
d3z^2-r^2 0 -0.006390869 -0.006390869 -0.012781739 0.000000000
dx^2-y^2 0 -0.005058116 -0.005058116 -0.010116232 0.000000000
dxy 0 -0.005434961 -0.005434961 -0.010869922 0.000000000
dxz 0 -0.006931544 -0.006931544 -0.013863088 0.000000000
dyz 0 -0.006931544 -0.006931544 -0.013863088 0.000000000
sum over m -0.030747034 -0.030747034 -0.061494068 0.000000000
sum over m+mul -0.030747034 -0.030747034 -0.061494068 0.000000000
784 O Up spin Down spin Sum Diff
multiple
s 0 0.893865736 0.893865736 1.787731473 0.000000000
sum over m 0.893865736 0.893865736 1.787731473 0.000000000
s 1 -0.003042200 -0.003042200 -0.006084399 0.000000000
sum over m -0.003042200 -0.003042200 -0.006084399 0.000000000
sum over m+mul 0.890823537 0.890823537 1.781647073 0.000000000
px 0 0.786905133 0.786905133 1.573810267 0.000000000
py 0 0.786905133 0.786905133 1.573810266 0.000000000
pz 0 0.779849876 0.779849876 1.559699753 0.000000000
sum over m 2.353660143 2.353660143 4.707320286 0.000000000
px 1 -0.008736932 -0.008736932 -0.017473864 0.000000000
py 1 -0.008736932 -0.008736932 -0.017473864 0.000000000
pz 1 -0.006465368 -0.006465368 -0.012930735 0.000000000
sum over m -0.023939231 -0.023939231 -0.047878462 0.000000000
sum over m+mul 2.329720912 2.329720912 4.659441823 0.000000000
d3z^2-r^2 0 -0.006389788 -0.006389788 -0.012779577 0.000000000
dx^2-y^2 0 -0.005060645 -0.005060645 -0.010121291 0.000000000
dxy 0 -0.005432715 -0.005432715 -0.010865429 0.000000000
dxz 0 -0.006934464 -0.006934464 -0.013868928 0.000000000
dyz 0 -0.006934464 -0.006934464 -0.013868928 0.000000000
sum over m -0.030752076 -0.030752076 -0.061504153 0.000000000
sum over m+mul -0.030752076 -0.030752076 -0.061504153 0.000000000
785 O Up spin Down spin Sum Diff
multiple
s 0 0.893909989 0.893909989 1.787819978 0.000000000
sum over m 0.893909989 0.893909989 1.787819978 0.000000000
s 1 -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m+mul 0.890867147 0.890867147 1.781734295 0.000000000
px 0 0.787049515 0.787049515 1.574099029 0.000000000
py 0 0.786958550 0.786958550 1.573917101 0.000000000
pz 0 0.779748985 0.779748985 1.559497970 0.000000000
sum over m 2.353757050 2.353757050 4.707514101 0.000000000
px 1 -0.008743259 -0.008743259 -0.017486519 0.000000000
py 1 -0.008740300 -0.008740300 -0.017480601 0.000000000
pz 1 -0.006461435 -0.006461435 -0.012922870 0.000000000
sum over m -0.023944995 -0.023944995 -0.047889989 0.000000000
sum over m+mul 2.329812056 2.329812056 4.659624111 0.000000000
d3z^2-r^2 0 -0.006390859 -0.006390859 -0.012781718 0.000000000
dx^2-y^2 0 -0.005056833 -0.005056833 -0.010113665 0.000000000
dxy 0 -0.005435510 -0.005435510 -0.010871019 0.000000000
dxz 0 -0.006928479 -0.006928479 -0.013856957 0.000000000
dyz 0 -0.006931103 -0.006931103 -0.013862207 0.000000000
sum over m -0.030742783 -0.030742783 -0.061485567 0.000000000
sum over m+mul -0.030742783 -0.030742783 -0.061485567 0.000000000
786 O Up spin Down spin Sum Diff
multiple
s 0 0.893909989 0.893909989 1.787819978 0.000000000
sum over m 0.893909989 0.893909989 1.787819978 0.000000000
s 1 -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m+mul 0.890867147 0.890867147 1.781734295 0.000000000
px 0 0.786958550 0.786958550 1.573917101 0.000000000
py 0 0.787049515 0.787049515 1.574099029 0.000000000
pz 0 0.779748985 0.779748985 1.559497970 0.000000000
sum over m 2.353757050 2.353757050 4.707514100 0.000000000
px 1 -0.008740300 -0.008740300 -0.017480600 0.000000000
py 1 -0.008743259 -0.008743259 -0.017486519 0.000000000
pz 1 -0.006461435 -0.006461435 -0.012922870 0.000000000
sum over m -0.023944995 -0.023944995 -0.047889989 0.000000000
sum over m+mul 2.329812055 2.329812055 4.659624111 0.000000000
d3z^2-r^2 0 -0.006390859 -0.006390859 -0.012781718 0.000000000
dx^2-y^2 0 -0.005056833 -0.005056833 -0.010113665 0.000000000
dxy 0 -0.005435510 -0.005435510 -0.010871019 0.000000000
dxz 0 -0.006931103 -0.006931103 -0.013862207 0.000000000
dyz 0 -0.006928479 -0.006928479 -0.013856957 0.000000000
sum over m -0.030742783 -0.030742783 -0.061485567 0.000000000
sum over m+mul -0.030742783 -0.030742783 -0.061485567 0.000000000
787 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000725403 1.000725403 2.001450806 0.000000000
sum over m 1.000725403 1.000725403 2.001450806 0.000000000
s 1 0.207430367 0.207430367 0.414860735 0.000000000
sum over m 0.207430367 0.207430367 0.414860735 0.000000000
s 2 0.014727697 0.014727697 0.029455394 0.000000000
sum over m 0.014727697 0.014727697 0.029455394 0.000000000
sum over m+mul 1.222883468 1.222883468 2.445766935 0.000000000
px 0 1.006393439 1.006393439 2.012786878 0.000000000
py 0 1.006393439 1.006393439 2.012786878 0.000000000
pz 0 1.006195798 1.006195798 2.012391597 0.000000000
sum over m 3.018982676 3.018982676 6.037965352 0.000000000
px 1 0.065412010 0.065412010 0.130824020 0.000000000
py 1 0.065412010 0.065412010 0.130824020 0.000000000
pz 1 0.040415874 0.040415874 0.080831748 0.000000000
sum over m 0.171239894 0.171239894 0.342479788 0.000000000
sum over m+mul 3.190222570 3.190222570 6.380445140 0.000000000
d3z^2-r^2 0 0.196297248 0.196297248 0.392594497 0.000000000
dx^2-y^2 0 0.201531020 0.201531020 0.403062039 0.000000000
dxy 0 0.250894199 0.250894199 0.501788398 0.000000000
dxz 0 0.268524245 0.268524245 0.537048490 0.000000000
dyz 0 0.268524245 0.268524245 0.537048490 0.000000000
sum over m 1.185770957 1.185770957 2.371541914 0.000000000
d3z^2-r^2 1 0.003483096 0.003483096 0.006966192 0.000000000
dx^2-y^2 1 -0.004465302 -0.004465302 -0.008930604 0.000000000
dxy 1 0.015339114 0.015339114 0.030678227 0.000000000
dxz 1 0.003495795 0.003495795 0.006991589 0.000000000
dyz 1 0.003495795 0.003495795 0.006991589 0.000000000
sum over m 0.021348497 0.021348497 0.042696994 0.000000000
sum over m+mul 1.207119454 1.207119454 2.414238908 0.000000000
788 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000725028 1.000725028 2.001450056 0.000000000
sum over m 1.000725028 1.000725028 2.001450056 0.000000000
s 1 0.207427994 0.207427994 0.414855988 0.000000000
sum over m 0.207427994 0.207427994 0.414855988 0.000000000
s 2 0.014726834 0.014726834 0.029453668 0.000000000
sum over m 0.014726834 0.014726834 0.029453668 0.000000000
sum over m+mul 1.222879856 1.222879856 2.445759712 0.000000000
px 0 1.006395557 1.006395557 2.012791113 0.000000000
py 0 1.006395557 1.006395557 2.012791113 0.000000000
pz 0 1.006197002 1.006197002 2.012394003 0.000000000
sum over m 3.018988115 3.018988115 6.037976230 0.000000000
px 1 0.065405251 0.065405251 0.130810502 0.000000000
py 1 0.065405251 0.065405251 0.130810502 0.000000000
pz 1 0.040420965 0.040420965 0.080841930 0.000000000
sum over m 0.171231467 0.171231467 0.342462934 0.000000000
sum over m+mul 3.190219582 3.190219582 6.380439164 0.000000000
d3z^2-r^2 0 0.196294299 0.196294299 0.392588598 0.000000000
dx^2-y^2 0 0.201531222 0.201531222 0.403062444 0.000000000
dxy 0 0.250892165 0.250892165 0.501784330 0.000000000
dxz 0 0.268525633 0.268525633 0.537051266 0.000000000
dyz 0 0.268525633 0.268525633 0.537051265 0.000000000
sum over m 1.185768951 1.185768951 2.371537902 0.000000000
d3z^2-r^2 1 0.003482159 0.003482159 0.006964318 0.000000000
dx^2-y^2 1 -0.004466487 -0.004466487 -0.008932973 0.000000000
dxy 1 0.015337208 0.015337208 0.030674416 0.000000000
dxz 1 0.003493760 0.003493760 0.006987520 0.000000000
dyz 1 0.003493760 0.003493760 0.006987520 0.000000000
sum over m 0.021340400 0.021340400 0.042680800 0.000000000
sum over m+mul 1.207109351 1.207109351 2.414218702 0.000000000
789 O Up spin Down spin Sum Diff
multiple
s 0 0.893899660 0.893899660 1.787799321 0.000000000
sum over m 0.893899660 0.893899660 1.787799321 0.000000000
s 1 -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m+mul 0.890857091 0.890857091 1.781714183 0.000000000
px 0 0.786968798 0.786968798 1.573937595 0.000000000
py 0 0.786968798 0.786968798 1.573937595 0.000000000
pz 0 0.779782868 0.779782868 1.559565736 0.000000000
sum over m 2.353720463 2.353720463 4.707440926 0.000000000
px 1 -0.008740920 -0.008740920 -0.017481841 0.000000000
py 1 -0.008740920 -0.008740920 -0.017481841 0.000000000
pz 1 -0.006464178 -0.006464178 -0.012928355 0.000000000
sum over m -0.023946018 -0.023946018 -0.047892037 0.000000000
sum over m+mul 2.329774445 2.329774445 4.659548889 0.000000000
d3z^2-r^2 0 -0.006390869 -0.006390869 -0.012781739 0.000000000
dx^2-y^2 0 -0.005058116 -0.005058116 -0.010116232 0.000000000
dxy 0 -0.005434961 -0.005434961 -0.010869922 0.000000000
dxz 0 -0.006931544 -0.006931544 -0.013863088 0.000000000
dyz 0 -0.006931544 -0.006931544 -0.013863088 0.000000000
sum over m -0.030747034 -0.030747034 -0.061494068 0.000000000
sum over m+mul -0.030747034 -0.030747034 -0.061494068 0.000000000
790 O Up spin Down spin Sum Diff
multiple
s 0 0.893865736 0.893865736 1.787731473 0.000000000
sum over m 0.893865736 0.893865736 1.787731473 0.000000000
s 1 -0.003042200 -0.003042200 -0.006084399 0.000000000
sum over m -0.003042200 -0.003042200 -0.006084399 0.000000000
sum over m+mul 0.890823537 0.890823537 1.781647073 0.000000000
px 0 0.786905133 0.786905133 1.573810266 0.000000000
py 0 0.786905133 0.786905133 1.573810266 0.000000000
pz 0 0.779849876 0.779849876 1.559699753 0.000000000
sum over m 2.353660143 2.353660143 4.707320285 0.000000000
px 1 -0.008736932 -0.008736932 -0.017473864 0.000000000
py 1 -0.008736932 -0.008736932 -0.017473864 0.000000000
pz 1 -0.006465368 -0.006465368 -0.012930735 0.000000000
sum over m -0.023939231 -0.023939231 -0.047878463 0.000000000
sum over m+mul 2.329720911 2.329720911 4.659441823 0.000000000
d3z^2-r^2 0 -0.006389788 -0.006389788 -0.012779577 0.000000000
dx^2-y^2 0 -0.005060645 -0.005060645 -0.010121291 0.000000000
dxy 0 -0.005432715 -0.005432715 -0.010865429 0.000000000
dxz 0 -0.006934464 -0.006934464 -0.013868928 0.000000000
dyz 0 -0.006934464 -0.006934464 -0.013868928 0.000000000
sum over m -0.030752076 -0.030752076 -0.061504153 0.000000000
sum over m+mul -0.030752076 -0.030752076 -0.061504153 0.000000000
791 O Up spin Down spin Sum Diff
multiple
s 0 0.893909989 0.893909989 1.787819978 0.000000000
sum over m 0.893909989 0.893909989 1.787819978 0.000000000
s 1 -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m+mul 0.890867147 0.890867147 1.781734295 0.000000000
px 0 0.787049514 0.787049514 1.574099029 0.000000000
py 0 0.786958550 0.786958550 1.573917101 0.000000000
pz 0 0.779748985 0.779748985 1.559497970 0.000000000
sum over m 2.353757050 2.353757050 4.707514100 0.000000000
px 1 -0.008743259 -0.008743259 -0.017486519 0.000000000
py 1 -0.008740300 -0.008740300 -0.017480601 0.000000000
pz 1 -0.006461435 -0.006461435 -0.012922870 0.000000000
sum over m -0.023944995 -0.023944995 -0.047889989 0.000000000
sum over m+mul 2.329812055 2.329812055 4.659624111 0.000000000
d3z^2-r^2 0 -0.006390859 -0.006390859 -0.012781718 0.000000000
dx^2-y^2 0 -0.005056833 -0.005056833 -0.010113665 0.000000000
dxy 0 -0.005435510 -0.005435510 -0.010871019 0.000000000
dxz 0 -0.006928479 -0.006928479 -0.013856957 0.000000000
dyz 0 -0.006931103 -0.006931103 -0.013862207 0.000000000
sum over m -0.030742783 -0.030742783 -0.061485567 0.000000000
sum over m+mul -0.030742783 -0.030742783 -0.061485567 0.000000000
792 O Up spin Down spin Sum Diff
multiple
s 0 0.893909989 0.893909989 1.787819978 0.000000000
sum over m 0.893909989 0.893909989 1.787819978 0.000000000
s 1 -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m+mul 0.890867147 0.890867147 1.781734295 0.000000000
px 0 0.786958550 0.786958550 1.573917101 0.000000000
py 0 0.787049514 0.787049514 1.574099029 0.000000000
pz 0 0.779748985 0.779748985 1.559497970 0.000000000
sum over m 2.353757050 2.353757050 4.707514100 0.000000000
px 1 -0.008740300 -0.008740300 -0.017480600 0.000000000
py 1 -0.008743259 -0.008743259 -0.017486519 0.000000000
pz 1 -0.006461435 -0.006461435 -0.012922870 0.000000000
sum over m -0.023944995 -0.023944995 -0.047889989 0.000000000
sum over m+mul 2.329812055 2.329812055 4.659624111 0.000000000
d3z^2-r^2 0 -0.006390859 -0.006390859 -0.012781718 0.000000000
dx^2-y^2 0 -0.005056833 -0.005056833 -0.010113665 0.000000000
dxy 0 -0.005435510 -0.005435510 -0.010871019 0.000000000
dxz 0 -0.006931103 -0.006931103 -0.013862207 0.000000000
dyz 0 -0.006928479 -0.006928479 -0.013856957 0.000000000
sum over m -0.030742783 -0.030742783 -0.061485567 0.000000000
sum over m+mul -0.030742783 -0.030742783 -0.061485567 0.000000000
793 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000725403 1.000725403 2.001450807 0.000000000
sum over m 1.000725403 1.000725403 2.001450807 0.000000000
s 1 0.207430367 0.207430367 0.414860734 0.000000000
sum over m 0.207430367 0.207430367 0.414860734 0.000000000
s 2 0.014727697 0.014727697 0.029455394 0.000000000
sum over m 0.014727697 0.014727697 0.029455394 0.000000000
sum over m+mul 1.222883468 1.222883468 2.445766935 0.000000000
px 0 1.006393439 1.006393439 2.012786877 0.000000000
py 0 1.006393439 1.006393439 2.012786878 0.000000000
pz 0 1.006195798 1.006195798 2.012391597 0.000000000
sum over m 3.018982676 3.018982676 6.037965352 0.000000000
px 1 0.065412010 0.065412010 0.130824020 0.000000000
py 1 0.065412010 0.065412010 0.130824021 0.000000000
pz 1 0.040415874 0.040415874 0.080831748 0.000000000
sum over m 0.171239894 0.171239894 0.342479788 0.000000000
sum over m+mul 3.190222570 3.190222570 6.380445140 0.000000000
d3z^2-r^2 0 0.196297248 0.196297248 0.392594496 0.000000000
dx^2-y^2 0 0.201531019 0.201531019 0.403062039 0.000000000
dxy 0 0.250894199 0.250894199 0.501788398 0.000000000
dxz 0 0.268524245 0.268524245 0.537048490 0.000000000
dyz 0 0.268524246 0.268524246 0.537048491 0.000000000
sum over m 1.185770957 1.185770957 2.371541915 0.000000000
d3z^2-r^2 1 0.003483096 0.003483096 0.006966192 0.000000000
dx^2-y^2 1 -0.004465302 -0.004465302 -0.008930604 0.000000000
dxy 1 0.015339114 0.015339114 0.030678227 0.000000000
dxz 1 0.003495795 0.003495795 0.006991589 0.000000000
dyz 1 0.003495795 0.003495795 0.006991589 0.000000000
sum over m 0.021348497 0.021348497 0.042696994 0.000000000
sum over m+mul 1.207119454 1.207119454 2.414238909 0.000000000
794 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000725028 1.000725028 2.001450057 0.000000000
sum over m 1.000725028 1.000725028 2.001450057 0.000000000
s 1 0.207427994 0.207427994 0.414855988 0.000000000
sum over m 0.207427994 0.207427994 0.414855988 0.000000000
s 2 0.014726834 0.014726834 0.029453668 0.000000000
sum over m 0.014726834 0.014726834 0.029453668 0.000000000
sum over m+mul 1.222879856 1.222879856 2.445759712 0.000000000
px 0 1.006395557 1.006395557 2.012791113 0.000000000
py 0 1.006395557 1.006395557 2.012791113 0.000000000
pz 0 1.006197002 1.006197002 2.012394003 0.000000000
sum over m 3.018988115 3.018988115 6.037976230 0.000000000
px 1 0.065405251 0.065405251 0.130810502 0.000000000
py 1 0.065405251 0.065405251 0.130810502 0.000000000
pz 1 0.040420965 0.040420965 0.080841930 0.000000000
sum over m 0.171231467 0.171231467 0.342462934 0.000000000
sum over m+mul 3.190219582 3.190219582 6.380439164 0.000000000
d3z^2-r^2 0 0.196294299 0.196294299 0.392588597 0.000000000
dx^2-y^2 0 0.201531222 0.201531222 0.403062443 0.000000000
dxy 0 0.250892165 0.250892165 0.501784330 0.000000000
dxz 0 0.268525633 0.268525633 0.537051266 0.000000000
dyz 0 0.268525633 0.268525633 0.537051266 0.000000000
sum over m 1.185768951 1.185768951 2.371537902 0.000000000
d3z^2-r^2 1 0.003482159 0.003482159 0.006964318 0.000000000
dx^2-y^2 1 -0.004466487 -0.004466487 -0.008932973 0.000000000
dxy 1 0.015337208 0.015337208 0.030674416 0.000000000
dxz 1 0.003493760 0.003493760 0.006987520 0.000000000
dyz 1 0.003493760 0.003493760 0.006987520 0.000000000
sum over m 0.021340400 0.021340400 0.042680800 0.000000000
sum over m+mul 1.207109351 1.207109351 2.414218702 0.000000000
795 O Up spin Down spin Sum Diff
multiple
s 0 0.893899660 0.893899660 1.787799321 0.000000000
sum over m 0.893899660 0.893899660 1.787799321 0.000000000
s 1 -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m -0.003042569 -0.003042569 -0.006085138 0.000000000
sum over m+mul 0.890857091 0.890857091 1.781714183 0.000000000
px 0 0.786968798 0.786968798 1.573937595 0.000000000
py 0 0.786968798 0.786968798 1.573937595 0.000000000
pz 0 0.779782868 0.779782868 1.559565736 0.000000000
sum over m 2.353720463 2.353720463 4.707440926 0.000000000
px 1 -0.008740920 -0.008740920 -0.017481841 0.000000000
py 1 -0.008740920 -0.008740920 -0.017481841 0.000000000
pz 1 -0.006464178 -0.006464178 -0.012928355 0.000000000
sum over m -0.023946018 -0.023946018 -0.047892037 0.000000000
sum over m+mul 2.329774445 2.329774445 4.659548890 0.000000000
d3z^2-r^2 0 -0.006390869 -0.006390869 -0.012781739 0.000000000
dx^2-y^2 0 -0.005058116 -0.005058116 -0.010116232 0.000000000
dxy 0 -0.005434961 -0.005434961 -0.010869922 0.000000000
dxz 0 -0.006931544 -0.006931544 -0.013863088 0.000000000
dyz 0 -0.006931544 -0.006931544 -0.013863088 0.000000000
sum over m -0.030747034 -0.030747034 -0.061494068 0.000000000
sum over m+mul -0.030747034 -0.030747034 -0.061494068 0.000000000
796 O Up spin Down spin Sum Diff
multiple
s 0 0.893865736 0.893865736 1.787731473 0.000000000
sum over m 0.893865736 0.893865736 1.787731473 0.000000000
s 1 -0.003042200 -0.003042200 -0.006084399 0.000000000
sum over m -0.003042200 -0.003042200 -0.006084399 0.000000000
sum over m+mul 0.890823537 0.890823537 1.781647074 0.000000000
px 0 0.786905133 0.786905133 1.573810267 0.000000000
py 0 0.786905133 0.786905133 1.573810266 0.000000000
pz 0 0.779849876 0.779849876 1.559699753 0.000000000
sum over m 2.353660143 2.353660143 4.707320285 0.000000000
px 1 -0.008736932 -0.008736932 -0.017473864 0.000000000
py 1 -0.008736932 -0.008736932 -0.017473864 0.000000000
pz 1 -0.006465368 -0.006465368 -0.012930735 0.000000000
sum over m -0.023939231 -0.023939231 -0.047878462 0.000000000
sum over m+mul 2.329720911 2.329720911 4.659441823 0.000000000
d3z^2-r^2 0 -0.006389788 -0.006389788 -0.012779577 0.000000000
dx^2-y^2 0 -0.005060645 -0.005060645 -0.010121291 0.000000000
dxy 0 -0.005432715 -0.005432715 -0.010865429 0.000000000
dxz 0 -0.006934464 -0.006934464 -0.013868928 0.000000000
dyz 0 -0.006934464 -0.006934464 -0.013868928 0.000000000
sum over m -0.030752076 -0.030752076 -0.061504153 0.000000000
sum over m+mul -0.030752076 -0.030752076 -0.061504153 0.000000000
797 O Up spin Down spin Sum Diff
multiple
s 0 0.893909989 0.893909989 1.787819978 0.000000000
sum over m 0.893909989 0.893909989 1.787819978 0.000000000
s 1 -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m+mul 0.890867147 0.890867147 1.781734295 0.000000000
px 0 0.787049515 0.787049515 1.574099029 0.000000000
py 0 0.786958550 0.786958550 1.573917100 0.000000000
pz 0 0.779748985 0.779748985 1.559497971 0.000000000
sum over m 2.353757050 2.353757050 4.707514100 0.000000000
px 1 -0.008743259 -0.008743259 -0.017486519 0.000000000
py 1 -0.008740300 -0.008740300 -0.017480601 0.000000000
pz 1 -0.006461435 -0.006461435 -0.012922870 0.000000000
sum over m -0.023944995 -0.023944995 -0.047889989 0.000000000
sum over m+mul 2.329812055 2.329812055 4.659624111 0.000000000
d3z^2-r^2 0 -0.006390859 -0.006390859 -0.012781718 0.000000000
dx^2-y^2 0 -0.005056833 -0.005056833 -0.010113665 0.000000000
dxy 0 -0.005435510 -0.005435510 -0.010871019 0.000000000
dxz 0 -0.006928479 -0.006928479 -0.013856957 0.000000000
dyz 0 -0.006931103 -0.006931103 -0.013862207 0.000000000
sum over m -0.030742783 -0.030742783 -0.061485567 0.000000000
sum over m+mul -0.030742783 -0.030742783 -0.061485567 0.000000000
798 O Up spin Down spin Sum Diff
multiple
s 0 0.893909989 0.893909989 1.787819978 0.000000000
sum over m 0.893909989 0.893909989 1.787819978 0.000000000
s 1 -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m -0.003042842 -0.003042842 -0.006085683 0.000000000
sum over m+mul 0.890867147 0.890867147 1.781734295 0.000000000
px 0 0.786958550 0.786958550 1.573917101 0.000000000
py 0 0.787049515 0.787049515 1.574099029 0.000000000
pz 0 0.779748985 0.779748985 1.559497970 0.000000000
sum over m 2.353757050 2.353757050 4.707514100 0.000000000
px 1 -0.008740300 -0.008740300 -0.017480600 0.000000000
py 1 -0.008743259 -0.008743259 -0.017486519 0.000000000
pz 1 -0.006461435 -0.006461435 -0.012922870 0.000000000
sum over m -0.023944995 -0.023944995 -0.047889989 0.000000000
sum over m+mul 2.329812055 2.329812055 4.659624110 0.000000000
d3z^2-r^2 0 -0.006390859 -0.006390859 -0.012781718 0.000000000
dx^2-y^2 0 -0.005056833 -0.005056833 -0.010113665 0.000000000
dxy 0 -0.005435510 -0.005435510 -0.010871019 0.000000000
dxz 0 -0.006931103 -0.006931103 -0.013862207 0.000000000
dyz 0 -0.006928479 -0.006928479 -0.013856957 0.000000000
sum over m -0.030742783 -0.030742783 -0.061485567 0.000000000
sum over m+mul -0.030742783 -0.030742783 -0.061485567 0.000000000
799 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742384 1.000742384 2.001484768 0.000000000
sum over m 1.000742384 1.000742384 2.001484768 0.000000000
s 1 0.207419860 0.207419860 0.414839720 0.000000000
sum over m 0.207419860 0.207419860 0.414839720 0.000000000
s 2 0.014726842 0.014726842 0.029453685 0.000000000
sum over m 0.014726842 0.014726842 0.029453685 0.000000000
sum over m+mul 1.222889086 1.222889086 2.445778173 0.000000000
px 0 1.006382190 1.006382190 2.012764379 0.000000000
py 0 1.006389813 1.006389813 2.012779625 0.000000000
pz 0 1.006209268 1.006209268 2.012418536 0.000000000
sum over m 3.018981270 3.018981270 6.037962541 0.000000000
px 1 0.065407996 0.065407996 0.130815993 0.000000000
py 1 0.065419256 0.065419256 0.130838512 0.000000000
pz 1 0.040404373 0.040404373 0.080808746 0.000000000
sum over m 0.171231625 0.171231625 0.342463251 0.000000000
sum over m+mul 3.190212896 3.190212896 6.380425792 0.000000000
d3z^2-r^2 0 0.196292287 0.196292287 0.392584573 0.000000000
dx^2-y^2 0 0.201528144 0.201528144 0.403056288 0.000000000
dxy 0 0.250900631 0.250900631 0.501801262 0.000000000
dxz 0 0.268523414 0.268523414 0.537046828 0.000000000
dyz 0 0.268518199 0.268518199 0.537036398 0.000000000
sum over m 1.185762674 1.185762674 2.371525349 0.000000000
d3z^2-r^2 1 0.003481533 0.003481533 0.006963067 0.000000000
dx^2-y^2 1 -0.004468526 -0.004468526 -0.008937052 0.000000000
dxy 1 0.015338662 0.015338662 0.030677323 0.000000000
dxz 1 0.003491426 0.003491426 0.006982852 0.000000000
dyz 1 0.003492549 0.003492549 0.006985098 0.000000000
sum over m 0.021335644 0.021335644 0.042671289 0.000000000
sum over m+mul 1.207098319 1.207098319 2.414196637 0.000000000
800 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000756856 1.000756856 2.001513712 0.000000000
sum over m 1.000756856 1.000756856 2.001513712 0.000000000
s 1 0.207409960 0.207409960 0.414819921 0.000000000
sum over m 0.207409960 0.207409960 0.414819921 0.000000000
s 2 0.014725999 0.014725999 0.029451998 0.000000000
sum over m 0.014725999 0.014725999 0.029451998 0.000000000
sum over m+mul 1.222892815 1.222892815 2.445785631 0.000000000
px 0 1.006373475 1.006373475 2.012746950 0.000000000
py 0 1.006375870 1.006375870 2.012751739 0.000000000
pz 0 1.006214911 1.006214911 2.012429822 0.000000000
sum over m 3.018964256 3.018964256 6.037928511 0.000000000
px 1 0.065418425 0.065418425 0.130836851 0.000000000
py 1 0.065439993 0.065439993 0.130879987 0.000000000
pz 1 0.040380762 0.040380762 0.080761524 0.000000000
sum over m 0.171239181 0.171239181 0.342478361 0.000000000
sum over m+mul 3.190203436 3.190203436 6.380406873 0.000000000
d3z^2-r^2 0 0.196294767 0.196294767 0.392589534 0.000000000
dx^2-y^2 0 0.201520194 0.201520194 0.403040388 0.000000000
dxy 0 0.250918861 0.250918861 0.501837721 0.000000000
dxz 0 0.268520644 0.268520644 0.537041287 0.000000000
dyz 0 0.268505238 0.268505238 0.537010475 0.000000000
sum over m 1.185759703 1.185759703 2.371519406 0.000000000
d3z^2-r^2 1 0.003478828 0.003478828 0.006957656 0.000000000
dx^2-y^2 1 -0.004472687 -0.004472687 -0.008945374 0.000000000
dxy 1 0.015340656 0.015340656 0.030681312 0.000000000
dxz 1 0.003489489 0.003489489 0.006978978 0.000000000
dyz 1 0.003491007 0.003491007 0.006982015 0.000000000
sum over m 0.021327293 0.021327293 0.042654586 0.000000000
sum over m+mul 1.207086996 1.207086996 2.414173993 0.000000000
801 O Up spin Down spin Sum Diff
multiple
s 0 0.893912940 0.893912940 1.787825881 0.000000000
sum over m 0.893912940 0.893912940 1.787825881 0.000000000
s 1 -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m+mul 0.890870277 0.890870277 1.781740554 0.000000000
px 0 0.786955523 0.786955523 1.573911046 0.000000000
py 0 0.787099819 0.787099819 1.574199637 0.000000000
pz 0 0.779726273 0.779726273 1.559452547 0.000000000
sum over m 2.353781615 2.353781615 4.707563230 0.000000000
px 1 -0.008737472 -0.008737472 -0.017474944 0.000000000
py 1 -0.008741820 -0.008741820 -0.017483640 0.000000000
pz 1 -0.006459855 -0.006459855 -0.012919711 0.000000000
sum over m -0.023939147 -0.023939147 -0.047878295 0.000000000
sum over m+mul 2.329842467 2.329842467 4.659684935 0.000000000
d3z^2-r^2 0 -0.006390642 -0.006390642 -0.012781283 0.000000000
dx^2-y^2 0 -0.005055774 -0.005055774 -0.010111549 0.000000000
dxy 0 -0.005436133 -0.005436133 -0.010872267 0.000000000
dxz 0 -0.006930509 -0.006930509 -0.013861018 0.000000000
dyz 0 -0.006925393 -0.006925393 -0.013850787 0.000000000
sum over m -0.030738452 -0.030738452 -0.061476903 0.000000000
sum over m+mul -0.030738452 -0.030738452 -0.061476903 0.000000000
802 O Up spin Down spin Sum Diff
multiple
s 0 0.893852153 0.893852153 1.787704305 0.000000000
sum over m 0.893852153 0.893852153 1.787704305 0.000000000
s 1 -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m+mul 0.890809938 0.890809938 1.781619875 0.000000000
px 0 0.786926850 0.786926850 1.573853701 0.000000000
py 0 0.786865166 0.786865166 1.573730333 0.000000000
pz 0 0.779871065 0.779871065 1.559742131 0.000000000
sum over m 2.353663082 2.353663082 4.707326164 0.000000000
px 1 -0.008731742 -0.008731742 -0.017463485 0.000000000
py 1 -0.008735735 -0.008735735 -0.017471470 0.000000000
pz 1 -0.006466435 -0.006466435 -0.012932870 0.000000000
sum over m -0.023933912 -0.023933912 -0.047867825 0.000000000
sum over m+mul 2.329729170 2.329729170 4.659458339 0.000000000
d3z^2-r^2 0 -0.006389061 -0.006389061 -0.012778123 0.000000000
dx^2-y^2 0 -0.005061139 -0.005061139 -0.010122278 0.000000000
dxy 0 -0.005432262 -0.005432262 -0.010864524 0.000000000
dxz 0 -0.006934030 -0.006934030 -0.013868061 0.000000000
dyz 0 -0.006934207 -0.006934207 -0.013868413 0.000000000
sum over m -0.030750700 -0.030750700 -0.061501399 0.000000000
sum over m+mul -0.030750700 -0.030750700 -0.061501399 0.000000000
803 O Up spin Down spin Sum Diff
multiple
s 0 0.893893680 0.893893680 1.787787361 0.000000000
sum over m 0.893893680 0.893893680 1.787787361 0.000000000
s 1 -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m+mul 0.890851350 0.890851350 1.781702699 0.000000000
px 0 0.787088608 0.787088608 1.574177217 0.000000000
py 0 0.786824065 0.786824065 1.573648130 0.000000000
pz 0 0.779803270 0.779803270 1.559606540 0.000000000
sum over m 2.353715943 2.353715943 4.707431887 0.000000000
px 1 -0.008743572 -0.008743572 -0.017487144 0.000000000
py 1 -0.008736146 -0.008736146 -0.017472292 0.000000000
pz 1 -0.006463076 -0.006463076 -0.012926152 0.000000000
sum over m -0.023942794 -0.023942794 -0.047885589 0.000000000
sum over m+mul 2.329773149 2.329773149 4.659546298 0.000000000
d3z^2-r^2 0 -0.006390493 -0.006390493 -0.012780986 0.000000000
dx^2-y^2 0 -0.005059161 -0.005059161 -0.010118322 0.000000000
dxy 0 -0.005434201 -0.005434201 -0.010868403 0.000000000
dxz 0 -0.006929332 -0.006929332 -0.013858665 0.000000000
dyz 0 -0.006933940 -0.006933940 -0.013867881 0.000000000
sum over m -0.030747128 -0.030747128 -0.061494256 0.000000000
sum over m+mul -0.030747128 -0.030747128 -0.061494256 0.000000000
804 O Up spin Down spin Sum Diff
multiple
s 0 0.893907478 0.893907478 1.787814956 0.000000000
sum over m 0.893907478 0.893907478 1.787814956 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m+mul 0.890865303 0.890865303 1.781730606 0.000000000
px 0 0.786958584 0.786958584 1.573917168 0.000000000
py 0 0.787102518 0.787102518 1.574205035 0.000000000
pz 0 0.779724466 0.779724466 1.559448932 0.000000000
sum over m 2.353785567 2.353785567 4.707571135 0.000000000
px 1 -0.008733424 -0.008733424 -0.017466849 0.000000000
py 1 -0.008740799 -0.008740799 -0.017481598 0.000000000
pz 1 -0.006457641 -0.006457641 -0.012915283 0.000000000
sum over m -0.023931864 -0.023931864 -0.047863729 0.000000000
sum over m+mul 2.329853703 2.329853703 4.659707406 0.000000000
d3z^2-r^2 0 -0.006390204 -0.006390204 -0.012780408 0.000000000
dx^2-y^2 0 -0.005055858 -0.005055858 -0.010111717 0.000000000
dxy 0 -0.005435946 -0.005435946 -0.010871892 0.000000000
dxz 0 -0.006929974 -0.006929974 -0.013859947 0.000000000
dyz 0 -0.006924124 -0.006924124 -0.013848248 0.000000000
sum over m -0.030736106 -0.030736106 -0.061472212 0.000000000
sum over m+mul -0.030736106 -0.030736106 -0.061472212 0.000000000
805 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742384 1.000742384 2.001484767 0.000000000
sum over m 1.000742384 1.000742384 2.001484767 0.000000000
s 1 0.207419860 0.207419860 0.414839720 0.000000000
sum over m 0.207419860 0.207419860 0.414839720 0.000000000
s 2 0.014726842 0.014726842 0.029453685 0.000000000
sum over m 0.014726842 0.014726842 0.029453685 0.000000000
sum over m+mul 1.222889086 1.222889086 2.445778172 0.000000000
px 0 1.006382190 1.006382190 2.012764379 0.000000000
py 0 1.006389813 1.006389813 2.012779625 0.000000000
pz 0 1.006209268 1.006209268 2.012418536 0.000000000
sum over m 3.018981270 3.018981270 6.037962541 0.000000000
px 1 0.065407996 0.065407996 0.130815992 0.000000000
py 1 0.065419256 0.065419256 0.130838512 0.000000000
pz 1 0.040404373 0.040404373 0.080808746 0.000000000
sum over m 0.171231625 0.171231625 0.342463250 0.000000000
sum over m+mul 3.190212895 3.190212895 6.380425791 0.000000000
d3z^2-r^2 0 0.196292287 0.196292287 0.392584573 0.000000000
dx^2-y^2 0 0.201528144 0.201528144 0.403056288 0.000000000
dxy 0 0.250900631 0.250900631 0.501801262 0.000000000
dxz 0 0.268523414 0.268523414 0.537046828 0.000000000
dyz 0 0.268518199 0.268518199 0.537036398 0.000000000
sum over m 1.185762674 1.185762674 2.371525349 0.000000000
d3z^2-r^2 1 0.003481533 0.003481533 0.006963067 0.000000000
dx^2-y^2 1 -0.004468526 -0.004468526 -0.008937052 0.000000000
dxy 1 0.015338662 0.015338662 0.030677323 0.000000000
dxz 1 0.003491426 0.003491426 0.006982852 0.000000000
dyz 1 0.003492549 0.003492549 0.006985098 0.000000000
sum over m 0.021335644 0.021335644 0.042671289 0.000000000
sum over m+mul 1.207098319 1.207098319 2.414196638 0.000000000
806 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000756856 1.000756856 2.001513712 0.000000000
sum over m 1.000756856 1.000756856 2.001513712 0.000000000
s 1 0.207409960 0.207409960 0.414819920 0.000000000
sum over m 0.207409960 0.207409960 0.414819920 0.000000000
s 2 0.014725999 0.014725999 0.029451998 0.000000000
sum over m 0.014725999 0.014725999 0.029451998 0.000000000
sum over m+mul 1.222892815 1.222892815 2.445785631 0.000000000
px 0 1.006373475 1.006373475 2.012746950 0.000000000
py 0 1.006375870 1.006375870 2.012751740 0.000000000
pz 0 1.006214911 1.006214911 2.012429822 0.000000000
sum over m 3.018964256 3.018964256 6.037928511 0.000000000
px 1 0.065418425 0.065418425 0.130836850 0.000000000
py 1 0.065439994 0.065439994 0.130879987 0.000000000
pz 1 0.040380762 0.040380762 0.080761523 0.000000000
sum over m 0.171239180 0.171239180 0.342478361 0.000000000
sum over m+mul 3.190203436 3.190203436 6.380406872 0.000000000
d3z^2-r^2 0 0.196294767 0.196294767 0.392589534 0.000000000
dx^2-y^2 0 0.201520194 0.201520194 0.403040388 0.000000000
dxy 0 0.250918861 0.250918861 0.501837722 0.000000000
dxz 0 0.268520644 0.268520644 0.537041287 0.000000000
dyz 0 0.268505238 0.268505238 0.537010475 0.000000000
sum over m 1.185759703 1.185759703 2.371519406 0.000000000
d3z^2-r^2 1 0.003478828 0.003478828 0.006957656 0.000000000
dx^2-y^2 1 -0.004472687 -0.004472687 -0.008945374 0.000000000
dxy 1 0.015340656 0.015340656 0.030681312 0.000000000
dxz 1 0.003489489 0.003489489 0.006978978 0.000000000
dyz 1 0.003491007 0.003491007 0.006982015 0.000000000
sum over m 0.021327293 0.021327293 0.042654586 0.000000000
sum over m+mul 1.207086996 1.207086996 2.414173993 0.000000000
807 O Up spin Down spin Sum Diff
multiple
s 0 0.893912940 0.893912940 1.787825881 0.000000000
sum over m 0.893912940 0.893912940 1.787825881 0.000000000
s 1 -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m+mul 0.890870277 0.890870277 1.781740554 0.000000000
px 0 0.786955523 0.786955523 1.573911047 0.000000000
py 0 0.787099819 0.787099819 1.574199637 0.000000000
pz 0 0.779726273 0.779726273 1.559452546 0.000000000
sum over m 2.353781615 2.353781615 4.707563230 0.000000000
px 1 -0.008737472 -0.008737472 -0.017474944 0.000000000
py 1 -0.008741820 -0.008741820 -0.017483639 0.000000000
pz 1 -0.006459855 -0.006459855 -0.012919711 0.000000000
sum over m -0.023939147 -0.023939147 -0.047878295 0.000000000
sum over m+mul 2.329842468 2.329842468 4.659684936 0.000000000
d3z^2-r^2 0 -0.006390642 -0.006390642 -0.012781283 0.000000000
dx^2-y^2 0 -0.005055774 -0.005055774 -0.010111549 0.000000000
dxy 0 -0.005436133 -0.005436133 -0.010872267 0.000000000
dxz 0 -0.006930509 -0.006930509 -0.013861018 0.000000000
dyz 0 -0.006925393 -0.006925393 -0.013850787 0.000000000
sum over m -0.030738452 -0.030738452 -0.061476904 0.000000000
sum over m+mul -0.030738452 -0.030738452 -0.061476904 0.000000000
808 O Up spin Down spin Sum Diff
multiple
s 0 0.893852153 0.893852153 1.787704305 0.000000000
sum over m 0.893852153 0.893852153 1.787704305 0.000000000
s 1 -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m+mul 0.890809938 0.890809938 1.781619875 0.000000000
px 0 0.786926851 0.786926851 1.573853702 0.000000000
py 0 0.786865166 0.786865166 1.573730332 0.000000000
pz 0 0.779871065 0.779871065 1.559742130 0.000000000
sum over m 2.353663082 2.353663082 4.707326164 0.000000000
px 1 -0.008731742 -0.008731742 -0.017463485 0.000000000
py 1 -0.008735735 -0.008735735 -0.017471470 0.000000000
pz 1 -0.006466435 -0.006466435 -0.012932870 0.000000000
sum over m -0.023933912 -0.023933912 -0.047867824 0.000000000
sum over m+mul 2.329729170 2.329729170 4.659458340 0.000000000
d3z^2-r^2 0 -0.006389061 -0.006389061 -0.012778123 0.000000000
dx^2-y^2 0 -0.005061139 -0.005061139 -0.010122278 0.000000000
dxy 0 -0.005432262 -0.005432262 -0.010864524 0.000000000
dxz 0 -0.006934030 -0.006934030 -0.013868061 0.000000000
dyz 0 -0.006934207 -0.006934207 -0.013868413 0.000000000
sum over m -0.030750700 -0.030750700 -0.061501399 0.000000000
sum over m+mul -0.030750700 -0.030750700 -0.061501399 0.000000000
809 O Up spin Down spin Sum Diff
multiple
s 0 0.893893680 0.893893680 1.787787361 0.000000000
sum over m 0.893893680 0.893893680 1.787787361 0.000000000
s 1 -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m+mul 0.890851350 0.890851350 1.781702699 0.000000000
px 0 0.787088609 0.787088609 1.574177217 0.000000000
py 0 0.786824065 0.786824065 1.573648131 0.000000000
pz 0 0.779803270 0.779803270 1.559606540 0.000000000
sum over m 2.353715944 2.353715944 4.707431888 0.000000000
px 1 -0.008743572 -0.008743572 -0.017487144 0.000000000
py 1 -0.008736146 -0.008736146 -0.017472292 0.000000000
pz 1 -0.006463076 -0.006463076 -0.012926152 0.000000000
sum over m -0.023942794 -0.023942794 -0.047885589 0.000000000
sum over m+mul 2.329773150 2.329773150 4.659546299 0.000000000
d3z^2-r^2 0 -0.006390493 -0.006390493 -0.012780986 0.000000000
dx^2-y^2 0 -0.005059161 -0.005059161 -0.010118322 0.000000000
dxy 0 -0.005434201 -0.005434201 -0.010868403 0.000000000
dxz 0 -0.006929332 -0.006929332 -0.013858665 0.000000000
dyz 0 -0.006933940 -0.006933940 -0.013867881 0.000000000
sum over m -0.030747128 -0.030747128 -0.061494256 0.000000000
sum over m+mul -0.030747128 -0.030747128 -0.061494256 0.000000000
810 O Up spin Down spin Sum Diff
multiple
s 0 0.893907478 0.893907478 1.787814956 0.000000000
sum over m 0.893907478 0.893907478 1.787814956 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m+mul 0.890865303 0.890865303 1.781730606 0.000000000
px 0 0.786958584 0.786958584 1.573917168 0.000000000
py 0 0.787102518 0.787102518 1.574205035 0.000000000
pz 0 0.779724467 0.779724467 1.559448933 0.000000000
sum over m 2.353785568 2.353785568 4.707571136 0.000000000
px 1 -0.008733424 -0.008733424 -0.017466849 0.000000000
py 1 -0.008740799 -0.008740799 -0.017481598 0.000000000
pz 1 -0.006457641 -0.006457641 -0.012915283 0.000000000
sum over m -0.023931865 -0.023931865 -0.047863729 0.000000000
sum over m+mul 2.329853703 2.329853703 4.659707407 0.000000000
d3z^2-r^2 0 -0.006390204 -0.006390204 -0.012780408 0.000000000
dx^2-y^2 0 -0.005055858 -0.005055858 -0.010111717 0.000000000
dxy 0 -0.005435946 -0.005435946 -0.010871892 0.000000000
dxz 0 -0.006929974 -0.006929974 -0.013859947 0.000000000
dyz 0 -0.006924124 -0.006924124 -0.013848248 0.000000000
sum over m -0.030736106 -0.030736106 -0.061472212 0.000000000
sum over m+mul -0.030736106 -0.030736106 -0.061472212 0.000000000
811 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742384 1.000742384 2.001484767 0.000000000
sum over m 1.000742384 1.000742384 2.001484767 0.000000000
s 1 0.207419860 0.207419860 0.414839720 0.000000000
sum over m 0.207419860 0.207419860 0.414839720 0.000000000
s 2 0.014726842 0.014726842 0.029453685 0.000000000
sum over m 0.014726842 0.014726842 0.029453685 0.000000000
sum over m+mul 1.222889086 1.222889086 2.445778172 0.000000000
px 0 1.006382190 1.006382190 2.012764379 0.000000000
py 0 1.006389813 1.006389813 2.012779625 0.000000000
pz 0 1.006209268 1.006209268 2.012418536 0.000000000
sum over m 3.018981270 3.018981270 6.037962541 0.000000000
px 1 0.065407996 0.065407996 0.130815992 0.000000000
py 1 0.065419256 0.065419256 0.130838511 0.000000000
pz 1 0.040404373 0.040404373 0.080808746 0.000000000
sum over m 0.171231625 0.171231625 0.342463250 0.000000000
sum over m+mul 3.190212895 3.190212895 6.380425790 0.000000000
d3z^2-r^2 0 0.196292287 0.196292287 0.392584573 0.000000000
dx^2-y^2 0 0.201528144 0.201528144 0.403056288 0.000000000
dxy 0 0.250900631 0.250900631 0.501801262 0.000000000
dxz 0 0.268523414 0.268523414 0.537046828 0.000000000
dyz 0 0.268518199 0.268518199 0.537036397 0.000000000
sum over m 1.185762674 1.185762674 2.371525347 0.000000000
d3z^2-r^2 1 0.003481533 0.003481533 0.006963067 0.000000000
dx^2-y^2 1 -0.004468526 -0.004468526 -0.008937052 0.000000000
dxy 1 0.015338662 0.015338662 0.030677323 0.000000000
dxz 1 0.003491426 0.003491426 0.006982852 0.000000000
dyz 1 0.003492549 0.003492549 0.006985098 0.000000000
sum over m 0.021335644 0.021335644 0.042671289 0.000000000
sum over m+mul 1.207098318 1.207098318 2.414196636 0.000000000
812 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000756856 1.000756856 2.001513712 0.000000000
sum over m 1.000756856 1.000756856 2.001513712 0.000000000
s 1 0.207409960 0.207409960 0.414819921 0.000000000
sum over m 0.207409960 0.207409960 0.414819921 0.000000000
s 2 0.014725999 0.014725999 0.029451998 0.000000000
sum over m 0.014725999 0.014725999 0.029451998 0.000000000
sum over m+mul 1.222892816 1.222892816 2.445785631 0.000000000
px 0 1.006373475 1.006373475 2.012746950 0.000000000
py 0 1.006375870 1.006375870 2.012751739 0.000000000
pz 0 1.006214911 1.006214911 2.012429822 0.000000000
sum over m 3.018964256 3.018964256 6.037928511 0.000000000
px 1 0.065418425 0.065418425 0.130836850 0.000000000
py 1 0.065439993 0.065439993 0.130879987 0.000000000
pz 1 0.040380762 0.040380762 0.080761523 0.000000000
sum over m 0.171239180 0.171239180 0.342478360 0.000000000
sum over m+mul 3.190203436 3.190203436 6.380406871 0.000000000
d3z^2-r^2 0 0.196294767 0.196294767 0.392589534 0.000000000
dx^2-y^2 0 0.201520194 0.201520194 0.403040388 0.000000000
dxy 0 0.250918861 0.250918861 0.501837721 0.000000000
dxz 0 0.268520643 0.268520643 0.537041287 0.000000000
dyz 0 0.268505238 0.268505238 0.537010475 0.000000000
sum over m 1.185759703 1.185759703 2.371519406 0.000000000
d3z^2-r^2 1 0.003478828 0.003478828 0.006957656 0.000000000
dx^2-y^2 1 -0.004472687 -0.004472687 -0.008945374 0.000000000
dxy 1 0.015340656 0.015340656 0.030681312 0.000000000
dxz 1 0.003489489 0.003489489 0.006978978 0.000000000
dyz 1 0.003491007 0.003491007 0.006982015 0.000000000
sum over m 0.021327293 0.021327293 0.042654586 0.000000000
sum over m+mul 1.207086996 1.207086996 2.414173992 0.000000000
813 O Up spin Down spin Sum Diff
multiple
s 0 0.893912940 0.893912940 1.787825881 0.000000000
sum over m 0.893912940 0.893912940 1.787825881 0.000000000
s 1 -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m+mul 0.890870277 0.890870277 1.781740554 0.000000000
px 0 0.786955523 0.786955523 1.573911047 0.000000000
py 0 0.787099819 0.787099819 1.574199637 0.000000000
pz 0 0.779726273 0.779726273 1.559452546 0.000000000
sum over m 2.353781615 2.353781615 4.707563230 0.000000000
px 1 -0.008737472 -0.008737472 -0.017474944 0.000000000
py 1 -0.008741820 -0.008741820 -0.017483640 0.000000000
pz 1 -0.006459855 -0.006459855 -0.012919711 0.000000000
sum over m -0.023939147 -0.023939147 -0.047878295 0.000000000
sum over m+mul 2.329842468 2.329842468 4.659684935 0.000000000
d3z^2-r^2 0 -0.006390642 -0.006390642 -0.012781283 0.000000000
dx^2-y^2 0 -0.005055774 -0.005055774 -0.010111549 0.000000000
dxy 0 -0.005436133 -0.005436133 -0.010872267 0.000000000
dxz 0 -0.006930509 -0.006930509 -0.013861018 0.000000000
dyz 0 -0.006925393 -0.006925393 -0.013850787 0.000000000
sum over m -0.030738452 -0.030738452 -0.061476904 0.000000000
sum over m+mul -0.030738452 -0.030738452 -0.061476904 0.000000000
814 O Up spin Down spin Sum Diff
multiple
s 0 0.893852153 0.893852153 1.787704305 0.000000000
sum over m 0.893852153 0.893852153 1.787704305 0.000000000
s 1 -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m+mul 0.890809938 0.890809938 1.781619875 0.000000000
px 0 0.786926851 0.786926851 1.573853701 0.000000000
py 0 0.786865166 0.786865166 1.573730332 0.000000000
pz 0 0.779871065 0.779871065 1.559742131 0.000000000
sum over m 2.353663082 2.353663082 4.707326164 0.000000000
px 1 -0.008731742 -0.008731742 -0.017463485 0.000000000
py 1 -0.008735735 -0.008735735 -0.017471470 0.000000000
pz 1 -0.006466435 -0.006466435 -0.012932870 0.000000000
sum over m -0.023933912 -0.023933912 -0.047867825 0.000000000
sum over m+mul 2.329729170 2.329729170 4.659458339 0.000000000
d3z^2-r^2 0 -0.006389061 -0.006389061 -0.012778123 0.000000000
dx^2-y^2 0 -0.005061139 -0.005061139 -0.010122278 0.000000000
dxy 0 -0.005432262 -0.005432262 -0.010864524 0.000000000
dxz 0 -0.006934030 -0.006934030 -0.013868061 0.000000000
dyz 0 -0.006934207 -0.006934207 -0.013868413 0.000000000
sum over m -0.030750700 -0.030750700 -0.061501399 0.000000000
sum over m+mul -0.030750700 -0.030750700 -0.061501399 0.000000000
815 O Up spin Down spin Sum Diff
multiple
s 0 0.893893680 0.893893680 1.787787361 0.000000000
sum over m 0.893893680 0.893893680 1.787787361 0.000000000
s 1 -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m+mul 0.890851350 0.890851350 1.781702699 0.000000000
px 0 0.787088609 0.787088609 1.574177217 0.000000000
py 0 0.786824066 0.786824066 1.573648131 0.000000000
pz 0 0.779803270 0.779803270 1.559606540 0.000000000
sum over m 2.353715944 2.353715944 4.707431888 0.000000000
px 1 -0.008743572 -0.008743572 -0.017487144 0.000000000
py 1 -0.008736146 -0.008736146 -0.017472292 0.000000000
pz 1 -0.006463076 -0.006463076 -0.012926152 0.000000000
sum over m -0.023942794 -0.023942794 -0.047885589 0.000000000
sum over m+mul 2.329773150 2.329773150 4.659546300 0.000000000
d3z^2-r^2 0 -0.006390493 -0.006390493 -0.012780986 0.000000000
dx^2-y^2 0 -0.005059161 -0.005059161 -0.010118322 0.000000000
dxy 0 -0.005434201 -0.005434201 -0.010868403 0.000000000
dxz 0 -0.006929332 -0.006929332 -0.013858665 0.000000000
dyz 0 -0.006933940 -0.006933940 -0.013867881 0.000000000
sum over m -0.030747128 -0.030747128 -0.061494256 0.000000000
sum over m+mul -0.030747128 -0.030747128 -0.061494256 0.000000000
816 O Up spin Down spin Sum Diff
multiple
s 0 0.893907478 0.893907478 1.787814956 0.000000000
sum over m 0.893907478 0.893907478 1.787814956 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m+mul 0.890865303 0.890865303 1.781730606 0.000000000
px 0 0.786958584 0.786958584 1.573917168 0.000000000
py 0 0.787102517 0.787102517 1.574205035 0.000000000
pz 0 0.779724466 0.779724466 1.559448933 0.000000000
sum over m 2.353785568 2.353785568 4.707571135 0.000000000
px 1 -0.008733424 -0.008733424 -0.017466849 0.000000000
py 1 -0.008740799 -0.008740799 -0.017481598 0.000000000
pz 1 -0.006457641 -0.006457641 -0.012915283 0.000000000
sum over m -0.023931865 -0.023931865 -0.047863729 0.000000000
sum over m+mul 2.329853703 2.329853703 4.659707406 0.000000000
d3z^2-r^2 0 -0.006390204 -0.006390204 -0.012780408 0.000000000
dx^2-y^2 0 -0.005055858 -0.005055858 -0.010111717 0.000000000
dxy 0 -0.005435946 -0.005435946 -0.010871892 0.000000000
dxz 0 -0.006929974 -0.006929974 -0.013859947 0.000000000
dyz 0 -0.006924124 -0.006924124 -0.013848248 0.000000000
sum over m -0.030736106 -0.030736106 -0.061472212 0.000000000
sum over m+mul -0.030736106 -0.030736106 -0.061472212 0.000000000
817 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742384 1.000742384 2.001484767 0.000000000
sum over m 1.000742384 1.000742384 2.001484767 0.000000000
s 1 0.207419860 0.207419860 0.414839720 0.000000000
sum over m 0.207419860 0.207419860 0.414839720 0.000000000
s 2 0.014726842 0.014726842 0.029453685 0.000000000
sum over m 0.014726842 0.014726842 0.029453685 0.000000000
sum over m+mul 1.222889086 1.222889086 2.445778172 0.000000000
px 0 1.006382190 1.006382190 2.012764379 0.000000000
py 0 1.006389813 1.006389813 2.012779625 0.000000000
pz 0 1.006209268 1.006209268 2.012418537 0.000000000
sum over m 3.018981271 3.018981271 6.037962541 0.000000000
px 1 0.065407996 0.065407996 0.130815992 0.000000000
py 1 0.065419256 0.065419256 0.130838512 0.000000000
pz 1 0.040404373 0.040404373 0.080808745 0.000000000
sum over m 0.171231625 0.171231625 0.342463249 0.000000000
sum over m+mul 3.190212895 3.190212895 6.380425791 0.000000000
d3z^2-r^2 0 0.196292286 0.196292286 0.392584573 0.000000000
dx^2-y^2 0 0.201528144 0.201528144 0.403056287 0.000000000
dxy 0 0.250900631 0.250900631 0.501801262 0.000000000
dxz 0 0.268523414 0.268523414 0.537046828 0.000000000
dyz 0 0.268518199 0.268518199 0.537036398 0.000000000
sum over m 1.185762674 1.185762674 2.371525348 0.000000000
d3z^2-r^2 1 0.003481533 0.003481533 0.006963067 0.000000000
dx^2-y^2 1 -0.004468526 -0.004468526 -0.008937052 0.000000000
dxy 1 0.015338662 0.015338662 0.030677323 0.000000000
dxz 1 0.003491426 0.003491426 0.006982852 0.000000000
dyz 1 0.003492549 0.003492549 0.006985098 0.000000000
sum over m 0.021335644 0.021335644 0.042671289 0.000000000
sum over m+mul 1.207098318 1.207098318 2.414196636 0.000000000
818 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000756856 1.000756856 2.001513713 0.000000000
sum over m 1.000756856 1.000756856 2.001513713 0.000000000
s 1 0.207409960 0.207409960 0.414819921 0.000000000
sum over m 0.207409960 0.207409960 0.414819921 0.000000000
s 2 0.014725999 0.014725999 0.029451998 0.000000000
sum over m 0.014725999 0.014725999 0.029451998 0.000000000
sum over m+mul 1.222892816 1.222892816 2.445785632 0.000000000
px 0 1.006373475 1.006373475 2.012746950 0.000000000
py 0 1.006375870 1.006375870 2.012751739 0.000000000
pz 0 1.006214911 1.006214911 2.012429822 0.000000000
sum over m 3.018964256 3.018964256 6.037928511 0.000000000
px 1 0.065418425 0.065418425 0.130836850 0.000000000
py 1 0.065439994 0.065439994 0.130879987 0.000000000
pz 1 0.040380762 0.040380762 0.080761523 0.000000000
sum over m 0.171239180 0.171239180 0.342478361 0.000000000
sum over m+mul 3.190203436 3.190203436 6.380406872 0.000000000
d3z^2-r^2 0 0.196294767 0.196294767 0.392589535 0.000000000
dx^2-y^2 0 0.201520194 0.201520194 0.403040388 0.000000000
dxy 0 0.250918861 0.250918861 0.501837721 0.000000000
dxz 0 0.268520644 0.268520644 0.537041288 0.000000000
dyz 0 0.268505238 0.268505238 0.537010475 0.000000000
sum over m 1.185759703 1.185759703 2.371519407 0.000000000
d3z^2-r^2 1 0.003478828 0.003478828 0.006957656 0.000000000
dx^2-y^2 1 -0.004472687 -0.004472687 -0.008945374 0.000000000
dxy 1 0.015340656 0.015340656 0.030681312 0.000000000
dxz 1 0.003489489 0.003489489 0.006978978 0.000000000
dyz 1 0.003491007 0.003491007 0.006982015 0.000000000
sum over m 0.021327293 0.021327293 0.042654586 0.000000000
sum over m+mul 1.207086997 1.207086997 2.414173993 0.000000000
819 O Up spin Down spin Sum Diff
multiple
s 0 0.893912940 0.893912940 1.787825881 0.000000000
sum over m 0.893912940 0.893912940 1.787825881 0.000000000
s 1 -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m+mul 0.890870277 0.890870277 1.781740554 0.000000000
px 0 0.786955523 0.786955523 1.573911046 0.000000000
py 0 0.787099819 0.787099819 1.574199637 0.000000000
pz 0 0.779726273 0.779726273 1.559452547 0.000000000
sum over m 2.353781615 2.353781615 4.707563231 0.000000000
px 1 -0.008737472 -0.008737472 -0.017474945 0.000000000
py 1 -0.008741820 -0.008741820 -0.017483640 0.000000000
pz 1 -0.006459855 -0.006459855 -0.012919711 0.000000000
sum over m -0.023939147 -0.023939147 -0.047878295 0.000000000
sum over m+mul 2.329842468 2.329842468 4.659684936 0.000000000
d3z^2-r^2 0 -0.006390642 -0.006390642 -0.012781283 0.000000000
dx^2-y^2 0 -0.005055774 -0.005055774 -0.010111549 0.000000000
dxy 0 -0.005436133 -0.005436133 -0.010872267 0.000000000
dxz 0 -0.006930509 -0.006930509 -0.013861018 0.000000000
dyz 0 -0.006925393 -0.006925393 -0.013850787 0.000000000
sum over m -0.030738452 -0.030738452 -0.061476904 0.000000000
sum over m+mul -0.030738452 -0.030738452 -0.061476904 0.000000000
820 O Up spin Down spin Sum Diff
multiple
s 0 0.893852153 0.893852153 1.787704305 0.000000000
sum over m 0.893852153 0.893852153 1.787704305 0.000000000
s 1 -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m+mul 0.890809938 0.890809938 1.781619875 0.000000000
px 0 0.786926851 0.786926851 1.573853701 0.000000000
py 0 0.786865166 0.786865166 1.573730332 0.000000000
pz 0 0.779871065 0.779871065 1.559742131 0.000000000
sum over m 2.353663082 2.353663082 4.707326163 0.000000000
px 1 -0.008731742 -0.008731742 -0.017463485 0.000000000
py 1 -0.008735735 -0.008735735 -0.017471470 0.000000000
pz 1 -0.006466435 -0.006466435 -0.012932870 0.000000000
sum over m -0.023933912 -0.023933912 -0.047867825 0.000000000
sum over m+mul 2.329729169 2.329729169 4.659458339 0.000000000
d3z^2-r^2 0 -0.006389061 -0.006389061 -0.012778123 0.000000000
dx^2-y^2 0 -0.005061139 -0.005061139 -0.010122278 0.000000000
dxy 0 -0.005432262 -0.005432262 -0.010864524 0.000000000
dxz 0 -0.006934030 -0.006934030 -0.013868061 0.000000000
dyz 0 -0.006934207 -0.006934207 -0.013868413 0.000000000
sum over m -0.030750700 -0.030750700 -0.061501399 0.000000000
sum over m+mul -0.030750700 -0.030750700 -0.061501399 0.000000000
821 O Up spin Down spin Sum Diff
multiple
s 0 0.893893680 0.893893680 1.787787361 0.000000000
sum over m 0.893893680 0.893893680 1.787787361 0.000000000
s 1 -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m+mul 0.890851350 0.890851350 1.781702699 0.000000000
px 0 0.787088608 0.787088608 1.574177217 0.000000000
py 0 0.786824065 0.786824065 1.573648131 0.000000000
pz 0 0.779803270 0.779803270 1.559606541 0.000000000
sum over m 2.353715944 2.353715944 4.707431888 0.000000000
px 1 -0.008743572 -0.008743572 -0.017487144 0.000000000
py 1 -0.008736146 -0.008736146 -0.017472292 0.000000000
pz 1 -0.006463076 -0.006463076 -0.012926152 0.000000000
sum over m -0.023942794 -0.023942794 -0.047885589 0.000000000
sum over m+mul 2.329773150 2.329773150 4.659546299 0.000000000
d3z^2-r^2 0 -0.006390493 -0.006390493 -0.012780986 0.000000000
dx^2-y^2 0 -0.005059161 -0.005059161 -0.010118322 0.000000000
dxy 0 -0.005434201 -0.005434201 -0.010868403 0.000000000
dxz 0 -0.006929332 -0.006929332 -0.013858665 0.000000000
dyz 0 -0.006933940 -0.006933940 -0.013867881 0.000000000
sum over m -0.030747128 -0.030747128 -0.061494256 0.000000000
sum over m+mul -0.030747128 -0.030747128 -0.061494256 0.000000000
822 O Up spin Down spin Sum Diff
multiple
s 0 0.893907478 0.893907478 1.787814956 0.000000000
sum over m 0.893907478 0.893907478 1.787814956 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m+mul 0.890865303 0.890865303 1.781730606 0.000000000
px 0 0.786958584 0.786958584 1.573917167 0.000000000
py 0 0.787102518 0.787102518 1.574205035 0.000000000
pz 0 0.779724466 0.779724466 1.559448933 0.000000000
sum over m 2.353785568 2.353785568 4.707571135 0.000000000
px 1 -0.008733424 -0.008733424 -0.017466849 0.000000000
py 1 -0.008740799 -0.008740799 -0.017481598 0.000000000
pz 1 -0.006457641 -0.006457641 -0.012915283 0.000000000
sum over m -0.023931865 -0.023931865 -0.047863729 0.000000000
sum over m+mul 2.329853703 2.329853703 4.659707406 0.000000000
d3z^2-r^2 0 -0.006390204 -0.006390204 -0.012780408 0.000000000
dx^2-y^2 0 -0.005055858 -0.005055858 -0.010111717 0.000000000
dxy 0 -0.005435946 -0.005435946 -0.010871892 0.000000000
dxz 0 -0.006929974 -0.006929974 -0.013859947 0.000000000
dyz 0 -0.006924124 -0.006924124 -0.013848248 0.000000000
sum over m -0.030736106 -0.030736106 -0.061472212 0.000000000
sum over m+mul -0.030736106 -0.030736106 -0.061472212 0.000000000
823 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742384 1.000742384 2.001484767 0.000000000
sum over m 1.000742384 1.000742384 2.001484767 0.000000000
s 1 0.207419860 0.207419860 0.414839720 0.000000000
sum over m 0.207419860 0.207419860 0.414839720 0.000000000
s 2 0.014726842 0.014726842 0.029453685 0.000000000
sum over m 0.014726842 0.014726842 0.029453685 0.000000000
sum over m+mul 1.222889086 1.222889086 2.445778172 0.000000000
px 0 1.006382189 1.006382189 2.012764379 0.000000000
py 0 1.006389813 1.006389813 2.012779625 0.000000000
pz 0 1.006209268 1.006209268 2.012418536 0.000000000
sum over m 3.018981270 3.018981270 6.037962540 0.000000000
px 1 0.065407996 0.065407996 0.130815992 0.000000000
py 1 0.065419256 0.065419256 0.130838512 0.000000000
pz 1 0.040404373 0.040404373 0.080808746 0.000000000
sum over m 0.171231625 0.171231625 0.342463250 0.000000000
sum over m+mul 3.190212895 3.190212895 6.380425791 0.000000000
d3z^2-r^2 0 0.196292287 0.196292287 0.392584573 0.000000000
dx^2-y^2 0 0.201528143 0.201528143 0.403056287 0.000000000
dxy 0 0.250900631 0.250900631 0.501801262 0.000000000
dxz 0 0.268523414 0.268523414 0.537046828 0.000000000
dyz 0 0.268518199 0.268518199 0.537036398 0.000000000
sum over m 1.185762674 1.185762674 2.371525348 0.000000000
d3z^2-r^2 1 0.003481533 0.003481533 0.006963067 0.000000000
dx^2-y^2 1 -0.004468526 -0.004468526 -0.008937052 0.000000000
dxy 1 0.015338662 0.015338662 0.030677323 0.000000000
dxz 1 0.003491426 0.003491426 0.006982852 0.000000000
dyz 1 0.003492549 0.003492549 0.006985098 0.000000000
sum over m 0.021335644 0.021335644 0.042671289 0.000000000
sum over m+mul 1.207098318 1.207098318 2.414196636 0.000000000
824 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000756856 1.000756856 2.001513712 0.000000000
sum over m 1.000756856 1.000756856 2.001513712 0.000000000
s 1 0.207409960 0.207409960 0.414819920 0.000000000
sum over m 0.207409960 0.207409960 0.414819920 0.000000000
s 2 0.014725999 0.014725999 0.029451998 0.000000000
sum over m 0.014725999 0.014725999 0.029451998 0.000000000
sum over m+mul 1.222892815 1.222892815 2.445785631 0.000000000
px 0 1.006373475 1.006373475 2.012746950 0.000000000
py 0 1.006375870 1.006375870 2.012751739 0.000000000
pz 0 1.006214911 1.006214911 2.012429822 0.000000000
sum over m 3.018964255 3.018964255 6.037928511 0.000000000
px 1 0.065418425 0.065418425 0.130836850 0.000000000
py 1 0.065439993 0.065439993 0.130879987 0.000000000
pz 1 0.040380762 0.040380762 0.080761523 0.000000000
sum over m 0.171239180 0.171239180 0.342478360 0.000000000
sum over m+mul 3.190203435 3.190203435 6.380406871 0.000000000
d3z^2-r^2 0 0.196294767 0.196294767 0.392589534 0.000000000
dx^2-y^2 0 0.201520194 0.201520194 0.403040388 0.000000000
dxy 0 0.250918861 0.250918861 0.501837721 0.000000000
dxz 0 0.268520644 0.268520644 0.537041288 0.000000000
dyz 0 0.268505238 0.268505238 0.537010475 0.000000000
sum over m 1.185759703 1.185759703 2.371519407 0.000000000
d3z^2-r^2 1 0.003478828 0.003478828 0.006957656 0.000000000
dx^2-y^2 1 -0.004472687 -0.004472687 -0.008945374 0.000000000
dxy 1 0.015340656 0.015340656 0.030681312 0.000000000
dxz 1 0.003489489 0.003489489 0.006978978 0.000000000
dyz 1 0.003491007 0.003491007 0.006982015 0.000000000
sum over m 0.021327293 0.021327293 0.042654586 0.000000000
sum over m+mul 1.207086997 1.207086997 2.414173993 0.000000000
825 O Up spin Down spin Sum Diff
multiple
s 0 0.893912940 0.893912940 1.787825881 0.000000000
sum over m 0.893912940 0.893912940 1.787825881 0.000000000
s 1 -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m+mul 0.890870277 0.890870277 1.781740554 0.000000000
px 0 0.786955523 0.786955523 1.573911046 0.000000000
py 0 0.787099819 0.787099819 1.574199637 0.000000000
pz 0 0.779726273 0.779726273 1.559452547 0.000000000
sum over m 2.353781615 2.353781615 4.707563230 0.000000000
px 1 -0.008737472 -0.008737472 -0.017474944 0.000000000
py 1 -0.008741820 -0.008741820 -0.017483639 0.000000000
pz 1 -0.006459855 -0.006459855 -0.012919711 0.000000000
sum over m -0.023939147 -0.023939147 -0.047878295 0.000000000
sum over m+mul 2.329842468 2.329842468 4.659684936 0.000000000
d3z^2-r^2 0 -0.006390642 -0.006390642 -0.012781283 0.000000000
dx^2-y^2 0 -0.005055774 -0.005055774 -0.010111549 0.000000000
dxy 0 -0.005436133 -0.005436133 -0.010872267 0.000000000
dxz 0 -0.006930509 -0.006930509 -0.013861018 0.000000000
dyz 0 -0.006925393 -0.006925393 -0.013850787 0.000000000
sum over m -0.030738452 -0.030738452 -0.061476903 0.000000000
sum over m+mul -0.030738452 -0.030738452 -0.061476903 0.000000000
826 O Up spin Down spin Sum Diff
multiple
s 0 0.893852153 0.893852153 1.787704305 0.000000000
sum over m 0.893852153 0.893852153 1.787704305 0.000000000
s 1 -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m+mul 0.890809938 0.890809938 1.781619875 0.000000000
px 0 0.786926851 0.786926851 1.573853701 0.000000000
py 0 0.786865166 0.786865166 1.573730332 0.000000000
pz 0 0.779871065 0.779871065 1.559742130 0.000000000
sum over m 2.353663082 2.353663082 4.707326163 0.000000000
px 1 -0.008731742 -0.008731742 -0.017463485 0.000000000
py 1 -0.008735735 -0.008735735 -0.017471470 0.000000000
pz 1 -0.006466435 -0.006466435 -0.012932870 0.000000000
sum over m -0.023933912 -0.023933912 -0.047867825 0.000000000
sum over m+mul 2.329729169 2.329729169 4.659458339 0.000000000
d3z^2-r^2 0 -0.006389061 -0.006389061 -0.012778123 0.000000000
dx^2-y^2 0 -0.005061139 -0.005061139 -0.010122278 0.000000000
dxy 0 -0.005432262 -0.005432262 -0.010864524 0.000000000
dxz 0 -0.006934030 -0.006934030 -0.013868061 0.000000000
dyz 0 -0.006934207 -0.006934207 -0.013868413 0.000000000
sum over m -0.030750700 -0.030750700 -0.061501399 0.000000000
sum over m+mul -0.030750700 -0.030750700 -0.061501399 0.000000000
827 O Up spin Down spin Sum Diff
multiple
s 0 0.893893680 0.893893680 1.787787361 0.000000000
sum over m 0.893893680 0.893893680 1.787787361 0.000000000
s 1 -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m+mul 0.890851350 0.890851350 1.781702699 0.000000000
px 0 0.787088608 0.787088608 1.574177217 0.000000000
py 0 0.786824065 0.786824065 1.573648131 0.000000000
pz 0 0.779803270 0.779803270 1.559606540 0.000000000
sum over m 2.353715944 2.353715944 4.707431888 0.000000000
px 1 -0.008743572 -0.008743572 -0.017487144 0.000000000
py 1 -0.008736146 -0.008736146 -0.017472292 0.000000000
pz 1 -0.006463076 -0.006463076 -0.012926152 0.000000000
sum over m -0.023942794 -0.023942794 -0.047885589 0.000000000
sum over m+mul 2.329773149 2.329773149 4.659546299 0.000000000
d3z^2-r^2 0 -0.006390493 -0.006390493 -0.012780986 0.000000000
dx^2-y^2 0 -0.005059161 -0.005059161 -0.010118322 0.000000000
dxy 0 -0.005434201 -0.005434201 -0.010868403 0.000000000
dxz 0 -0.006929332 -0.006929332 -0.013858665 0.000000000
dyz 0 -0.006933940 -0.006933940 -0.013867881 0.000000000
sum over m -0.030747128 -0.030747128 -0.061494256 0.000000000
sum over m+mul -0.030747128 -0.030747128 -0.061494256 0.000000000
828 O Up spin Down spin Sum Diff
multiple
s 0 0.893907478 0.893907478 1.787814956 0.000000000
sum over m 0.893907478 0.893907478 1.787814956 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m+mul 0.890865303 0.890865303 1.781730606 0.000000000
px 0 0.786958584 0.786958584 1.573917168 0.000000000
py 0 0.787102518 0.787102518 1.574205035 0.000000000
pz 0 0.779724466 0.779724466 1.559448933 0.000000000
sum over m 2.353785568 2.353785568 4.707571136 0.000000000
px 1 -0.008733424 -0.008733424 -0.017466849 0.000000000
py 1 -0.008740799 -0.008740799 -0.017481598 0.000000000
pz 1 -0.006457641 -0.006457641 -0.012915283 0.000000000
sum over m -0.023931865 -0.023931865 -0.047863729 0.000000000
sum over m+mul 2.329853703 2.329853703 4.659707407 0.000000000
d3z^2-r^2 0 -0.006390204 -0.006390204 -0.012780408 0.000000000
dx^2-y^2 0 -0.005055858 -0.005055858 -0.010111717 0.000000000
dxy 0 -0.005435946 -0.005435946 -0.010871892 0.000000000
dxz 0 -0.006929974 -0.006929974 -0.013859947 0.000000000
dyz 0 -0.006924124 -0.006924124 -0.013848248 0.000000000
sum over m -0.030736106 -0.030736106 -0.061472213 0.000000000
sum over m+mul -0.030736106 -0.030736106 -0.061472213 0.000000000
829 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742384 1.000742384 2.001484767 0.000000000
sum over m 1.000742384 1.000742384 2.001484767 0.000000000
s 1 0.207419860 0.207419860 0.414839720 0.000000000
sum over m 0.207419860 0.207419860 0.414839720 0.000000000
s 2 0.014726842 0.014726842 0.029453685 0.000000000
sum over m 0.014726842 0.014726842 0.029453685 0.000000000
sum over m+mul 1.222889086 1.222889086 2.445778172 0.000000000
px 0 1.006382190 1.006382190 2.012764379 0.000000000
py 0 1.006389813 1.006389813 2.012779625 0.000000000
pz 0 1.006209268 1.006209268 2.012418536 0.000000000
sum over m 3.018981270 3.018981270 6.037962541 0.000000000
px 1 0.065407996 0.065407996 0.130815992 0.000000000
py 1 0.065419256 0.065419256 0.130838512 0.000000000
pz 1 0.040404373 0.040404373 0.080808746 0.000000000
sum over m 0.171231625 0.171231625 0.342463250 0.000000000
sum over m+mul 3.190212895 3.190212895 6.380425790 0.000000000
d3z^2-r^2 0 0.196292287 0.196292287 0.392584573 0.000000000
dx^2-y^2 0 0.201528144 0.201528144 0.403056287 0.000000000
dxy 0 0.250900631 0.250900631 0.501801262 0.000000000
dxz 0 0.268523414 0.268523414 0.537046828 0.000000000
dyz 0 0.268518199 0.268518199 0.537036397 0.000000000
sum over m 1.185762674 1.185762674 2.371525347 0.000000000
d3z^2-r^2 1 0.003481533 0.003481533 0.006963067 0.000000000
dx^2-y^2 1 -0.004468526 -0.004468526 -0.008937052 0.000000000
dxy 1 0.015338662 0.015338662 0.030677323 0.000000000
dxz 1 0.003491426 0.003491426 0.006982852 0.000000000
dyz 1 0.003492549 0.003492549 0.006985098 0.000000000
sum over m 0.021335644 0.021335644 0.042671289 0.000000000
sum over m+mul 1.207098318 1.207098318 2.414196636 0.000000000
830 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000756856 1.000756856 2.001513712 0.000000000
sum over m 1.000756856 1.000756856 2.001513712 0.000000000
s 1 0.207409960 0.207409960 0.414819920 0.000000000
sum over m 0.207409960 0.207409960 0.414819920 0.000000000
s 2 0.014725999 0.014725999 0.029451998 0.000000000
sum over m 0.014725999 0.014725999 0.029451998 0.000000000
sum over m+mul 1.222892815 1.222892815 2.445785631 0.000000000
px 0 1.006373475 1.006373475 2.012746950 0.000000000
py 0 1.006375870 1.006375870 2.012751739 0.000000000
pz 0 1.006214911 1.006214911 2.012429822 0.000000000
sum over m 3.018964256 3.018964256 6.037928511 0.000000000
px 1 0.065418425 0.065418425 0.130836850 0.000000000
py 1 0.065439993 0.065439993 0.130879987 0.000000000
pz 1 0.040380762 0.040380762 0.080761523 0.000000000
sum over m 0.171239180 0.171239180 0.342478360 0.000000000
sum over m+mul 3.190203436 3.190203436 6.380406872 0.000000000
d3z^2-r^2 0 0.196294767 0.196294767 0.392589534 0.000000000
dx^2-y^2 0 0.201520194 0.201520194 0.403040388 0.000000000
dxy 0 0.250918861 0.250918861 0.501837721 0.000000000
dxz 0 0.268520643 0.268520643 0.537041287 0.000000000
dyz 0 0.268505238 0.268505238 0.537010476 0.000000000
sum over m 1.185759703 1.185759703 2.371519407 0.000000000
d3z^2-r^2 1 0.003478828 0.003478828 0.006957656 0.000000000
dx^2-y^2 1 -0.004472687 -0.004472687 -0.008945374 0.000000000
dxy 1 0.015340656 0.015340656 0.030681312 0.000000000
dxz 1 0.003489489 0.003489489 0.006978978 0.000000000
dyz 1 0.003491008 0.003491008 0.006982015 0.000000000
sum over m 0.021327293 0.021327293 0.042654586 0.000000000
sum over m+mul 1.207086996 1.207086996 2.414173993 0.000000000
831 O Up spin Down spin Sum Diff
multiple
s 0 0.893912940 0.893912940 1.787825881 0.000000000
sum over m 0.893912940 0.893912940 1.787825881 0.000000000
s 1 -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m+mul 0.890870277 0.890870277 1.781740554 0.000000000
px 0 0.786955523 0.786955523 1.573911046 0.000000000
py 0 0.787099819 0.787099819 1.574199637 0.000000000
pz 0 0.779726273 0.779726273 1.559452547 0.000000000
sum over m 2.353781615 2.353781615 4.707563230 0.000000000
px 1 -0.008737472 -0.008737472 -0.017474944 0.000000000
py 1 -0.008741820 -0.008741820 -0.017483639 0.000000000
pz 1 -0.006459855 -0.006459855 -0.012919711 0.000000000
sum over m -0.023939147 -0.023939147 -0.047878295 0.000000000
sum over m+mul 2.329842468 2.329842468 4.659684936 0.000000000
d3z^2-r^2 0 -0.006390642 -0.006390642 -0.012781283 0.000000000
dx^2-y^2 0 -0.005055774 -0.005055774 -0.010111549 0.000000000
dxy 0 -0.005436133 -0.005436133 -0.010872267 0.000000000
dxz 0 -0.006930509 -0.006930509 -0.013861018 0.000000000
dyz 0 -0.006925393 -0.006925393 -0.013850787 0.000000000
sum over m -0.030738452 -0.030738452 -0.061476903 0.000000000
sum over m+mul -0.030738452 -0.030738452 -0.061476903 0.000000000
832 O Up spin Down spin Sum Diff
multiple
s 0 0.893852153 0.893852153 1.787704305 0.000000000
sum over m 0.893852153 0.893852153 1.787704305 0.000000000
s 1 -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m+mul 0.890809938 0.890809938 1.781619875 0.000000000
px 0 0.786926850 0.786926850 1.573853701 0.000000000
py 0 0.786865166 0.786865166 1.573730332 0.000000000
pz 0 0.779871065 0.779871065 1.559742130 0.000000000
sum over m 2.353663082 2.353663082 4.707326163 0.000000000
px 1 -0.008731742 -0.008731742 -0.017463485 0.000000000
py 1 -0.008735735 -0.008735735 -0.017471470 0.000000000
pz 1 -0.006466435 -0.006466435 -0.012932870 0.000000000
sum over m -0.023933912 -0.023933912 -0.047867825 0.000000000
sum over m+mul 2.329729169 2.329729169 4.659458339 0.000000000
d3z^2-r^2 0 -0.006389061 -0.006389061 -0.012778123 0.000000000
dx^2-y^2 0 -0.005061139 -0.005061139 -0.010122278 0.000000000
dxy 0 -0.005432262 -0.005432262 -0.010864524 0.000000000
dxz 0 -0.006934030 -0.006934030 -0.013868061 0.000000000
dyz 0 -0.006934207 -0.006934207 -0.013868413 0.000000000
sum over m -0.030750700 -0.030750700 -0.061501399 0.000000000
sum over m+mul -0.030750700 -0.030750700 -0.061501399 0.000000000
833 O Up spin Down spin Sum Diff
multiple
s 0 0.893893680 0.893893680 1.787787361 0.000000000
sum over m 0.893893680 0.893893680 1.787787361 0.000000000
s 1 -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m+mul 0.890851350 0.890851350 1.781702699 0.000000000
px 0 0.787088608 0.787088608 1.574177217 0.000000000
py 0 0.786824065 0.786824065 1.573648131 0.000000000
pz 0 0.779803270 0.779803270 1.559606540 0.000000000
sum over m 2.353715944 2.353715944 4.707431888 0.000000000
px 1 -0.008743572 -0.008743572 -0.017487144 0.000000000
py 1 -0.008736146 -0.008736146 -0.017472292 0.000000000
pz 1 -0.006463076 -0.006463076 -0.012926152 0.000000000
sum over m -0.023942794 -0.023942794 -0.047885589 0.000000000
sum over m+mul 2.329773149 2.329773149 4.659546299 0.000000000
d3z^2-r^2 0 -0.006390493 -0.006390493 -0.012780986 0.000000000
dx^2-y^2 0 -0.005059161 -0.005059161 -0.010118322 0.000000000
dxy 0 -0.005434201 -0.005434201 -0.010868403 0.000000000
dxz 0 -0.006929332 -0.006929332 -0.013858665 0.000000000
dyz 0 -0.006933940 -0.006933940 -0.013867881 0.000000000
sum over m -0.030747128 -0.030747128 -0.061494256 0.000000000
sum over m+mul -0.030747128 -0.030747128 -0.061494256 0.000000000
834 O Up spin Down spin Sum Diff
multiple
s 0 0.893907478 0.893907478 1.787814956 0.000000000
sum over m 0.893907478 0.893907478 1.787814956 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m+mul 0.890865303 0.890865303 1.781730606 0.000000000
px 0 0.786958584 0.786958584 1.573917167 0.000000000
py 0 0.787102518 0.787102518 1.574205036 0.000000000
pz 0 0.779724466 0.779724466 1.559448932 0.000000000
sum over m 2.353785568 2.353785568 4.707571135 0.000000000
px 1 -0.008733424 -0.008733424 -0.017466849 0.000000000
py 1 -0.008740799 -0.008740799 -0.017481598 0.000000000
pz 1 -0.006457641 -0.006457641 -0.012915283 0.000000000
sum over m -0.023931865 -0.023931865 -0.047863729 0.000000000
sum over m+mul 2.329853703 2.329853703 4.659707406 0.000000000
d3z^2-r^2 0 -0.006390204 -0.006390204 -0.012780408 0.000000000
dx^2-y^2 0 -0.005055858 -0.005055858 -0.010111717 0.000000000
dxy 0 -0.005435946 -0.005435946 -0.010871892 0.000000000
dxz 0 -0.006929974 -0.006929974 -0.013859947 0.000000000
dyz 0 -0.006924124 -0.006924124 -0.013848248 0.000000000
sum over m -0.030736106 -0.030736106 -0.061472213 0.000000000
sum over m+mul -0.030736106 -0.030736106 -0.061472213 0.000000000
835 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742384 1.000742384 2.001484767 0.000000000
sum over m 1.000742384 1.000742384 2.001484767 0.000000000
s 1 0.207419860 0.207419860 0.414839720 0.000000000
sum over m 0.207419860 0.207419860 0.414839720 0.000000000
s 2 0.014726842 0.014726842 0.029453685 0.000000000
sum over m 0.014726842 0.014726842 0.029453685 0.000000000
sum over m+mul 1.222889086 1.222889086 2.445778172 0.000000000
px 0 1.006382190 1.006382190 2.012764379 0.000000000
py 0 1.006389813 1.006389813 2.012779625 0.000000000
pz 0 1.006209268 1.006209268 2.012418537 0.000000000
sum over m 3.018981271 3.018981271 6.037962541 0.000000000
px 1 0.065407996 0.065407996 0.130815992 0.000000000
py 1 0.065419256 0.065419256 0.130838512 0.000000000
pz 1 0.040404373 0.040404373 0.080808745 0.000000000
sum over m 0.171231625 0.171231625 0.342463250 0.000000000
sum over m+mul 3.190212896 3.190212896 6.380425791 0.000000000
d3z^2-r^2 0 0.196292287 0.196292287 0.392584574 0.000000000
dx^2-y^2 0 0.201528144 0.201528144 0.403056287 0.000000000
dxy 0 0.250900631 0.250900631 0.501801262 0.000000000
dxz 0 0.268523414 0.268523414 0.537046828 0.000000000
dyz 0 0.268518199 0.268518199 0.537036397 0.000000000
sum over m 1.185762674 1.185762674 2.371525348 0.000000000
d3z^2-r^2 1 0.003481533 0.003481533 0.006963067 0.000000000
dx^2-y^2 1 -0.004468526 -0.004468526 -0.008937052 0.000000000
dxy 1 0.015338662 0.015338662 0.030677323 0.000000000
dxz 1 0.003491426 0.003491426 0.006982852 0.000000000
dyz 1 0.003492549 0.003492549 0.006985098 0.000000000
sum over m 0.021335644 0.021335644 0.042671289 0.000000000
sum over m+mul 1.207098318 1.207098318 2.414196636 0.000000000
836 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000756856 1.000756856 2.001513712 0.000000000
sum over m 1.000756856 1.000756856 2.001513712 0.000000000
s 1 0.207409960 0.207409960 0.414819921 0.000000000
sum over m 0.207409960 0.207409960 0.414819921 0.000000000
s 2 0.014725999 0.014725999 0.029451998 0.000000000
sum over m 0.014725999 0.014725999 0.029451998 0.000000000
sum over m+mul 1.222892816 1.222892816 2.445785631 0.000000000
px 0 1.006373475 1.006373475 2.012746950 0.000000000
py 0 1.006375870 1.006375870 2.012751739 0.000000000
pz 0 1.006214911 1.006214911 2.012429822 0.000000000
sum over m 3.018964256 3.018964256 6.037928511 0.000000000
px 1 0.065418425 0.065418425 0.130836851 0.000000000
py 1 0.065439993 0.065439993 0.130879987 0.000000000
pz 1 0.040380761 0.040380761 0.080761523 0.000000000
sum over m 0.171239180 0.171239180 0.342478360 0.000000000
sum over m+mul 3.190203436 3.190203436 6.380406872 0.000000000
d3z^2-r^2 0 0.196294767 0.196294767 0.392589534 0.000000000
dx^2-y^2 0 0.201520194 0.201520194 0.403040388 0.000000000
dxy 0 0.250918861 0.250918861 0.501837721 0.000000000
dxz 0 0.268520643 0.268520643 0.537041287 0.000000000
dyz 0 0.268505238 0.268505238 0.537010476 0.000000000
sum over m 1.185759703 1.185759703 2.371519407 0.000000000
d3z^2-r^2 1 0.003478828 0.003478828 0.006957656 0.000000000
dx^2-y^2 1 -0.004472687 -0.004472687 -0.008945374 0.000000000
dxy 1 0.015340656 0.015340656 0.030681312 0.000000000
dxz 1 0.003489489 0.003489489 0.006978978 0.000000000
dyz 1 0.003491007 0.003491007 0.006982015 0.000000000
sum over m 0.021327293 0.021327293 0.042654586 0.000000000
sum over m+mul 1.207086996 1.207086996 2.414173993 0.000000000
837 O Up spin Down spin Sum Diff
multiple
s 0 0.893912940 0.893912940 1.787825881 0.000000000
sum over m 0.893912940 0.893912940 1.787825881 0.000000000
s 1 -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m+mul 0.890870277 0.890870277 1.781740554 0.000000000
px 0 0.786955523 0.786955523 1.573911047 0.000000000
py 0 0.787099819 0.787099819 1.574199637 0.000000000
pz 0 0.779726273 0.779726273 1.559452547 0.000000000
sum over m 2.353781615 2.353781615 4.707563231 0.000000000
px 1 -0.008737472 -0.008737472 -0.017474944 0.000000000
py 1 -0.008741820 -0.008741820 -0.017483639 0.000000000
pz 1 -0.006459855 -0.006459855 -0.012919711 0.000000000
sum over m -0.023939147 -0.023939147 -0.047878295 0.000000000
sum over m+mul 2.329842468 2.329842468 4.659684936 0.000000000
d3z^2-r^2 0 -0.006390642 -0.006390642 -0.012781283 0.000000000
dx^2-y^2 0 -0.005055774 -0.005055774 -0.010111549 0.000000000
dxy 0 -0.005436133 -0.005436133 -0.010872267 0.000000000
dxz 0 -0.006930509 -0.006930509 -0.013861018 0.000000000
dyz 0 -0.006925393 -0.006925393 -0.013850787 0.000000000
sum over m -0.030738452 -0.030738452 -0.061476903 0.000000000
sum over m+mul -0.030738452 -0.030738452 -0.061476903 0.000000000
838 O Up spin Down spin Sum Diff
multiple
s 0 0.893852153 0.893852153 1.787704305 0.000000000
sum over m 0.893852153 0.893852153 1.787704305 0.000000000
s 1 -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m+mul 0.890809938 0.890809938 1.781619875 0.000000000
px 0 0.786926851 0.786926851 1.573853701 0.000000000
py 0 0.786865166 0.786865166 1.573730332 0.000000000
pz 0 0.779871065 0.779871065 1.559742130 0.000000000
sum over m 2.353663082 2.353663082 4.707326163 0.000000000
px 1 -0.008731742 -0.008731742 -0.017463485 0.000000000
py 1 -0.008735735 -0.008735735 -0.017471470 0.000000000
pz 1 -0.006466435 -0.006466435 -0.012932870 0.000000000
sum over m -0.023933912 -0.023933912 -0.047867825 0.000000000
sum over m+mul 2.329729169 2.329729169 4.659458339 0.000000000
d3z^2-r^2 0 -0.006389061 -0.006389061 -0.012778123 0.000000000
dx^2-y^2 0 -0.005061139 -0.005061139 -0.010122278 0.000000000
dxy 0 -0.005432262 -0.005432262 -0.010864524 0.000000000
dxz 0 -0.006934030 -0.006934030 -0.013868061 0.000000000
dyz 0 -0.006934207 -0.006934207 -0.013868413 0.000000000
sum over m -0.030750700 -0.030750700 -0.061501399 0.000000000
sum over m+mul -0.030750700 -0.030750700 -0.061501399 0.000000000
839 O Up spin Down spin Sum Diff
multiple
s 0 0.893893680 0.893893680 1.787787361 0.000000000
sum over m 0.893893680 0.893893680 1.787787361 0.000000000
s 1 -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m+mul 0.890851350 0.890851350 1.781702699 0.000000000
px 0 0.787088608 0.787088608 1.574177217 0.000000000
py 0 0.786824065 0.786824065 1.573648131 0.000000000
pz 0 0.779803270 0.779803270 1.559606540 0.000000000
sum over m 2.353715944 2.353715944 4.707431888 0.000000000
px 1 -0.008743572 -0.008743572 -0.017487144 0.000000000
py 1 -0.008736146 -0.008736146 -0.017472292 0.000000000
pz 1 -0.006463076 -0.006463076 -0.012926152 0.000000000
sum over m -0.023942794 -0.023942794 -0.047885589 0.000000000
sum over m+mul 2.329773149 2.329773149 4.659546299 0.000000000
d3z^2-r^2 0 -0.006390493 -0.006390493 -0.012780986 0.000000000
dx^2-y^2 0 -0.005059161 -0.005059161 -0.010118322 0.000000000
dxy 0 -0.005434201 -0.005434201 -0.010868403 0.000000000
dxz 0 -0.006929332 -0.006929332 -0.013858665 0.000000000
dyz 0 -0.006933940 -0.006933940 -0.013867881 0.000000000
sum over m -0.030747128 -0.030747128 -0.061494256 0.000000000
sum over m+mul -0.030747128 -0.030747128 -0.061494256 0.000000000
840 O Up spin Down spin Sum Diff
multiple
s 0 0.893907478 0.893907478 1.787814956 0.000000000
sum over m 0.893907478 0.893907478 1.787814956 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m+mul 0.890865303 0.890865303 1.781730606 0.000000000
px 0 0.786958584 0.786958584 1.573917168 0.000000000
py 0 0.787102518 0.787102518 1.574205036 0.000000000
pz 0 0.779724466 0.779724466 1.559448933 0.000000000
sum over m 2.353785568 2.353785568 4.707571136 0.000000000
px 1 -0.008733424 -0.008733424 -0.017466849 0.000000000
py 1 -0.008740799 -0.008740799 -0.017481598 0.000000000
pz 1 -0.006457641 -0.006457641 -0.012915283 0.000000000
sum over m -0.023931865 -0.023931865 -0.047863729 0.000000000
sum over m+mul 2.329853703 2.329853703 4.659707407 0.000000000
d3z^2-r^2 0 -0.006390204 -0.006390204 -0.012780408 0.000000000
dx^2-y^2 0 -0.005055858 -0.005055858 -0.010111717 0.000000000
dxy 0 -0.005435946 -0.005435946 -0.010871892 0.000000000
dxz 0 -0.006929974 -0.006929974 -0.013859947 0.000000000
dyz 0 -0.006924124 -0.006924124 -0.013848248 0.000000000
sum over m -0.030736106 -0.030736106 -0.061472212 0.000000000
sum over m+mul -0.030736106 -0.030736106 -0.061472212 0.000000000
841 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778916 1.000778916 2.001557832 0.000000000
sum over m 1.000778916 1.000778916 2.001557832 0.000000000
s 1 0.207409563 0.207409563 0.414819126 0.000000000
sum over m 0.207409563 0.207409563 0.414819126 0.000000000
s 2 0.014724051 0.014724051 0.029448102 0.000000000
sum over m 0.014724051 0.014724051 0.029448102 0.000000000
sum over m+mul 1.222912530 1.222912530 2.445825060 0.000000000
px 0 1.006362420 1.006362420 2.012724841 0.000000000
py 0 1.006374183 1.006374183 2.012748366 0.000000000
pz 0 1.006209865 1.006209865 2.012419730 0.000000000
sum over m 3.018946468 3.018946468 6.037892937 0.000000000
px 1 0.065443904 0.065443904 0.130887808 0.000000000
py 1 0.065429433 0.065429433 0.130858865 0.000000000
pz 1 0.040370974 0.040370974 0.080741948 0.000000000
sum over m 0.171244310 0.171244310 0.342488621 0.000000000
sum over m+mul 3.190190779 3.190190779 6.380381557 0.000000000
d3z^2-r^2 0 0.196318571 0.196318571 0.392637143 0.000000000
dx^2-y^2 0 0.201518580 0.201518580 0.403037160 0.000000000
dxy 0 0.250943858 0.250943858 0.501887717 0.000000000
dxz 0 0.268501702 0.268501702 0.537003404 0.000000000
dyz 0 0.268483071 0.268483071 0.536966141 0.000000000
sum over m 1.185765783 1.185765783 2.371531565 0.000000000
d3z^2-r^2 1 0.003475678 0.003475678 0.006951357 0.000000000
dx^2-y^2 1 -0.004478521 -0.004478521 -0.008957041 0.000000000
dxy 1 0.015343153 0.015343153 0.030686307 0.000000000
dxz 1 0.003494748 0.003494748 0.006989496 0.000000000
dyz 1 0.003492711 0.003492711 0.006985422 0.000000000
sum over m 0.021327770 0.021327770 0.042655540 0.000000000
sum over m+mul 1.207093553 1.207093553 2.414187105 0.000000000
842 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000792991 1.000792991 2.001585981 0.000000000
sum over m 1.000792991 1.000792991 2.001585981 0.000000000
s 1 0.207390820 0.207390820 0.414781640 0.000000000
sum over m 0.207390820 0.207390820 0.414781640 0.000000000
s 2 0.014720510 0.014720510 0.029441020 0.000000000
sum over m 0.014720510 0.014720510 0.029441020 0.000000000
sum over m+mul 1.222904321 1.222904321 2.445808642 0.000000000
px 0 1.006377573 1.006377573 2.012755146 0.000000000
py 0 1.006384887 1.006384887 2.012769774 0.000000000
pz 0 1.006212343 1.006212343 2.012424686 0.000000000
sum over m 3.018974803 3.018974803 6.037949606 0.000000000
px 1 0.065446611 0.065446611 0.130893222 0.000000000
py 1 0.065437539 0.065437539 0.130875079 0.000000000
pz 1 0.040352263 0.040352263 0.080704526 0.000000000
sum over m 0.171236413 0.171236413 0.342472826 0.000000000
sum over m+mul 3.190211216 3.190211216 6.380422433 0.000000000
d3z^2-r^2 0 0.196306883 0.196306883 0.392613765 0.000000000
dx^2-y^2 0 0.201535544 0.201535544 0.403071088 0.000000000
dxy 0 0.250924809 0.250924809 0.501849618 0.000000000
dxz 0 0.268500321 0.268500321 0.537000642 0.000000000
dyz 0 0.268487707 0.268487707 0.536975415 0.000000000
sum over m 1.185755264 1.185755264 2.371510528 0.000000000
d3z^2-r^2 1 0.003469984 0.003469984 0.006939968 0.000000000
dx^2-y^2 1 -0.004484206 -0.004484206 -0.008968412 0.000000000
dxy 1 0.015344325 0.015344325 0.030688651 0.000000000
dxz 1 0.003487590 0.003487590 0.006975180 0.000000000
dyz 1 0.003485635 0.003485635 0.006971270 0.000000000
sum over m 0.021303329 0.021303329 0.042606657 0.000000000
sum over m+mul 1.207058593 1.207058593 2.414117186 0.000000000
843 O Up spin Down spin Sum Diff
multiple
s 0 0.893905185 0.893905185 1.787810370 0.000000000
sum over m 0.893905185 0.893905185 1.787810370 0.000000000
s 1 -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m+mul 0.890862675 0.890862675 1.781725349 0.000000000
px 0 0.787059160 0.787059160 1.574118321 0.000000000
py 0 0.787002996 0.787002996 1.574005991 0.000000000
pz 0 0.779696595 0.779696595 1.559393190 0.000000000
sum over m 2.353758751 2.353758751 4.707517502 0.000000000
px 1 -0.008733168 -0.008733168 -0.017466336 0.000000000
py 1 -0.008735018 -0.008735018 -0.017470036 0.000000000
pz 1 -0.006457441 -0.006457441 -0.012914882 0.000000000
sum over m -0.023925627 -0.023925627 -0.047851254 0.000000000
sum over m+mul 2.329833124 2.329833124 4.659666248 0.000000000
d3z^2-r^2 0 -0.006390179 -0.006390179 -0.012780358 0.000000000
dx^2-y^2 0 -0.005053263 -0.005053263 -0.010106526 0.000000000
dxy 0 -0.005435079 -0.005435079 -0.010870159 0.000000000
dxz 0 -0.006925305 -0.006925305 -0.013850609 0.000000000
dyz 0 -0.006924637 -0.006924637 -0.013849274 0.000000000
sum over m -0.030728463 -0.030728463 -0.061456926 0.000000000
sum over m+mul -0.030728463 -0.030728463 -0.061456926 0.000000000
844 O Up spin Down spin Sum Diff
multiple
s 0 0.893888928 0.893888928 1.787777856 0.000000000
sum over m 0.893888928 0.893888928 1.787777856 0.000000000
s 1 -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m+mul 0.890848292 0.890848292 1.781696584 0.000000000
px 0 0.786865217 0.786865217 1.573730434 0.000000000
py 0 0.787028939 0.787028939 1.574057877 0.000000000
pz 0 0.779830101 0.779830101 1.559660202 0.000000000
sum over m 2.353724257 2.353724257 4.707448514 0.000000000
px 1 -0.008732655 -0.008732655 -0.017465311 0.000000000
py 1 -0.008744757 -0.008744757 -0.017489514 0.000000000
pz 1 -0.006466405 -0.006466405 -0.012932810 0.000000000
sum over m -0.023943817 -0.023943817 -0.047887635 0.000000000
sum over m+mul 2.329780439 2.329780439 4.659560879 0.000000000
d3z^2-r^2 0 -0.006391873 -0.006391873 -0.012783746 0.000000000
dx^2-y^2 0 -0.005060058 -0.005060058 -0.010120116 0.000000000
dxy 0 -0.005434637 -0.005434637 -0.010869275 0.000000000
dxz 0 -0.006933241 -0.006933241 -0.013866483 0.000000000
dyz 0 -0.006930267 -0.006930267 -0.013860534 0.000000000
sum over m -0.030750077 -0.030750077 -0.061500154 0.000000000
sum over m+mul -0.030750077 -0.030750077 -0.061500154 0.000000000
845 O Up spin Down spin Sum Diff
multiple
s 0 0.893912791 0.893912791 1.787825582 0.000000000
sum over m 0.893912791 0.893912791 1.787825582 0.000000000
s 1 -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m+mul 0.890871448 0.890871448 1.781742896 0.000000000
px 0 0.787115831 0.787115831 1.574231661 0.000000000
py 0 0.786870148 0.786870148 1.573740297 0.000000000
pz 0 0.779754650 0.779754650 1.559509300 0.000000000
sum over m 2.353740629 2.353740629 4.707481258 0.000000000
px 1 -0.008744205 -0.008744205 -0.017488409 0.000000000
py 1 -0.008737390 -0.008737390 -0.017474781 0.000000000
pz 1 -0.006463247 -0.006463247 -0.012926493 0.000000000
sum over m -0.023944842 -0.023944842 -0.047889683 0.000000000
sum over m+mul 2.329795787 2.329795787 4.659591575 0.000000000
d3z^2-r^2 0 -0.006392167 -0.006392167 -0.012784335 0.000000000
dx^2-y^2 0 -0.005057196 -0.005057196 -0.010114392 0.000000000
dxy 0 -0.005435295 -0.005435295 -0.010870589 0.000000000
dxz 0 -0.006926335 -0.006926335 -0.013852670 0.000000000
dyz 0 -0.006930221 -0.006930221 -0.013860442 0.000000000
sum over m -0.030741214 -0.030741214 -0.061482428 0.000000000
sum over m+mul -0.030741214 -0.030741214 -0.061482428 0.000000000
846 O Up spin Down spin Sum Diff
multiple
s 0 0.893877889 0.893877889 1.787755777 0.000000000
sum over m 0.893877889 0.893877889 1.787755777 0.000000000
s 1 -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m+mul 0.890836748 0.890836748 1.781673495 0.000000000
px 0 0.786864481 0.786864481 1.573728963 0.000000000
py 0 0.787030508 0.787030508 1.574061017 0.000000000
pz 0 0.779832475 0.779832475 1.559664951 0.000000000
sum over m 2.353727465 2.353727465 4.707454930 0.000000000
px 1 -0.008727804 -0.008727804 -0.017455608 0.000000000
py 1 -0.008742331 -0.008742331 -0.017484663 0.000000000
pz 1 -0.006466676 -0.006466676 -0.012933352 0.000000000
sum over m -0.023936811 -0.023936811 -0.047873623 0.000000000
sum over m+mul 2.329790654 2.329790654 4.659581308 0.000000000
d3z^2-r^2 0 -0.006390882 -0.006390882 -0.012781764 0.000000000
dx^2-y^2 0 -0.005059703 -0.005059703 -0.010119406 0.000000000
dxy 0 -0.005434362 -0.005434362 -0.010868723 0.000000000
dxz 0 -0.006933518 -0.006933518 -0.013867035 0.000000000
dyz 0 -0.006929750 -0.006929750 -0.013859500 0.000000000
sum over m -0.030748214 -0.030748214 -0.061496429 0.000000000
sum over m+mul -0.030748214 -0.030748214 -0.061496429 0.000000000
847 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778916 1.000778916 2.001557832 0.000000000
sum over m 1.000778916 1.000778916 2.001557832 0.000000000
s 1 0.207409563 0.207409563 0.414819127 0.000000000
sum over m 0.207409563 0.207409563 0.414819127 0.000000000
s 2 0.014724051 0.014724051 0.029448102 0.000000000
sum over m 0.014724051 0.014724051 0.029448102 0.000000000
sum over m+mul 1.222912530 1.222912530 2.445825060 0.000000000
px 0 1.006362420 1.006362420 2.012724841 0.000000000
py 0 1.006374183 1.006374183 2.012748366 0.000000000
pz 0 1.006209865 1.006209865 2.012419730 0.000000000
sum over m 3.018946468 3.018946468 6.037892937 0.000000000
px 1 0.065443904 0.065443904 0.130887808 0.000000000
py 1 0.065429433 0.065429433 0.130858865 0.000000000
pz 1 0.040370974 0.040370974 0.080741948 0.000000000
sum over m 0.171244310 0.171244310 0.342488620 0.000000000
sum over m+mul 3.190190779 3.190190779 6.380381557 0.000000000
d3z^2-r^2 0 0.196318571 0.196318571 0.392637143 0.000000000
dx^2-y^2 0 0.201518580 0.201518580 0.403037160 0.000000000
dxy 0 0.250943858 0.250943858 0.501887717 0.000000000
dxz 0 0.268501702 0.268501702 0.537003404 0.000000000
dyz 0 0.268483071 0.268483071 0.536966142 0.000000000
sum over m 1.185765783 1.185765783 2.371531566 0.000000000
d3z^2-r^2 1 0.003475678 0.003475678 0.006951357 0.000000000
dx^2-y^2 1 -0.004478521 -0.004478521 -0.008957041 0.000000000
dxy 1 0.015343153 0.015343153 0.030686307 0.000000000
dxz 1 0.003494748 0.003494748 0.006989496 0.000000000
dyz 1 0.003492711 0.003492711 0.006985422 0.000000000
sum over m 0.021327770 0.021327770 0.042655540 0.000000000
sum over m+mul 1.207093553 1.207093553 2.414187106 0.000000000
848 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000792991 1.000792991 2.001585982 0.000000000
sum over m 1.000792991 1.000792991 2.001585982 0.000000000
s 1 0.207390820 0.207390820 0.414781640 0.000000000
sum over m 0.207390820 0.207390820 0.414781640 0.000000000
s 2 0.014720510 0.014720510 0.029441020 0.000000000
sum over m 0.014720510 0.014720510 0.029441020 0.000000000
sum over m+mul 1.222904321 1.222904321 2.445808642 0.000000000
px 0 1.006377573 1.006377573 2.012755145 0.000000000
py 0 1.006384887 1.006384887 2.012769774 0.000000000
pz 0 1.006212343 1.006212343 2.012424686 0.000000000
sum over m 3.018974803 3.018974803 6.037949606 0.000000000
px 1 0.065446611 0.065446611 0.130893222 0.000000000
py 1 0.065437539 0.065437539 0.130875079 0.000000000
pz 1 0.040352263 0.040352263 0.080704525 0.000000000
sum over m 0.171236413 0.171236413 0.342472826 0.000000000
sum over m+mul 3.190211216 3.190211216 6.380422432 0.000000000
d3z^2-r^2 0 0.196306883 0.196306883 0.392613765 0.000000000
dx^2-y^2 0 0.201535544 0.201535544 0.403071089 0.000000000
dxy 0 0.250924809 0.250924809 0.501849619 0.000000000
dxz 0 0.268500321 0.268500321 0.537000642 0.000000000
dyz 0 0.268487708 0.268487708 0.536975415 0.000000000
sum over m 1.185755265 1.185755265 2.371510530 0.000000000
d3z^2-r^2 1 0.003469984 0.003469984 0.006939968 0.000000000
dx^2-y^2 1 -0.004484206 -0.004484206 -0.008968412 0.000000000
dxy 1 0.015344325 0.015344325 0.030688651 0.000000000
dxz 1 0.003487590 0.003487590 0.006975180 0.000000000
dyz 1 0.003485635 0.003485635 0.006971270 0.000000000
sum over m 0.021303329 0.021303329 0.042606657 0.000000000
sum over m+mul 1.207058593 1.207058593 2.414117187 0.000000000
849 O Up spin Down spin Sum Diff
multiple
s 0 0.893905185 0.893905185 1.787810370 0.000000000
sum over m 0.893905185 0.893905185 1.787810370 0.000000000
s 1 -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m+mul 0.890862675 0.890862675 1.781725349 0.000000000
px 0 0.787059160 0.787059160 1.574118321 0.000000000
py 0 0.787002996 0.787002996 1.574005992 0.000000000
pz 0 0.779696595 0.779696595 1.559393190 0.000000000
sum over m 2.353758751 2.353758751 4.707517503 0.000000000
px 1 -0.008733168 -0.008733168 -0.017466336 0.000000000
py 1 -0.008735018 -0.008735018 -0.017470036 0.000000000
pz 1 -0.006457441 -0.006457441 -0.012914882 0.000000000
sum over m -0.023925627 -0.023925627 -0.047851254 0.000000000
sum over m+mul 2.329833124 2.329833124 4.659666248 0.000000000
d3z^2-r^2 0 -0.006390179 -0.006390179 -0.012780358 0.000000000
dx^2-y^2 0 -0.005053263 -0.005053263 -0.010106526 0.000000000
dxy 0 -0.005435079 -0.005435079 -0.010870159 0.000000000
dxz 0 -0.006925305 -0.006925305 -0.013850609 0.000000000
dyz 0 -0.006924637 -0.006924637 -0.013849274 0.000000000
sum over m -0.030728463 -0.030728463 -0.061456926 0.000000000
sum over m+mul -0.030728463 -0.030728463 -0.061456926 0.000000000
850 O Up spin Down spin Sum Diff
multiple
s 0 0.893888928 0.893888928 1.787777856 0.000000000
sum over m 0.893888928 0.893888928 1.787777856 0.000000000
s 1 -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m+mul 0.890848292 0.890848292 1.781696584 0.000000000
px 0 0.786865217 0.786865217 1.573730435 0.000000000
py 0 0.787028939 0.787028939 1.574057877 0.000000000
pz 0 0.779830101 0.779830101 1.559660202 0.000000000
sum over m 2.353724257 2.353724257 4.707448514 0.000000000
px 1 -0.008732655 -0.008732655 -0.017465311 0.000000000
py 1 -0.008744757 -0.008744757 -0.017489514 0.000000000
pz 1 -0.006466405 -0.006466405 -0.012932810 0.000000000
sum over m -0.023943817 -0.023943817 -0.047887635 0.000000000
sum over m+mul 2.329780440 2.329780440 4.659560880 0.000000000
d3z^2-r^2 0 -0.006391873 -0.006391873 -0.012783746 0.000000000
dx^2-y^2 0 -0.005060058 -0.005060058 -0.010120116 0.000000000
dxy 0 -0.005434637 -0.005434637 -0.010869275 0.000000000
dxz 0 -0.006933241 -0.006933241 -0.013866483 0.000000000
dyz 0 -0.006930267 -0.006930267 -0.013860534 0.000000000
sum over m -0.030750077 -0.030750077 -0.061500154 0.000000000
sum over m+mul -0.030750077 -0.030750077 -0.061500154 0.000000000
851 O Up spin Down spin Sum Diff
multiple
s 0 0.893912791 0.893912791 1.787825582 0.000000000
sum over m 0.893912791 0.893912791 1.787825582 0.000000000
s 1 -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m+mul 0.890871448 0.890871448 1.781742896 0.000000000
px 0 0.787115831 0.787115831 1.574231662 0.000000000
py 0 0.786870148 0.786870148 1.573740297 0.000000000
pz 0 0.779754650 0.779754650 1.559509300 0.000000000
sum over m 2.353740629 2.353740629 4.707481259 0.000000000
px 1 -0.008744205 -0.008744205 -0.017488409 0.000000000
py 1 -0.008737390 -0.008737390 -0.017474781 0.000000000
pz 1 -0.006463247 -0.006463247 -0.012926493 0.000000000
sum over m -0.023944842 -0.023944842 -0.047889683 0.000000000
sum over m+mul 2.329795788 2.329795788 4.659591575 0.000000000
d3z^2-r^2 0 -0.006392167 -0.006392167 -0.012784335 0.000000000
dx^2-y^2 0 -0.005057196 -0.005057196 -0.010114392 0.000000000
dxy 0 -0.005435295 -0.005435295 -0.010870589 0.000000000
dxz 0 -0.006926335 -0.006926335 -0.013852670 0.000000000
dyz 0 -0.006930221 -0.006930221 -0.013860442 0.000000000
sum over m -0.030741214 -0.030741214 -0.061482428 0.000000000
sum over m+mul -0.030741214 -0.030741214 -0.061482428 0.000000000
852 O Up spin Down spin Sum Diff
multiple
s 0 0.893877889 0.893877889 1.787755777 0.000000000
sum over m 0.893877889 0.893877889 1.787755777 0.000000000
s 1 -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m+mul 0.890836748 0.890836748 1.781673495 0.000000000
px 0 0.786864481 0.786864481 1.573728963 0.000000000
py 0 0.787030508 0.787030508 1.574061016 0.000000000
pz 0 0.779832475 0.779832475 1.559664951 0.000000000
sum over m 2.353727465 2.353727465 4.707454930 0.000000000
px 1 -0.008727804 -0.008727804 -0.017455608 0.000000000
py 1 -0.008742331 -0.008742331 -0.017484663 0.000000000
pz 1 -0.006466676 -0.006466676 -0.012933352 0.000000000
sum over m -0.023936811 -0.023936811 -0.047873622 0.000000000
sum over m+mul 2.329790654 2.329790654 4.659581307 0.000000000
d3z^2-r^2 0 -0.006390882 -0.006390882 -0.012781764 0.000000000
dx^2-y^2 0 -0.005059703 -0.005059703 -0.010119406 0.000000000
dxy 0 -0.005434362 -0.005434362 -0.010868723 0.000000000
dxz 0 -0.006933518 -0.006933518 -0.013867035 0.000000000
dyz 0 -0.006929750 -0.006929750 -0.013859500 0.000000000
sum over m -0.030748214 -0.030748214 -0.061496429 0.000000000
sum over m+mul -0.030748214 -0.030748214 -0.061496429 0.000000000
853 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778916 1.000778916 2.001557832 0.000000000
sum over m 1.000778916 1.000778916 2.001557832 0.000000000
s 1 0.207409563 0.207409563 0.414819126 0.000000000
sum over m 0.207409563 0.207409563 0.414819126 0.000000000
s 2 0.014724051 0.014724051 0.029448102 0.000000000
sum over m 0.014724051 0.014724051 0.029448102 0.000000000
sum over m+mul 1.222912530 1.222912530 2.445825060 0.000000000
px 0 1.006362420 1.006362420 2.012724841 0.000000000
py 0 1.006374183 1.006374183 2.012748366 0.000000000
pz 0 1.006209865 1.006209865 2.012419730 0.000000000
sum over m 3.018946468 3.018946468 6.037892937 0.000000000
px 1 0.065443904 0.065443904 0.130887808 0.000000000
py 1 0.065429433 0.065429433 0.130858865 0.000000000
pz 1 0.040370974 0.040370974 0.080741948 0.000000000
sum over m 0.171244310 0.171244310 0.342488621 0.000000000
sum over m+mul 3.190190779 3.190190779 6.380381558 0.000000000
d3z^2-r^2 0 0.196318572 0.196318572 0.392637143 0.000000000
dx^2-y^2 0 0.201518580 0.201518580 0.403037160 0.000000000
dxy 0 0.250943859 0.250943859 0.501887717 0.000000000
dxz 0 0.268501702 0.268501702 0.537003404 0.000000000
dyz 0 0.268483071 0.268483071 0.536966142 0.000000000
sum over m 1.185765783 1.185765783 2.371531566 0.000000000
d3z^2-r^2 1 0.003475678 0.003475678 0.006951357 0.000000000
dx^2-y^2 1 -0.004478521 -0.004478521 -0.008957041 0.000000000
dxy 1 0.015343153 0.015343153 0.030686307 0.000000000
dxz 1 0.003494748 0.003494748 0.006989496 0.000000000
dyz 1 0.003492711 0.003492711 0.006985422 0.000000000
sum over m 0.021327770 0.021327770 0.042655540 0.000000000
sum over m+mul 1.207093553 1.207093553 2.414187106 0.000000000
854 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000792991 1.000792991 2.001585981 0.000000000
sum over m 1.000792991 1.000792991 2.001585981 0.000000000
s 1 0.207390820 0.207390820 0.414781640 0.000000000
sum over m 0.207390820 0.207390820 0.414781640 0.000000000
s 2 0.014720510 0.014720510 0.029441020 0.000000000
sum over m 0.014720510 0.014720510 0.029441020 0.000000000
sum over m+mul 1.222904321 1.222904321 2.445808642 0.000000000
px 0 1.006377573 1.006377573 2.012755145 0.000000000
py 0 1.006384887 1.006384887 2.012769774 0.000000000
pz 0 1.006212343 1.006212343 2.012424686 0.000000000
sum over m 3.018974803 3.018974803 6.037949606 0.000000000
px 1 0.065446611 0.065446611 0.130893221 0.000000000
py 1 0.065437539 0.065437539 0.130875078 0.000000000
pz 1 0.040352263 0.040352263 0.080704525 0.000000000
sum over m 0.171236413 0.171236413 0.342472825 0.000000000
sum over m+mul 3.190211216 3.190211216 6.380422431 0.000000000
d3z^2-r^2 0 0.196306883 0.196306883 0.392613766 0.000000000
dx^2-y^2 0 0.201535544 0.201535544 0.403071088 0.000000000
dxy 0 0.250924809 0.250924809 0.501849618 0.000000000
dxz 0 0.268500321 0.268500321 0.537000642 0.000000000
dyz 0 0.268487707 0.268487707 0.536975415 0.000000000
sum over m 1.185755264 1.185755264 2.371510529 0.000000000
d3z^2-r^2 1 0.003469984 0.003469984 0.006939968 0.000000000
dx^2-y^2 1 -0.004484206 -0.004484206 -0.008968412 0.000000000
dxy 1 0.015344325 0.015344325 0.030688651 0.000000000
dxz 1 0.003487590 0.003487590 0.006975180 0.000000000
dyz 1 0.003485635 0.003485635 0.006971270 0.000000000
sum over m 0.021303329 0.021303329 0.042606657 0.000000000
sum over m+mul 1.207058593 1.207058593 2.414117186 0.000000000
855 O Up spin Down spin Sum Diff
multiple
s 0 0.893905185 0.893905185 1.787810370 0.000000000
sum over m 0.893905185 0.893905185 1.787810370 0.000000000
s 1 -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m+mul 0.890862675 0.890862675 1.781725349 0.000000000
px 0 0.787059160 0.787059160 1.574118321 0.000000000
py 0 0.787002996 0.787002996 1.574005992 0.000000000
pz 0 0.779696595 0.779696595 1.559393190 0.000000000
sum over m 2.353758751 2.353758751 4.707517502 0.000000000
px 1 -0.008733168 -0.008733168 -0.017466336 0.000000000
py 1 -0.008735018 -0.008735018 -0.017470036 0.000000000
pz 1 -0.006457441 -0.006457441 -0.012914882 0.000000000
sum over m -0.023925627 -0.023925627 -0.047851254 0.000000000
sum over m+mul 2.329833124 2.329833124 4.659666248 0.000000000
d3z^2-r^2 0 -0.006390179 -0.006390179 -0.012780358 0.000000000
dx^2-y^2 0 -0.005053263 -0.005053263 -0.010106526 0.000000000
dxy 0 -0.005435079 -0.005435079 -0.010870159 0.000000000
dxz 0 -0.006925305 -0.006925305 -0.013850609 0.000000000
dyz 0 -0.006924637 -0.006924637 -0.013849274 0.000000000
sum over m -0.030728463 -0.030728463 -0.061456926 0.000000000
sum over m+mul -0.030728463 -0.030728463 -0.061456926 0.000000000
856 O Up spin Down spin Sum Diff
multiple
s 0 0.893888928 0.893888928 1.787777856 0.000000000
sum over m 0.893888928 0.893888928 1.787777856 0.000000000
s 1 -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m+mul 0.890848292 0.890848292 1.781696584 0.000000000
px 0 0.786865217 0.786865217 1.573730434 0.000000000
py 0 0.787028939 0.787028939 1.574057878 0.000000000
pz 0 0.779830101 0.779830101 1.559660202 0.000000000
sum over m 2.353724257 2.353724257 4.707448514 0.000000000
px 1 -0.008732655 -0.008732655 -0.017465311 0.000000000
py 1 -0.008744757 -0.008744757 -0.017489514 0.000000000
pz 1 -0.006466405 -0.006466405 -0.012932810 0.000000000
sum over m -0.023943817 -0.023943817 -0.047887635 0.000000000
sum over m+mul 2.329780440 2.329780440 4.659560879 0.000000000
d3z^2-r^2 0 -0.006391873 -0.006391873 -0.012783746 0.000000000
dx^2-y^2 0 -0.005060058 -0.005060058 -0.010120116 0.000000000
dxy 0 -0.005434637 -0.005434637 -0.010869275 0.000000000
dxz 0 -0.006933241 -0.006933241 -0.013866483 0.000000000
dyz 0 -0.006930267 -0.006930267 -0.013860534 0.000000000
sum over m -0.030750077 -0.030750077 -0.061500154 0.000000000
sum over m+mul -0.030750077 -0.030750077 -0.061500154 0.000000000
857 O Up spin Down spin Sum Diff
multiple
s 0 0.893912791 0.893912791 1.787825582 0.000000000
sum over m 0.893912791 0.893912791 1.787825582 0.000000000
s 1 -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m+mul 0.890871448 0.890871448 1.781742896 0.000000000
px 0 0.787115831 0.787115831 1.574231662 0.000000000
py 0 0.786870148 0.786870148 1.573740297 0.000000000
pz 0 0.779754650 0.779754650 1.559509300 0.000000000
sum over m 2.353740629 2.353740629 4.707481258 0.000000000
px 1 -0.008744205 -0.008744205 -0.017488409 0.000000000
py 1 -0.008737390 -0.008737390 -0.017474781 0.000000000
pz 1 -0.006463247 -0.006463247 -0.012926493 0.000000000
sum over m -0.023944842 -0.023944842 -0.047889683 0.000000000
sum over m+mul 2.329795788 2.329795788 4.659591575 0.000000000
d3z^2-r^2 0 -0.006392167 -0.006392167 -0.012784335 0.000000000
dx^2-y^2 0 -0.005057196 -0.005057196 -0.010114392 0.000000000
dxy 0 -0.005435295 -0.005435295 -0.010870589 0.000000000
dxz 0 -0.006926335 -0.006926335 -0.013852670 0.000000000
dyz 0 -0.006930221 -0.006930221 -0.013860442 0.000000000
sum over m -0.030741214 -0.030741214 -0.061482428 0.000000000
sum over m+mul -0.030741214 -0.030741214 -0.061482428 0.000000000
858 O Up spin Down spin Sum Diff
multiple
s 0 0.893877889 0.893877889 1.787755777 0.000000000
sum over m 0.893877889 0.893877889 1.787755777 0.000000000
s 1 -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m+mul 0.890836748 0.890836748 1.781673495 0.000000000
px 0 0.786864481 0.786864481 1.573728963 0.000000000
py 0 0.787030508 0.787030508 1.574061017 0.000000000
pz 0 0.779832475 0.779832475 1.559664951 0.000000000
sum over m 2.353727465 2.353727465 4.707454930 0.000000000
px 1 -0.008727804 -0.008727804 -0.017455608 0.000000000
py 1 -0.008742331 -0.008742331 -0.017484663 0.000000000
pz 1 -0.006466676 -0.006466676 -0.012933352 0.000000000
sum over m -0.023936811 -0.023936811 -0.047873622 0.000000000
sum over m+mul 2.329790654 2.329790654 4.659581308 0.000000000
d3z^2-r^2 0 -0.006390882 -0.006390882 -0.012781764 0.000000000
dx^2-y^2 0 -0.005059703 -0.005059703 -0.010119406 0.000000000
dxy 0 -0.005434362 -0.005434362 -0.010868723 0.000000000
dxz 0 -0.006933518 -0.006933518 -0.013867035 0.000000000
dyz 0 -0.006929750 -0.006929750 -0.013859500 0.000000000
sum over m -0.030748214 -0.030748214 -0.061496428 0.000000000
sum over m+mul -0.030748214 -0.030748214 -0.061496428 0.000000000
859 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778916 1.000778916 2.001557832 0.000000000
sum over m 1.000778916 1.000778916 2.001557832 0.000000000
s 1 0.207409563 0.207409563 0.414819126 0.000000000
sum over m 0.207409563 0.207409563 0.414819126 0.000000000
s 2 0.014724051 0.014724051 0.029448102 0.000000000
sum over m 0.014724051 0.014724051 0.029448102 0.000000000
sum over m+mul 1.222912530 1.222912530 2.445825060 0.000000000
px 0 1.006362420 1.006362420 2.012724841 0.000000000
py 0 1.006374183 1.006374183 2.012748366 0.000000000
pz 0 1.006209865 1.006209865 2.012419730 0.000000000
sum over m 3.018946468 3.018946468 6.037892937 0.000000000
px 1 0.065443904 0.065443904 0.130887808 0.000000000
py 1 0.065429433 0.065429433 0.130858866 0.000000000
pz 1 0.040370974 0.040370974 0.080741947 0.000000000
sum over m 0.171244311 0.171244311 0.342488621 0.000000000
sum over m+mul 3.190190779 3.190190779 6.380381558 0.000000000
d3z^2-r^2 0 0.196318571 0.196318571 0.392637143 0.000000000
dx^2-y^2 0 0.201518580 0.201518580 0.403037160 0.000000000
dxy 0 0.250943858 0.250943858 0.501887717 0.000000000
dxz 0 0.268501702 0.268501702 0.537003404 0.000000000
dyz 0 0.268483071 0.268483071 0.536966141 0.000000000
sum over m 1.185765783 1.185765783 2.371531565 0.000000000
d3z^2-r^2 1 0.003475678 0.003475678 0.006951357 0.000000000
dx^2-y^2 1 -0.004478521 -0.004478521 -0.008957041 0.000000000
dxy 1 0.015343153 0.015343153 0.030686307 0.000000000
dxz 1 0.003494748 0.003494748 0.006989496 0.000000000
dyz 1 0.003492711 0.003492711 0.006985422 0.000000000
sum over m 0.021327770 0.021327770 0.042655540 0.000000000
sum over m+mul 1.207093553 1.207093553 2.414187106 0.000000000
860 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000792991 1.000792991 2.001585981 0.000000000
sum over m 1.000792991 1.000792991 2.001585981 0.000000000
s 1 0.207390820 0.207390820 0.414781640 0.000000000
sum over m 0.207390820 0.207390820 0.414781640 0.000000000
s 2 0.014720510 0.014720510 0.029441020 0.000000000
sum over m 0.014720510 0.014720510 0.029441020 0.000000000
sum over m+mul 1.222904321 1.222904321 2.445808641 0.000000000
px 0 1.006377573 1.006377573 2.012755145 0.000000000
py 0 1.006384887 1.006384887 2.012769774 0.000000000
pz 0 1.006212343 1.006212343 2.012424686 0.000000000
sum over m 3.018974803 3.018974803 6.037949605 0.000000000
px 1 0.065446611 0.065446611 0.130893222 0.000000000
py 1 0.065437539 0.065437539 0.130875079 0.000000000
pz 1 0.040352263 0.040352263 0.080704526 0.000000000
sum over m 0.171236413 0.171236413 0.342472826 0.000000000
sum over m+mul 3.190211216 3.190211216 6.380422432 0.000000000
d3z^2-r^2 0 0.196306883 0.196306883 0.392613766 0.000000000
dx^2-y^2 0 0.201535544 0.201535544 0.403071088 0.000000000
dxy 0 0.250924809 0.250924809 0.501849618 0.000000000
dxz 0 0.268500321 0.268500321 0.537000642 0.000000000
dyz 0 0.268487707 0.268487707 0.536975415 0.000000000
sum over m 1.185755264 1.185755264 2.371510529 0.000000000
d3z^2-r^2 1 0.003469984 0.003469984 0.006939968 0.000000000
dx^2-y^2 1 -0.004484206 -0.004484206 -0.008968412 0.000000000
dxy 1 0.015344325 0.015344325 0.030688651 0.000000000
dxz 1 0.003487590 0.003487590 0.006975180 0.000000000
dyz 1 0.003485635 0.003485635 0.006971270 0.000000000
sum over m 0.021303329 0.021303329 0.042606657 0.000000000
sum over m+mul 1.207058593 1.207058593 2.414117186 0.000000000
861 O Up spin Down spin Sum Diff
multiple
s 0 0.893905185 0.893905185 1.787810370 0.000000000
sum over m 0.893905185 0.893905185 1.787810370 0.000000000
s 1 -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m+mul 0.890862675 0.890862675 1.781725349 0.000000000
px 0 0.787059160 0.787059160 1.574118321 0.000000000
py 0 0.787002996 0.787002996 1.574005991 0.000000000
pz 0 0.779696595 0.779696595 1.559393190 0.000000000
sum over m 2.353758751 2.353758751 4.707517502 0.000000000
px 1 -0.008733168 -0.008733168 -0.017466336 0.000000000
py 1 -0.008735018 -0.008735018 -0.017470036 0.000000000
pz 1 -0.006457441 -0.006457441 -0.012914882 0.000000000
sum over m -0.023925627 -0.023925627 -0.047851254 0.000000000
sum over m+mul 2.329833124 2.329833124 4.659666248 0.000000000
d3z^2-r^2 0 -0.006390179 -0.006390179 -0.012780358 0.000000000
dx^2-y^2 0 -0.005053263 -0.005053263 -0.010106526 0.000000000
dxy 0 -0.005435079 -0.005435079 -0.010870159 0.000000000
dxz 0 -0.006925305 -0.006925305 -0.013850609 0.000000000
dyz 0 -0.006924637 -0.006924637 -0.013849274 0.000000000
sum over m -0.030728463 -0.030728463 -0.061456926 0.000000000
sum over m+mul -0.030728463 -0.030728463 -0.061456926 0.000000000
862 O Up spin Down spin Sum Diff
multiple
s 0 0.893888928 0.893888928 1.787777856 0.000000000
sum over m 0.893888928 0.893888928 1.787777856 0.000000000
s 1 -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m+mul 0.890848292 0.890848292 1.781696584 0.000000000
px 0 0.786865217 0.786865217 1.573730434 0.000000000
py 0 0.787028939 0.787028939 1.574057878 0.000000000
pz 0 0.779830101 0.779830101 1.559660202 0.000000000
sum over m 2.353724257 2.353724257 4.707448514 0.000000000
px 1 -0.008732656 -0.008732656 -0.017465311 0.000000000
py 1 -0.008744757 -0.008744757 -0.017489514 0.000000000
pz 1 -0.006466405 -0.006466405 -0.012932810 0.000000000
sum over m -0.023943817 -0.023943817 -0.047887635 0.000000000
sum over m+mul 2.329780439 2.329780439 4.659560879 0.000000000
d3z^2-r^2 0 -0.006391873 -0.006391873 -0.012783746 0.000000000
dx^2-y^2 0 -0.005060058 -0.005060058 -0.010120116 0.000000000
dxy 0 -0.005434637 -0.005434637 -0.010869275 0.000000000
dxz 0 -0.006933241 -0.006933241 -0.013866483 0.000000000
dyz 0 -0.006930267 -0.006930267 -0.013860534 0.000000000
sum over m -0.030750077 -0.030750077 -0.061500154 0.000000000
sum over m+mul -0.030750077 -0.030750077 -0.061500154 0.000000000
863 O Up spin Down spin Sum Diff
multiple
s 0 0.893912791 0.893912791 1.787825582 0.000000000
sum over m 0.893912791 0.893912791 1.787825582 0.000000000
s 1 -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m+mul 0.890871448 0.890871448 1.781742896 0.000000000
px 0 0.787115831 0.787115831 1.574231661 0.000000000
py 0 0.786870148 0.786870148 1.573740296 0.000000000
pz 0 0.779754650 0.779754650 1.559509300 0.000000000
sum over m 2.353740629 2.353740629 4.707481258 0.000000000
px 1 -0.008744205 -0.008744205 -0.017488409 0.000000000
py 1 -0.008737390 -0.008737390 -0.017474781 0.000000000
pz 1 -0.006463247 -0.006463247 -0.012926493 0.000000000
sum over m -0.023944842 -0.023944842 -0.047889683 0.000000000
sum over m+mul 2.329795787 2.329795787 4.659591575 0.000000000
d3z^2-r^2 0 -0.006392167 -0.006392167 -0.012784335 0.000000000
dx^2-y^2 0 -0.005057196 -0.005057196 -0.010114392 0.000000000
dxy 0 -0.005435295 -0.005435295 -0.010870589 0.000000000
dxz 0 -0.006926335 -0.006926335 -0.013852670 0.000000000
dyz 0 -0.006930221 -0.006930221 -0.013860442 0.000000000
sum over m -0.030741214 -0.030741214 -0.061482428 0.000000000
sum over m+mul -0.030741214 -0.030741214 -0.061482428 0.000000000
864 O Up spin Down spin Sum Diff
multiple
s 0 0.893877889 0.893877889 1.787755777 0.000000000
sum over m 0.893877889 0.893877889 1.787755777 0.000000000
s 1 -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m+mul 0.890836748 0.890836748 1.781673495 0.000000000
px 0 0.786864481 0.786864481 1.573728963 0.000000000
py 0 0.787030508 0.787030508 1.574061017 0.000000000
pz 0 0.779832475 0.779832475 1.559664951 0.000000000
sum over m 2.353727465 2.353727465 4.707454930 0.000000000
px 1 -0.008727804 -0.008727804 -0.017455608 0.000000000
py 1 -0.008742331 -0.008742331 -0.017484663 0.000000000
pz 1 -0.006466676 -0.006466676 -0.012933352 0.000000000
sum over m -0.023936811 -0.023936811 -0.047873622 0.000000000
sum over m+mul 2.329790654 2.329790654 4.659581308 0.000000000
d3z^2-r^2 0 -0.006390882 -0.006390882 -0.012781764 0.000000000
dx^2-y^2 0 -0.005059703 -0.005059703 -0.010119406 0.000000000
dxy 0 -0.005434362 -0.005434362 -0.010868723 0.000000000
dxz 0 -0.006933518 -0.006933518 -0.013867035 0.000000000
dyz 0 -0.006929750 -0.006929750 -0.013859500 0.000000000
sum over m -0.030748214 -0.030748214 -0.061496428 0.000000000
sum over m+mul -0.030748214 -0.030748214 -0.061496428 0.000000000
865 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778916 1.000778916 2.001557832 0.000000000
sum over m 1.000778916 1.000778916 2.001557832 0.000000000
s 1 0.207409563 0.207409563 0.414819126 0.000000000
sum over m 0.207409563 0.207409563 0.414819126 0.000000000
s 2 0.014724051 0.014724051 0.029448102 0.000000000
sum over m 0.014724051 0.014724051 0.029448102 0.000000000
sum over m+mul 1.222912530 1.222912530 2.445825060 0.000000000
px 0 1.006362420 1.006362420 2.012724841 0.000000000
py 0 1.006374183 1.006374183 2.012748366 0.000000000
pz 0 1.006209865 1.006209865 2.012419730 0.000000000
sum over m 3.018946468 3.018946468 6.037892937 0.000000000
px 1 0.065443904 0.065443904 0.130887808 0.000000000
py 1 0.065429432 0.065429432 0.130858865 0.000000000
pz 1 0.040370974 0.040370974 0.080741948 0.000000000
sum over m 0.171244310 0.171244310 0.342488621 0.000000000
sum over m+mul 3.190190779 3.190190779 6.380381557 0.000000000
d3z^2-r^2 0 0.196318572 0.196318572 0.392637143 0.000000000
dx^2-y^2 0 0.201518580 0.201518580 0.403037160 0.000000000
dxy 0 0.250943859 0.250943859 0.501887717 0.000000000
dxz 0 0.268501702 0.268501702 0.537003404 0.000000000
dyz 0 0.268483071 0.268483071 0.536966142 0.000000000
sum over m 1.185765783 1.185765783 2.371531566 0.000000000
d3z^2-r^2 1 0.003475678 0.003475678 0.006951357 0.000000000
dx^2-y^2 1 -0.004478521 -0.004478521 -0.008957041 0.000000000
dxy 1 0.015343153 0.015343153 0.030686307 0.000000000
dxz 1 0.003494748 0.003494748 0.006989496 0.000000000
dyz 1 0.003492711 0.003492711 0.006985422 0.000000000
sum over m 0.021327770 0.021327770 0.042655540 0.000000000
sum over m+mul 1.207093553 1.207093553 2.414187106 0.000000000
866 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000792991 1.000792991 2.001585982 0.000000000
sum over m 1.000792991 1.000792991 2.001585982 0.000000000
s 1 0.207390820 0.207390820 0.414781640 0.000000000
sum over m 0.207390820 0.207390820 0.414781640 0.000000000
s 2 0.014720510 0.014720510 0.029441020 0.000000000
sum over m 0.014720510 0.014720510 0.029441020 0.000000000
sum over m+mul 1.222904321 1.222904321 2.445808642 0.000000000
px 0 1.006377573 1.006377573 2.012755145 0.000000000
py 0 1.006384887 1.006384887 2.012769774 0.000000000
pz 0 1.006212343 1.006212343 2.012424686 0.000000000
sum over m 3.018974803 3.018974803 6.037949606 0.000000000
px 1 0.065446611 0.065446611 0.130893222 0.000000000
py 1 0.065437539 0.065437539 0.130875078 0.000000000
pz 1 0.040352263 0.040352263 0.080704526 0.000000000
sum over m 0.171236413 0.171236413 0.342472826 0.000000000
sum over m+mul 3.190211216 3.190211216 6.380422432 0.000000000
d3z^2-r^2 0 0.196306883 0.196306883 0.392613765 0.000000000
dx^2-y^2 0 0.201535544 0.201535544 0.403071088 0.000000000
dxy 0 0.250924809 0.250924809 0.501849618 0.000000000
dxz 0 0.268500321 0.268500321 0.537000642 0.000000000
dyz 0 0.268487707 0.268487707 0.536975415 0.000000000
sum over m 1.185755264 1.185755264 2.371510528 0.000000000
d3z^2-r^2 1 0.003469984 0.003469984 0.006939968 0.000000000
dx^2-y^2 1 -0.004484206 -0.004484206 -0.008968412 0.000000000
dxy 1 0.015344325 0.015344325 0.030688651 0.000000000
dxz 1 0.003487590 0.003487590 0.006975180 0.000000000
dyz 1 0.003485635 0.003485635 0.006971270 0.000000000
sum over m 0.021303329 0.021303329 0.042606657 0.000000000
sum over m+mul 1.207058593 1.207058593 2.414117186 0.000000000
867 O Up spin Down spin Sum Diff
multiple
s 0 0.893905185 0.893905185 1.787810370 0.000000000
sum over m 0.893905185 0.893905185 1.787810370 0.000000000
s 1 -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m+mul 0.890862675 0.890862675 1.781725349 0.000000000
px 0 0.787059161 0.787059161 1.574118321 0.000000000
py 0 0.787002996 0.787002996 1.574005991 0.000000000
pz 0 0.779696595 0.779696595 1.559393190 0.000000000
sum over m 2.353758751 2.353758751 4.707517503 0.000000000
px 1 -0.008733168 -0.008733168 -0.017466336 0.000000000
py 1 -0.008735018 -0.008735018 -0.017470036 0.000000000
pz 1 -0.006457441 -0.006457441 -0.012914882 0.000000000
sum over m -0.023925627 -0.023925627 -0.047851254 0.000000000
sum over m+mul 2.329833124 2.329833124 4.659666249 0.000000000
d3z^2-r^2 0 -0.006390179 -0.006390179 -0.012780358 0.000000000
dx^2-y^2 0 -0.005053263 -0.005053263 -0.010106526 0.000000000
dxy 0 -0.005435079 -0.005435079 -0.010870159 0.000000000
dxz 0 -0.006925305 -0.006925305 -0.013850609 0.000000000
dyz 0 -0.006924637 -0.006924637 -0.013849274 0.000000000
sum over m -0.030728463 -0.030728463 -0.061456926 0.000000000
sum over m+mul -0.030728463 -0.030728463 -0.061456926 0.000000000
868 O Up spin Down spin Sum Diff
multiple
s 0 0.893888928 0.893888928 1.787777856 0.000000000
sum over m 0.893888928 0.893888928 1.787777856 0.000000000
s 1 -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m+mul 0.890848292 0.890848292 1.781696584 0.000000000
px 0 0.786865217 0.786865217 1.573730434 0.000000000
py 0 0.787028939 0.787028939 1.574057877 0.000000000
pz 0 0.779830101 0.779830101 1.559660202 0.000000000
sum over m 2.353724257 2.353724257 4.707448514 0.000000000
px 1 -0.008732655 -0.008732655 -0.017465311 0.000000000
py 1 -0.008744757 -0.008744757 -0.017489514 0.000000000
pz 1 -0.006466405 -0.006466405 -0.012932810 0.000000000
sum over m -0.023943817 -0.023943817 -0.047887635 0.000000000
sum over m+mul 2.329780439 2.329780439 4.659560879 0.000000000
d3z^2-r^2 0 -0.006391873 -0.006391873 -0.012783746 0.000000000
dx^2-y^2 0 -0.005060058 -0.005060058 -0.010120116 0.000000000
dxy 0 -0.005434637 -0.005434637 -0.010869275 0.000000000
dxz 0 -0.006933241 -0.006933241 -0.013866483 0.000000000
dyz 0 -0.006930267 -0.006930267 -0.013860534 0.000000000
sum over m -0.030750077 -0.030750077 -0.061500154 0.000000000
sum over m+mul -0.030750077 -0.030750077 -0.061500154 0.000000000
869 O Up spin Down spin Sum Diff
multiple
s 0 0.893912791 0.893912791 1.787825582 0.000000000
sum over m 0.893912791 0.893912791 1.787825582 0.000000000
s 1 -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m+mul 0.890871448 0.890871448 1.781742896 0.000000000
px 0 0.787115831 0.787115831 1.574231661 0.000000000
py 0 0.786870148 0.786870148 1.573740297 0.000000000
pz 0 0.779754650 0.779754650 1.559509300 0.000000000
sum over m 2.353740629 2.353740629 4.707481258 0.000000000
px 1 -0.008744205 -0.008744205 -0.017488409 0.000000000
py 1 -0.008737390 -0.008737390 -0.017474781 0.000000000
pz 1 -0.006463247 -0.006463247 -0.012926493 0.000000000
sum over m -0.023944842 -0.023944842 -0.047889683 0.000000000
sum over m+mul 2.329795787 2.329795787 4.659591575 0.000000000
d3z^2-r^2 0 -0.006392167 -0.006392167 -0.012784335 0.000000000
dx^2-y^2 0 -0.005057196 -0.005057196 -0.010114392 0.000000000
dxy 0 -0.005435295 -0.005435295 -0.010870589 0.000000000
dxz 0 -0.006926335 -0.006926335 -0.013852670 0.000000000
dyz 0 -0.006930221 -0.006930221 -0.013860442 0.000000000
sum over m -0.030741214 -0.030741214 -0.061482428 0.000000000
sum over m+mul -0.030741214 -0.030741214 -0.061482428 0.000000000
870 O Up spin Down spin Sum Diff
multiple
s 0 0.893877889 0.893877889 1.787755777 0.000000000
sum over m 0.893877889 0.893877889 1.787755777 0.000000000
s 1 -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m+mul 0.890836748 0.890836748 1.781673495 0.000000000
px 0 0.786864481 0.786864481 1.573728962 0.000000000
py 0 0.787030508 0.787030508 1.574061017 0.000000000
pz 0 0.779832476 0.779832476 1.559664951 0.000000000
sum over m 2.353727465 2.353727465 4.707454930 0.000000000
px 1 -0.008727804 -0.008727804 -0.017455608 0.000000000
py 1 -0.008742331 -0.008742331 -0.017484663 0.000000000
pz 1 -0.006466676 -0.006466676 -0.012933352 0.000000000
sum over m -0.023936811 -0.023936811 -0.047873622 0.000000000
sum over m+mul 2.329790654 2.329790654 4.659581308 0.000000000
d3z^2-r^2 0 -0.006390882 -0.006390882 -0.012781764 0.000000000
dx^2-y^2 0 -0.005059703 -0.005059703 -0.010119406 0.000000000
dxy 0 -0.005434362 -0.005434362 -0.010868723 0.000000000
dxz 0 -0.006933518 -0.006933518 -0.013867035 0.000000000
dyz 0 -0.006929750 -0.006929750 -0.013859500 0.000000000
sum over m -0.030748214 -0.030748214 -0.061496428 0.000000000
sum over m+mul -0.030748214 -0.030748214 -0.061496428 0.000000000
871 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778916 1.000778916 2.001557832 0.000000000
sum over m 1.000778916 1.000778916 2.001557832 0.000000000
s 1 0.207409563 0.207409563 0.414819126 0.000000000
sum over m 0.207409563 0.207409563 0.414819126 0.000000000
s 2 0.014724051 0.014724051 0.029448102 0.000000000
sum over m 0.014724051 0.014724051 0.029448102 0.000000000
sum over m+mul 1.222912530 1.222912530 2.445825060 0.000000000
px 0 1.006362420 1.006362420 2.012724841 0.000000000
py 0 1.006374183 1.006374183 2.012748366 0.000000000
pz 0 1.006209865 1.006209865 2.012419730 0.000000000
sum over m 3.018946468 3.018946468 6.037892937 0.000000000
px 1 0.065443904 0.065443904 0.130887808 0.000000000
py 1 0.065429433 0.065429433 0.130858866 0.000000000
pz 1 0.040370974 0.040370974 0.080741948 0.000000000
sum over m 0.171244311 0.171244311 0.342488621 0.000000000
sum over m+mul 3.190190779 3.190190779 6.380381558 0.000000000
d3z^2-r^2 0 0.196318571 0.196318571 0.392637143 0.000000000
dx^2-y^2 0 0.201518580 0.201518580 0.403037160 0.000000000
dxy 0 0.250943859 0.250943859 0.501887717 0.000000000
dxz 0 0.268501702 0.268501702 0.537003404 0.000000000
dyz 0 0.268483070 0.268483070 0.536966141 0.000000000
sum over m 1.185765782 1.185765782 2.371531565 0.000000000
d3z^2-r^2 1 0.003475678 0.003475678 0.006951357 0.000000000
dx^2-y^2 1 -0.004478521 -0.004478521 -0.008957041 0.000000000
dxy 1 0.015343153 0.015343153 0.030686307 0.000000000
dxz 1 0.003494748 0.003494748 0.006989496 0.000000000
dyz 1 0.003492711 0.003492711 0.006985422 0.000000000
sum over m 0.021327770 0.021327770 0.042655540 0.000000000
sum over m+mul 1.207093553 1.207093553 2.414187105 0.000000000
872 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000792991 1.000792991 2.001585982 0.000000000
sum over m 1.000792991 1.000792991 2.001585982 0.000000000
s 1 0.207390820 0.207390820 0.414781640 0.000000000
sum over m 0.207390820 0.207390820 0.414781640 0.000000000
s 2 0.014720510 0.014720510 0.029441020 0.000000000
sum over m 0.014720510 0.014720510 0.029441020 0.000000000
sum over m+mul 1.222904321 1.222904321 2.445808642 0.000000000
px 0 1.006377573 1.006377573 2.012755145 0.000000000
py 0 1.006384887 1.006384887 2.012769774 0.000000000
pz 0 1.006212343 1.006212343 2.012424686 0.000000000
sum over m 3.018974803 3.018974803 6.037949606 0.000000000
px 1 0.065446611 0.065446611 0.130893222 0.000000000
py 1 0.065437539 0.065437539 0.130875079 0.000000000
pz 1 0.040352263 0.040352263 0.080704526 0.000000000
sum over m 0.171236413 0.171236413 0.342472826 0.000000000
sum over m+mul 3.190211216 3.190211216 6.380422432 0.000000000
d3z^2-r^2 0 0.196306883 0.196306883 0.392613766 0.000000000
dx^2-y^2 0 0.201535544 0.201535544 0.403071088 0.000000000
dxy 0 0.250924809 0.250924809 0.501849619 0.000000000
dxz 0 0.268500321 0.268500321 0.537000641 0.000000000
dyz 0 0.268487707 0.268487707 0.536975415 0.000000000
sum over m 1.185755264 1.185755264 2.371510529 0.000000000
d3z^2-r^2 1 0.003469984 0.003469984 0.006939968 0.000000000
dx^2-y^2 1 -0.004484206 -0.004484206 -0.008968412 0.000000000
dxy 1 0.015344325 0.015344325 0.030688651 0.000000000
dxz 1 0.003487590 0.003487590 0.006975180 0.000000000
dyz 1 0.003485635 0.003485635 0.006971270 0.000000000
sum over m 0.021303329 0.021303329 0.042606657 0.000000000
sum over m+mul 1.207058593 1.207058593 2.414117186 0.000000000
873 O Up spin Down spin Sum Diff
multiple
s 0 0.893905185 0.893905185 1.787810370 0.000000000
sum over m 0.893905185 0.893905185 1.787810370 0.000000000
s 1 -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m+mul 0.890862675 0.890862675 1.781725349 0.000000000
px 0 0.787059160 0.787059160 1.574118321 0.000000000
py 0 0.787002996 0.787002996 1.574005992 0.000000000
pz 0 0.779696595 0.779696595 1.559393190 0.000000000
sum over m 2.353758752 2.353758752 4.707517503 0.000000000
px 1 -0.008733168 -0.008733168 -0.017466336 0.000000000
py 1 -0.008735018 -0.008735018 -0.017470036 0.000000000
pz 1 -0.006457441 -0.006457441 -0.012914882 0.000000000
sum over m -0.023925627 -0.023925627 -0.047851254 0.000000000
sum over m+mul 2.329833124 2.329833124 4.659666249 0.000000000
d3z^2-r^2 0 -0.006390179 -0.006390179 -0.012780358 0.000000000
dx^2-y^2 0 -0.005053263 -0.005053263 -0.010106526 0.000000000
dxy 0 -0.005435079 -0.005435079 -0.010870159 0.000000000
dxz 0 -0.006925305 -0.006925305 -0.013850609 0.000000000
dyz 0 -0.006924637 -0.006924637 -0.013849274 0.000000000
sum over m -0.030728463 -0.030728463 -0.061456926 0.000000000
sum over m+mul -0.030728463 -0.030728463 -0.061456926 0.000000000
874 O Up spin Down spin Sum Diff
multiple
s 0 0.893888928 0.893888928 1.787777856 0.000000000
sum over m 0.893888928 0.893888928 1.787777856 0.000000000
s 1 -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m+mul 0.890848292 0.890848292 1.781696584 0.000000000
px 0 0.786865217 0.786865217 1.573730434 0.000000000
py 0 0.787028939 0.787028939 1.574057877 0.000000000
pz 0 0.779830101 0.779830101 1.559660202 0.000000000
sum over m 2.353724257 2.353724257 4.707448514 0.000000000
px 1 -0.008732655 -0.008732655 -0.017465311 0.000000000
py 1 -0.008744757 -0.008744757 -0.017489514 0.000000000
pz 1 -0.006466405 -0.006466405 -0.012932810 0.000000000
sum over m -0.023943817 -0.023943817 -0.047887635 0.000000000
sum over m+mul 2.329780439 2.329780439 4.659560879 0.000000000
d3z^2-r^2 0 -0.006391873 -0.006391873 -0.012783746 0.000000000
dx^2-y^2 0 -0.005060058 -0.005060058 -0.010120116 0.000000000
dxy 0 -0.005434637 -0.005434637 -0.010869275 0.000000000
dxz 0 -0.006933241 -0.006933241 -0.013866483 0.000000000
dyz 0 -0.006930267 -0.006930267 -0.013860534 0.000000000
sum over m -0.030750077 -0.030750077 -0.061500154 0.000000000
sum over m+mul -0.030750077 -0.030750077 -0.061500154 0.000000000
875 O Up spin Down spin Sum Diff
multiple
s 0 0.893912791 0.893912791 1.787825582 0.000000000
sum over m 0.893912791 0.893912791 1.787825582 0.000000000
s 1 -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m+mul 0.890871448 0.890871448 1.781742896 0.000000000
px 0 0.787115830 0.787115830 1.574231661 0.000000000
py 0 0.786870148 0.786870148 1.573740296 0.000000000
pz 0 0.779754650 0.779754650 1.559509300 0.000000000
sum over m 2.353740629 2.353740629 4.707481257 0.000000000
px 1 -0.008744205 -0.008744205 -0.017488409 0.000000000
py 1 -0.008737390 -0.008737390 -0.017474781 0.000000000
pz 1 -0.006463247 -0.006463247 -0.012926493 0.000000000
sum over m -0.023944842 -0.023944842 -0.047889683 0.000000000
sum over m+mul 2.329795787 2.329795787 4.659591574 0.000000000
d3z^2-r^2 0 -0.006392167 -0.006392167 -0.012784335 0.000000000
dx^2-y^2 0 -0.005057196 -0.005057196 -0.010114392 0.000000000
dxy 0 -0.005435295 -0.005435295 -0.010870589 0.000000000
dxz 0 -0.006926335 -0.006926335 -0.013852670 0.000000000
dyz 0 -0.006930221 -0.006930221 -0.013860442 0.000000000
sum over m -0.030741214 -0.030741214 -0.061482428 0.000000000
sum over m+mul -0.030741214 -0.030741214 -0.061482428 0.000000000
876 O Up spin Down spin Sum Diff
multiple
s 0 0.893877889 0.893877889 1.787755777 0.000000000
sum over m 0.893877889 0.893877889 1.787755777 0.000000000
s 1 -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m+mul 0.890836748 0.890836748 1.781673495 0.000000000
px 0 0.786864481 0.786864481 1.573728963 0.000000000
py 0 0.787030508 0.787030508 1.574061017 0.000000000
pz 0 0.779832475 0.779832475 1.559664951 0.000000000
sum over m 2.353727465 2.353727465 4.707454930 0.000000000
px 1 -0.008727804 -0.008727804 -0.017455608 0.000000000
py 1 -0.008742331 -0.008742331 -0.017484663 0.000000000
pz 1 -0.006466676 -0.006466676 -0.012933352 0.000000000
sum over m -0.023936811 -0.023936811 -0.047873622 0.000000000
sum over m+mul 2.329790654 2.329790654 4.659581308 0.000000000
d3z^2-r^2 0 -0.006390882 -0.006390882 -0.012781764 0.000000000
dx^2-y^2 0 -0.005059703 -0.005059703 -0.010119406 0.000000000
dxy 0 -0.005434362 -0.005434362 -0.010868723 0.000000000
dxz 0 -0.006933518 -0.006933518 -0.013867035 0.000000000
dyz 0 -0.006929750 -0.006929750 -0.013859500 0.000000000
sum over m -0.030748214 -0.030748214 -0.061496428 0.000000000
sum over m+mul -0.030748214 -0.030748214 -0.061496428 0.000000000
877 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000778916 1.000778916 2.001557831 0.000000000
sum over m 1.000778916 1.000778916 2.001557831 0.000000000
s 1 0.207409563 0.207409563 0.414819127 0.000000000
sum over m 0.207409563 0.207409563 0.414819127 0.000000000
s 2 0.014724051 0.014724051 0.029448102 0.000000000
sum over m 0.014724051 0.014724051 0.029448102 0.000000000
sum over m+mul 1.222912530 1.222912530 2.445825060 0.000000000
px 0 1.006362420 1.006362420 2.012724841 0.000000000
py 0 1.006374183 1.006374183 2.012748366 0.000000000
pz 0 1.006209865 1.006209865 2.012419730 0.000000000
sum over m 3.018946468 3.018946468 6.037892937 0.000000000
px 1 0.065443904 0.065443904 0.130887808 0.000000000
py 1 0.065429433 0.065429433 0.130858865 0.000000000
pz 1 0.040370974 0.040370974 0.080741948 0.000000000
sum over m 0.171244311 0.171244311 0.342488621 0.000000000
sum over m+mul 3.190190779 3.190190779 6.380381558 0.000000000
d3z^2-r^2 0 0.196318571 0.196318571 0.392637143 0.000000000
dx^2-y^2 0 0.201518580 0.201518580 0.403037160 0.000000000
dxy 0 0.250943858 0.250943858 0.501887717 0.000000000
dxz 0 0.268501702 0.268501702 0.537003404 0.000000000
dyz 0 0.268483071 0.268483071 0.536966142 0.000000000
sum over m 1.185765783 1.185765783 2.371531565 0.000000000
d3z^2-r^2 1 0.003475678 0.003475678 0.006951357 0.000000000
dx^2-y^2 1 -0.004478521 -0.004478521 -0.008957041 0.000000000
dxy 1 0.015343153 0.015343153 0.030686307 0.000000000
dxz 1 0.003494748 0.003494748 0.006989496 0.000000000
dyz 1 0.003492711 0.003492711 0.006985422 0.000000000
sum over m 0.021327770 0.021327770 0.042655540 0.000000000
sum over m+mul 1.207093553 1.207093553 2.414187105 0.000000000
878 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000792990 1.000792990 2.001585981 0.000000000
sum over m 1.000792990 1.000792990 2.001585981 0.000000000
s 1 0.207390820 0.207390820 0.414781640 0.000000000
sum over m 0.207390820 0.207390820 0.414781640 0.000000000
s 2 0.014720510 0.014720510 0.029441020 0.000000000
sum over m 0.014720510 0.014720510 0.029441020 0.000000000
sum over m+mul 1.222904321 1.222904321 2.445808641 0.000000000
px 0 1.006377573 1.006377573 2.012755145 0.000000000
py 0 1.006384887 1.006384887 2.012769775 0.000000000
pz 0 1.006212343 1.006212343 2.012424686 0.000000000
sum over m 3.018974803 3.018974803 6.037949606 0.000000000
px 1 0.065446611 0.065446611 0.130893222 0.000000000
py 1 0.065437539 0.065437539 0.130875078 0.000000000
pz 1 0.040352263 0.040352263 0.080704525 0.000000000
sum over m 0.171236413 0.171236413 0.342472825 0.000000000
sum over m+mul 3.190211216 3.190211216 6.380422431 0.000000000
d3z^2-r^2 0 0.196306883 0.196306883 0.392613766 0.000000000
dx^2-y^2 0 0.201535544 0.201535544 0.403071088 0.000000000
dxy 0 0.250924809 0.250924809 0.501849618 0.000000000
dxz 0 0.268500321 0.268500321 0.537000642 0.000000000
dyz 0 0.268487707 0.268487707 0.536975415 0.000000000
sum over m 1.185755264 1.185755264 2.371510529 0.000000000
d3z^2-r^2 1 0.003469984 0.003469984 0.006939968 0.000000000
dx^2-y^2 1 -0.004484206 -0.004484206 -0.008968412 0.000000000
dxy 1 0.015344325 0.015344325 0.030688651 0.000000000
dxz 1 0.003487590 0.003487590 0.006975180 0.000000000
dyz 1 0.003485635 0.003485635 0.006971270 0.000000000
sum over m 0.021303329 0.021303329 0.042606657 0.000000000
sum over m+mul 1.207058593 1.207058593 2.414117186 0.000000000
879 O Up spin Down spin Sum Diff
multiple
s 0 0.893905185 0.893905185 1.787810370 0.000000000
sum over m 0.893905185 0.893905185 1.787810370 0.000000000
s 1 -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m -0.003042510 -0.003042510 -0.006085021 0.000000000
sum over m+mul 0.890862675 0.890862675 1.781725350 0.000000000
px 0 0.787059160 0.787059160 1.574118321 0.000000000
py 0 0.787002996 0.787002996 1.574005992 0.000000000
pz 0 0.779696595 0.779696595 1.559393190 0.000000000
sum over m 2.353758751 2.353758751 4.707517503 0.000000000
px 1 -0.008733168 -0.008733168 -0.017466336 0.000000000
py 1 -0.008735018 -0.008735018 -0.017470036 0.000000000
pz 1 -0.006457441 -0.006457441 -0.012914882 0.000000000
sum over m -0.023925627 -0.023925627 -0.047851254 0.000000000
sum over m+mul 2.329833124 2.329833124 4.659666249 0.000000000
d3z^2-r^2 0 -0.006390179 -0.006390179 -0.012780358 0.000000000
dx^2-y^2 0 -0.005053263 -0.005053263 -0.010106526 0.000000000
dxy 0 -0.005435079 -0.005435079 -0.010870159 0.000000000
dxz 0 -0.006925305 -0.006925305 -0.013850609 0.000000000
dyz 0 -0.006924637 -0.006924637 -0.013849274 0.000000000
sum over m -0.030728463 -0.030728463 -0.061456926 0.000000000
sum over m+mul -0.030728463 -0.030728463 -0.061456926 0.000000000
880 O Up spin Down spin Sum Diff
multiple
s 0 0.893888928 0.893888928 1.787777856 0.000000000
sum over m 0.893888928 0.893888928 1.787777856 0.000000000
s 1 -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m -0.003040636 -0.003040636 -0.006081272 0.000000000
sum over m+mul 0.890848292 0.890848292 1.781696584 0.000000000
px 0 0.786865217 0.786865217 1.573730434 0.000000000
py 0 0.787028939 0.787028939 1.574057878 0.000000000
pz 0 0.779830101 0.779830101 1.559660202 0.000000000
sum over m 2.353724257 2.353724257 4.707448514 0.000000000
px 1 -0.008732655 -0.008732655 -0.017465311 0.000000000
py 1 -0.008744757 -0.008744757 -0.017489514 0.000000000
pz 1 -0.006466405 -0.006466405 -0.012932810 0.000000000
sum over m -0.023943817 -0.023943817 -0.047887635 0.000000000
sum over m+mul 2.329780440 2.329780440 4.659560879 0.000000000
d3z^2-r^2 0 -0.006391873 -0.006391873 -0.012783746 0.000000000
dx^2-y^2 0 -0.005060058 -0.005060058 -0.010120116 0.000000000
dxy 0 -0.005434637 -0.005434637 -0.010869275 0.000000000
dxz 0 -0.006933241 -0.006933241 -0.013866483 0.000000000
dyz 0 -0.006930267 -0.006930267 -0.013860534 0.000000000
sum over m -0.030750077 -0.030750077 -0.061500154 0.000000000
sum over m+mul -0.030750077 -0.030750077 -0.061500154 0.000000000
881 O Up spin Down spin Sum Diff
multiple
s 0 0.893912791 0.893912791 1.787825582 0.000000000
sum over m 0.893912791 0.893912791 1.787825582 0.000000000
s 1 -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m -0.003041343 -0.003041343 -0.006082686 0.000000000
sum over m+mul 0.890871448 0.890871448 1.781742896 0.000000000
px 0 0.787115831 0.787115831 1.574231661 0.000000000
py 0 0.786870148 0.786870148 1.573740296 0.000000000
pz 0 0.779754650 0.779754650 1.559509300 0.000000000
sum over m 2.353740629 2.353740629 4.707481258 0.000000000
px 1 -0.008744205 -0.008744205 -0.017488409 0.000000000
py 1 -0.008737390 -0.008737390 -0.017474781 0.000000000
pz 1 -0.006463247 -0.006463247 -0.012926493 0.000000000
sum over m -0.023944842 -0.023944842 -0.047889683 0.000000000
sum over m+mul 2.329795787 2.329795787 4.659591575 0.000000000
d3z^2-r^2 0 -0.006392167 -0.006392167 -0.012784335 0.000000000
dx^2-y^2 0 -0.005057196 -0.005057196 -0.010114392 0.000000000
dxy 0 -0.005435295 -0.005435295 -0.010870589 0.000000000
dxz 0 -0.006926335 -0.006926335 -0.013852670 0.000000000
dyz 0 -0.006930221 -0.006930221 -0.013860442 0.000000000
sum over m -0.030741214 -0.030741214 -0.061482428 0.000000000
sum over m+mul -0.030741214 -0.030741214 -0.061482428 0.000000000
882 O Up spin Down spin Sum Diff
multiple
s 0 0.893877889 0.893877889 1.787755777 0.000000000
sum over m 0.893877889 0.893877889 1.787755777 0.000000000
s 1 -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m -0.003041141 -0.003041141 -0.006082282 0.000000000
sum over m+mul 0.890836748 0.890836748 1.781673495 0.000000000
px 0 0.786864481 0.786864481 1.573728963 0.000000000
py 0 0.787030508 0.787030508 1.574061016 0.000000000
pz 0 0.779832476 0.779832476 1.559664951 0.000000000
sum over m 2.353727465 2.353727465 4.707454930 0.000000000
px 1 -0.008727804 -0.008727804 -0.017455608 0.000000000
py 1 -0.008742331 -0.008742331 -0.017484663 0.000000000
pz 1 -0.006466676 -0.006466676 -0.012933352 0.000000000
sum over m -0.023936811 -0.023936811 -0.047873622 0.000000000
sum over m+mul 2.329790654 2.329790654 4.659581308 0.000000000
d3z^2-r^2 0 -0.006390882 -0.006390882 -0.012781764 0.000000000
dx^2-y^2 0 -0.005059703 -0.005059703 -0.010119406 0.000000000
dxy 0 -0.005434362 -0.005434362 -0.010868723 0.000000000
dxz 0 -0.006933518 -0.006933518 -0.013867035 0.000000000
dyz 0 -0.006929750 -0.006929750 -0.013859500 0.000000000
sum over m -0.030748214 -0.030748214 -0.061496428 0.000000000
sum over m+mul -0.030748214 -0.030748214 -0.061496428 0.000000000
883 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000784858 1.000784858 2.001569716 0.000000000
sum over m 1.000784858 1.000784858 2.001569716 0.000000000
s 1 0.207406430 0.207406430 0.414812860 0.000000000
sum over m 0.207406430 0.207406430 0.414812860 0.000000000
s 2 0.014723064 0.014723064 0.029446129 0.000000000
sum over m 0.014723064 0.014723064 0.029446129 0.000000000
sum over m+mul 1.222914352 1.222914352 2.445828705 0.000000000
px 0 1.006363600 1.006363600 2.012727200 0.000000000
py 0 1.006381732 1.006381732 2.012763464 0.000000000
pz 0 1.006198562 1.006198562 2.012397125 0.000000000
sum over m 3.018943894 3.018943894 6.037887789 0.000000000
px 1 0.065442820 0.065442820 0.130885640 0.000000000
py 1 0.065428221 0.065428221 0.130856442 0.000000000
pz 1 0.040368159 0.040368159 0.080736319 0.000000000
sum over m 0.171239201 0.171239201 0.342478401 0.000000000
sum over m+mul 3.190183095 3.190183095 6.380366190 0.000000000
d3z^2-r^2 0 0.196306152 0.196306152 0.392612304 0.000000000
dx^2-y^2 0 0.201515767 0.201515767 0.403031534 0.000000000
dxy 0 0.250939758 0.250939758 0.501879517 0.000000000
dxz 0 0.268506732 0.268506732 0.537013464 0.000000000
dyz 0 0.268483614 0.268483614 0.536967227 0.000000000
sum over m 1.185752023 1.185752023 2.371504046 0.000000000
d3z^2-r^2 1 0.003471637 0.003471637 0.006943275 0.000000000
dx^2-y^2 1 -0.004480560 -0.004480560 -0.008961121 0.000000000
dxy 1 0.015341408 0.015341408 0.030682816 0.000000000
dxz 1 0.003488934 0.003488934 0.006977868 0.000000000
dyz 1 0.003487605 0.003487605 0.006975210 0.000000000
sum over m 0.021309024 0.021309024 0.042618048 0.000000000
sum over m+mul 1.207061047 1.207061047 2.414122094 0.000000000
884 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000783643 1.000783643 2.001567285 0.000000000
sum over m 1.000783643 1.000783643 2.001567285 0.000000000
s 1 0.207408351 0.207408351 0.414816702 0.000000000
sum over m 0.207408351 0.207408351 0.414816702 0.000000000
s 2 0.014721554 0.014721554 0.029443107 0.000000000
sum over m 0.014721554 0.014721554 0.029443107 0.000000000
sum over m+mul 1.222913547 1.222913547 2.445827094 0.000000000
px 0 1.006375218 1.006375218 2.012750436 0.000000000
py 0 1.006384949 1.006384949 2.012769898 0.000000000
pz 0 1.006197785 1.006197785 2.012395570 0.000000000
sum over m 3.018957952 3.018957952 6.037915904 0.000000000
px 1 0.065438474 0.065438474 0.130876949 0.000000000
py 1 0.065427635 0.065427635 0.130855269 0.000000000
pz 1 0.040371962 0.040371962 0.080743925 0.000000000
sum over m 0.171238072 0.171238072 0.342476143 0.000000000
sum over m+mul 3.190196023 3.190196023 6.380392047 0.000000000
d3z^2-r^2 0 0.196324306 0.196324306 0.392648612 0.000000000
dx^2-y^2 0 0.201532272 0.201532272 0.403064544 0.000000000
dxy 0 0.250936209 0.250936209 0.501872418 0.000000000
dxz 0 0.268490663 0.268490663 0.536981326 0.000000000
dyz 0 0.268484247 0.268484247 0.536968494 0.000000000
sum over m 1.185767698 1.185767698 2.371535395 0.000000000
d3z^2-r^2 1 0.003473111 0.003473111 0.006946223 0.000000000
dx^2-y^2 1 -0.004482190 -0.004482190 -0.008964380 0.000000000
dxy 1 0.015344359 0.015344359 0.030688719 0.000000000
dxz 1 0.003494209 0.003494209 0.006988418 0.000000000
dyz 1 0.003493350 0.003493350 0.006986700 0.000000000
sum over m 0.021322840 0.021322840 0.042645679 0.000000000
sum over m+mul 1.207090537 1.207090537 2.414181074 0.000000000
885 O Up spin Down spin Sum Diff
multiple
s 0 0.893901335 0.893901335 1.787802670 0.000000000
sum over m 0.893901335 0.893901335 1.787802670 0.000000000
s 1 -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m+mul 0.890859315 0.890859315 1.781718630 0.000000000
px 0 0.787114197 0.787114197 1.574228393 0.000000000
py 0 0.786866759 0.786866759 1.573733517 0.000000000
pz 0 0.779754467 0.779754467 1.559508933 0.000000000
sum over m 2.353735422 2.353735422 4.707470843 0.000000000
px 1 -0.008742321 -0.008742321 -0.017484643 0.000000000
py 1 -0.008738330 -0.008738330 -0.017476661 0.000000000
pz 1 -0.006463117 -0.006463117 -0.012926233 0.000000000
sum over m -0.023943768 -0.023943768 -0.047887537 0.000000000
sum over m+mul 2.329791653 2.329791653 4.659583307 0.000000000
d3z^2-r^2 0 -0.006391142 -0.006391142 -0.012782285 0.000000000
dx^2-y^2 0 -0.005057147 -0.005057147 -0.010114295 0.000000000
dxy 0 -0.005434410 -0.005434410 -0.010868819 0.000000000
dxz 0 -0.006926802 -0.006926802 -0.013853605 0.000000000
dyz 0 -0.006929891 -0.006929891 -0.013859782 0.000000000
sum over m -0.030739393 -0.030739393 -0.061478786 0.000000000
sum over m+mul -0.030739393 -0.030739393 -0.061478786 0.000000000
886 O Up spin Down spin Sum Diff
multiple
s 0 0.893909360 0.893909360 1.787818719 0.000000000
sum over m 0.893909360 0.893909360 1.787818719 0.000000000
s 1 -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m+mul 0.890867990 0.890867990 1.781735980 0.000000000
px 0 0.786826014 0.786826014 1.573652027 0.000000000
py 0 0.787144557 0.787144557 1.574289115 0.000000000
pz 0 0.779778083 0.779778083 1.559556166 0.000000000
sum over m 2.353748654 2.353748654 4.707497308 0.000000000
px 1 -0.008734595 -0.008734595 -0.017469191 0.000000000
py 1 -0.008747399 -0.008747399 -0.017494798 0.000000000
pz 1 -0.006462482 -0.006462482 -0.012924964 0.000000000
sum over m -0.023944477 -0.023944477 -0.047888953 0.000000000
sum over m+mul 2.329804177 2.329804177 4.659608355 0.000000000
d3z^2-r^2 0 -0.006392050 -0.006392050 -0.012784100 0.000000000
dx^2-y^2 0 -0.005058247 -0.005058247 -0.010116495 0.000000000
dxy 0 -0.005435091 -0.005435091 -0.010870182 0.000000000
dxz 0 -0.006932038 -0.006932038 -0.013864076 0.000000000
dyz 0 -0.006926612 -0.006926612 -0.013853224 0.000000000
sum over m -0.030744038 -0.030744038 -0.061488076 0.000000000
sum over m+mul -0.030744038 -0.030744038 -0.061488076 0.000000000
887 O Up spin Down spin Sum Diff
multiple
s 0 0.893910980 0.893910980 1.787821961 0.000000000
sum over m 0.893910980 0.893910980 1.787821961 0.000000000
s 1 -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m+mul 0.890868828 0.890868828 1.781737657 0.000000000
px 0 0.787056163 0.787056163 1.574112326 0.000000000
py 0 0.787000538 0.787000538 1.574001075 0.000000000
pz 0 0.779693219 0.779693219 1.559386438 0.000000000
sum over m 2.353749920 2.353749920 4.707499840 0.000000000
px 1 -0.008736779 -0.008736779 -0.017473557 0.000000000
py 1 -0.008736984 -0.008736984 -0.017473968 0.000000000
pz 1 -0.006460978 -0.006460978 -0.012921957 0.000000000
sum over m -0.023934741 -0.023934741 -0.047869482 0.000000000
sum over m+mul 2.329815179 2.329815179 4.659630358 0.000000000
d3z^2-r^2 0 -0.006391148 -0.006391148 -0.012782297 0.000000000
dx^2-y^2 0 -0.005053457 -0.005053457 -0.010106915 0.000000000
dxy 0 -0.005434790 -0.005434790 -0.010869579 0.000000000
dxz 0 -0.006924704 -0.006924704 -0.013849407 0.000000000
dyz 0 -0.006925110 -0.006925110 -0.013850219 0.000000000
sum over m -0.030729209 -0.030729209 -0.061458417 0.000000000
sum over m+mul -0.030729209 -0.030729209 -0.061458417 0.000000000
888 O Up spin Down spin Sum Diff
multiple
s 0 0.893846619 0.893846619 1.787693237 0.000000000
sum over m 0.893846619 0.893846619 1.787693237 0.000000000
s 1 -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m+mul 0.890804808 0.890804808 1.781609615 0.000000000
px 0 0.786881619 0.786881619 1.573763237 0.000000000
py 0 0.786881029 0.786881029 1.573762057 0.000000000
pz 0 0.779895839 0.779895839 1.559791679 0.000000000
sum over m 2.353658487 2.353658487 4.707316973 0.000000000
px 1 -0.008727087 -0.008727087 -0.017454174 0.000000000
py 1 -0.008730718 -0.008730718 -0.017461435 0.000000000
pz 1 -0.006467591 -0.006467591 -0.012935183 0.000000000
sum over m -0.023925396 -0.023925396 -0.047850791 0.000000000
sum over m+mul 2.329733091 2.329733091 4.659466182 0.000000000
d3z^2-r^2 0 -0.006389848 -0.006389848 -0.012779696 0.000000000
dx^2-y^2 0 -0.005061427 -0.005061427 -0.010122854 0.000000000
dxy 0 -0.005432516 -0.005432516 -0.010865032 0.000000000
dxz 0 -0.006934596 -0.006934596 -0.013869192 0.000000000
dyz 0 -0.006934084 -0.006934084 -0.013868168 0.000000000
sum over m -0.030752471 -0.030752471 -0.061504941 0.000000000
sum over m+mul -0.030752471 -0.030752471 -0.061504941 0.000000000
889 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000784858 1.000784858 2.001569716 0.000000000
sum over m 1.000784858 1.000784858 2.001569716 0.000000000
s 1 0.207406430 0.207406430 0.414812860 0.000000000
sum over m 0.207406430 0.207406430 0.414812860 0.000000000
s 2 0.014723064 0.014723064 0.029446129 0.000000000
sum over m 0.014723064 0.014723064 0.029446129 0.000000000
sum over m+mul 1.222914352 1.222914352 2.445828704 0.000000000
px 0 1.006363600 1.006363600 2.012727200 0.000000000
py 0 1.006381732 1.006381732 2.012763464 0.000000000
pz 0 1.006198562 1.006198562 2.012397125 0.000000000
sum over m 3.018943894 3.018943894 6.037887789 0.000000000
px 1 0.065442820 0.065442820 0.130885640 0.000000000
py 1 0.065428221 0.065428221 0.130856442 0.000000000
pz 1 0.040368159 0.040368159 0.080736319 0.000000000
sum over m 0.171239200 0.171239200 0.342478401 0.000000000
sum over m+mul 3.190183095 3.190183095 6.380366190 0.000000000
d3z^2-r^2 0 0.196306152 0.196306152 0.392612303 0.000000000
dx^2-y^2 0 0.201515767 0.201515767 0.403031534 0.000000000
dxy 0 0.250939758 0.250939758 0.501879517 0.000000000
dxz 0 0.268506732 0.268506732 0.537013464 0.000000000
dyz 0 0.268483614 0.268483614 0.536967227 0.000000000
sum over m 1.185752023 1.185752023 2.371504046 0.000000000
d3z^2-r^2 1 0.003471637 0.003471637 0.006943275 0.000000000
dx^2-y^2 1 -0.004480560 -0.004480560 -0.008961121 0.000000000
dxy 1 0.015341408 0.015341408 0.030682816 0.000000000
dxz 1 0.003488934 0.003488934 0.006977868 0.000000000
dyz 1 0.003487605 0.003487605 0.006975210 0.000000000
sum over m 0.021309024 0.021309024 0.042618048 0.000000000
sum over m+mul 1.207061047 1.207061047 2.414122094 0.000000000
890 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000783643 1.000783643 2.001567286 0.000000000
sum over m 1.000783643 1.000783643 2.001567286 0.000000000
s 1 0.207408351 0.207408351 0.414816702 0.000000000
sum over m 0.207408351 0.207408351 0.414816702 0.000000000
s 2 0.014721554 0.014721554 0.029443107 0.000000000
sum over m 0.014721554 0.014721554 0.029443107 0.000000000
sum over m+mul 1.222913547 1.222913547 2.445827095 0.000000000
px 0 1.006375218 1.006375218 2.012750436 0.000000000
py 0 1.006384949 1.006384949 2.012769898 0.000000000
pz 0 1.006197785 1.006197785 2.012395570 0.000000000
sum over m 3.018957952 3.018957952 6.037915904 0.000000000
px 1 0.065438475 0.065438475 0.130876949 0.000000000
py 1 0.065427635 0.065427635 0.130855270 0.000000000
pz 1 0.040371963 0.040371963 0.080743925 0.000000000
sum over m 0.171238072 0.171238072 0.342476144 0.000000000
sum over m+mul 3.190196024 3.190196024 6.380392048 0.000000000
d3z^2-r^2 0 0.196324306 0.196324306 0.392648612 0.000000000
dx^2-y^2 0 0.201532272 0.201532272 0.403064545 0.000000000
dxy 0 0.250936209 0.250936209 0.501872418 0.000000000
dxz 0 0.268490663 0.268490663 0.536981326 0.000000000
dyz 0 0.268484247 0.268484247 0.536968494 0.000000000
sum over m 1.185767698 1.185767698 2.371535395 0.000000000
d3z^2-r^2 1 0.003473111 0.003473111 0.006946223 0.000000000
dx^2-y^2 1 -0.004482190 -0.004482190 -0.008964380 0.000000000
dxy 1 0.015344359 0.015344359 0.030688718 0.000000000
dxz 1 0.003494209 0.003494209 0.006988418 0.000000000
dyz 1 0.003493350 0.003493350 0.006986700 0.000000000
sum over m 0.021322840 0.021322840 0.042645679 0.000000000
sum over m+mul 1.207090537 1.207090537 2.414181075 0.000000000
891 O Up spin Down spin Sum Diff
multiple
s 0 0.893901335 0.893901335 1.787802670 0.000000000
sum over m 0.893901335 0.893901335 1.787802670 0.000000000
s 1 -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m+mul 0.890859315 0.890859315 1.781718630 0.000000000
px 0 0.787114197 0.787114197 1.574228393 0.000000000
py 0 0.786866759 0.786866759 1.573733518 0.000000000
pz 0 0.779754466 0.779754466 1.559508933 0.000000000
sum over m 2.353735422 2.353735422 4.707470843 0.000000000
px 1 -0.008742321 -0.008742321 -0.017484643 0.000000000
py 1 -0.008738330 -0.008738330 -0.017476661 0.000000000
pz 1 -0.006463117 -0.006463117 -0.012926233 0.000000000
sum over m -0.023943768 -0.023943768 -0.047887536 0.000000000
sum over m+mul 2.329791653 2.329791653 4.659583307 0.000000000
d3z^2-r^2 0 -0.006391142 -0.006391142 -0.012782285 0.000000000
dx^2-y^2 0 -0.005057147 -0.005057147 -0.010114295 0.000000000
dxy 0 -0.005434410 -0.005434410 -0.010868819 0.000000000
dxz 0 -0.006926802 -0.006926802 -0.013853605 0.000000000
dyz 0 -0.006929891 -0.006929891 -0.013859782 0.000000000
sum over m -0.030739393 -0.030739393 -0.061478786 0.000000000
sum over m+mul -0.030739393 -0.030739393 -0.061478786 0.000000000
892 O Up spin Down spin Sum Diff
multiple
s 0 0.893909360 0.893909360 1.787818719 0.000000000
sum over m 0.893909360 0.893909360 1.787818719 0.000000000
s 1 -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m+mul 0.890867990 0.890867990 1.781735980 0.000000000
px 0 0.786826014 0.786826014 1.573652028 0.000000000
py 0 0.787144557 0.787144557 1.574289115 0.000000000
pz 0 0.779778083 0.779778083 1.559556166 0.000000000
sum over m 2.353748654 2.353748654 4.707497308 0.000000000
px 1 -0.008734595 -0.008734595 -0.017469191 0.000000000
py 1 -0.008747399 -0.008747399 -0.017494798 0.000000000
pz 1 -0.006462482 -0.006462482 -0.012924964 0.000000000
sum over m -0.023944477 -0.023944477 -0.047888953 0.000000000
sum over m+mul 2.329804178 2.329804178 4.659608355 0.000000000
d3z^2-r^2 0 -0.006392050 -0.006392050 -0.012784100 0.000000000
dx^2-y^2 0 -0.005058247 -0.005058247 -0.010116495 0.000000000
dxy 0 -0.005435091 -0.005435091 -0.010870182 0.000000000
dxz 0 -0.006932038 -0.006932038 -0.013864076 0.000000000
dyz 0 -0.006926612 -0.006926612 -0.013853224 0.000000000
sum over m -0.030744038 -0.030744038 -0.061488076 0.000000000
sum over m+mul -0.030744038 -0.030744038 -0.061488076 0.000000000
893 O Up spin Down spin Sum Diff
multiple
s 0 0.893910980 0.893910980 1.787821961 0.000000000
sum over m 0.893910980 0.893910980 1.787821961 0.000000000
s 1 -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m+mul 0.890868828 0.890868828 1.781737657 0.000000000
px 0 0.787056163 0.787056163 1.574112326 0.000000000
py 0 0.787000538 0.787000538 1.574001076 0.000000000
pz 0 0.779693219 0.779693219 1.559386439 0.000000000
sum over m 2.353749920 2.353749920 4.707499840 0.000000000
px 1 -0.008736779 -0.008736779 -0.017473557 0.000000000
py 1 -0.008736984 -0.008736984 -0.017473968 0.000000000
pz 1 -0.006460978 -0.006460978 -0.012921957 0.000000000
sum over m -0.023934741 -0.023934741 -0.047869482 0.000000000
sum over m+mul 2.329815179 2.329815179 4.659630358 0.000000000
d3z^2-r^2 0 -0.006391148 -0.006391148 -0.012782297 0.000000000
dx^2-y^2 0 -0.005053457 -0.005053457 -0.010106915 0.000000000
dxy 0 -0.005434790 -0.005434790 -0.010869579 0.000000000
dxz 0 -0.006924704 -0.006924704 -0.013849407 0.000000000
dyz 0 -0.006925110 -0.006925110 -0.013850219 0.000000000
sum over m -0.030729209 -0.030729209 -0.061458417 0.000000000
sum over m+mul -0.030729209 -0.030729209 -0.061458417 0.000000000
894 O Up spin Down spin Sum Diff
multiple
s 0 0.893846619 0.893846619 1.787693238 0.000000000
sum over m 0.893846619 0.893846619 1.787693238 0.000000000
s 1 -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m+mul 0.890804808 0.890804808 1.781609616 0.000000000
px 0 0.786881618 0.786881618 1.573763237 0.000000000
py 0 0.786881029 0.786881029 1.573762057 0.000000000
pz 0 0.779895839 0.779895839 1.559791679 0.000000000
sum over m 2.353658486 2.353658486 4.707316973 0.000000000
px 1 -0.008727087 -0.008727087 -0.017454174 0.000000000
py 1 -0.008730718 -0.008730718 -0.017461435 0.000000000
pz 1 -0.006467591 -0.006467591 -0.012935183 0.000000000
sum over m -0.023925396 -0.023925396 -0.047850792 0.000000000
sum over m+mul 2.329733090 2.329733090 4.659466181 0.000000000
d3z^2-r^2 0 -0.006389848 -0.006389848 -0.012779696 0.000000000
dx^2-y^2 0 -0.005061427 -0.005061427 -0.010122854 0.000000000
dxy 0 -0.005432516 -0.005432516 -0.010865032 0.000000000
dxz 0 -0.006934596 -0.006934596 -0.013869192 0.000000000
dyz 0 -0.006934084 -0.006934084 -0.013868168 0.000000000
sum over m -0.030752471 -0.030752471 -0.061504941 0.000000000
sum over m+mul -0.030752471 -0.030752471 -0.061504941 0.000000000
895 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000784858 1.000784858 2.001569716 0.000000000
sum over m 1.000784858 1.000784858 2.001569716 0.000000000
s 1 0.207406430 0.207406430 0.414812860 0.000000000
sum over m 0.207406430 0.207406430 0.414812860 0.000000000
s 2 0.014723064 0.014723064 0.029446129 0.000000000
sum over m 0.014723064 0.014723064 0.029446129 0.000000000
sum over m+mul 1.222914352 1.222914352 2.445828704 0.000000000
px 0 1.006363600 1.006363600 2.012727200 0.000000000
py 0 1.006381732 1.006381732 2.012763464 0.000000000
pz 0 1.006198562 1.006198562 2.012397125 0.000000000
sum over m 3.018943894 3.018943894 6.037887789 0.000000000
px 1 0.065442820 0.065442820 0.130885641 0.000000000
py 1 0.065428221 0.065428221 0.130856442 0.000000000
pz 1 0.040368160 0.040368160 0.080736319 0.000000000
sum over m 0.171239201 0.171239201 0.342478402 0.000000000
sum over m+mul 3.190183095 3.190183095 6.380366190 0.000000000
d3z^2-r^2 0 0.196306152 0.196306152 0.392612304 0.000000000
dx^2-y^2 0 0.201515767 0.201515767 0.403031535 0.000000000
dxy 0 0.250939758 0.250939758 0.501879517 0.000000000
dxz 0 0.268506732 0.268506732 0.537013463 0.000000000
dyz 0 0.268483614 0.268483614 0.536967227 0.000000000
sum over m 1.185752023 1.185752023 2.371504046 0.000000000
d3z^2-r^2 1 0.003471637 0.003471637 0.006943275 0.000000000
dx^2-y^2 1 -0.004480560 -0.004480560 -0.008961121 0.000000000
dxy 1 0.015341408 0.015341408 0.030682816 0.000000000
dxz 1 0.003488934 0.003488934 0.006977868 0.000000000
dyz 1 0.003487605 0.003487605 0.006975210 0.000000000
sum over m 0.021309024 0.021309024 0.042618048 0.000000000
sum over m+mul 1.207061047 1.207061047 2.414122094 0.000000000
896 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000783643 1.000783643 2.001567285 0.000000000
sum over m 1.000783643 1.000783643 2.001567285 0.000000000
s 1 0.207408351 0.207408351 0.414816702 0.000000000
sum over m 0.207408351 0.207408351 0.414816702 0.000000000
s 2 0.014721554 0.014721554 0.029443107 0.000000000
sum over m 0.014721554 0.014721554 0.029443107 0.000000000
sum over m+mul 1.222913547 1.222913547 2.445827095 0.000000000
px 0 1.006375218 1.006375218 2.012750436 0.000000000
py 0 1.006384949 1.006384949 2.012769897 0.000000000
pz 0 1.006197785 1.006197785 2.012395570 0.000000000
sum over m 3.018957951 3.018957951 6.037915903 0.000000000
px 1 0.065438474 0.065438474 0.130876949 0.000000000
py 1 0.065427635 0.065427635 0.130855270 0.000000000
pz 1 0.040371962 0.040371962 0.080743924 0.000000000
sum over m 0.171238071 0.171238071 0.342476143 0.000000000
sum over m+mul 3.190196023 3.190196023 6.380392046 0.000000000
d3z^2-r^2 0 0.196324306 0.196324306 0.392648612 0.000000000
dx^2-y^2 0 0.201532272 0.201532272 0.403064544 0.000000000
dxy 0 0.250936209 0.250936209 0.501872419 0.000000000
dxz 0 0.268490663 0.268490663 0.536981326 0.000000000
dyz 0 0.268484247 0.268484247 0.536968494 0.000000000
sum over m 1.185767697 1.185767697 2.371535395 0.000000000
d3z^2-r^2 1 0.003473111 0.003473111 0.006946223 0.000000000
dx^2-y^2 1 -0.004482190 -0.004482190 -0.008964379 0.000000000
dxy 1 0.015344359 0.015344359 0.030688718 0.000000000
dxz 1 0.003494209 0.003494209 0.006988418 0.000000000
dyz 1 0.003493350 0.003493350 0.006986700 0.000000000
sum over m 0.021322840 0.021322840 0.042645679 0.000000000
sum over m+mul 1.207090537 1.207090537 2.414181074 0.000000000
897 O Up spin Down spin Sum Diff
multiple
s 0 0.893901335 0.893901335 1.787802670 0.000000000
sum over m 0.893901335 0.893901335 1.787802670 0.000000000
s 1 -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m+mul 0.890859315 0.890859315 1.781718630 0.000000000
px 0 0.787114197 0.787114197 1.574228393 0.000000000
py 0 0.786866759 0.786866759 1.573733517 0.000000000
pz 0 0.779754467 0.779754467 1.559508933 0.000000000
sum over m 2.353735422 2.353735422 4.707470844 0.000000000
px 1 -0.008742321 -0.008742321 -0.017484643 0.000000000
py 1 -0.008738330 -0.008738330 -0.017476661 0.000000000
pz 1 -0.006463117 -0.006463117 -0.012926233 0.000000000
sum over m -0.023943768 -0.023943768 -0.047887536 0.000000000
sum over m+mul 2.329791654 2.329791654 4.659583307 0.000000000
d3z^2-r^2 0 -0.006391142 -0.006391142 -0.012782285 0.000000000
dx^2-y^2 0 -0.005057147 -0.005057147 -0.010114295 0.000000000
dxy 0 -0.005434410 -0.005434410 -0.010868819 0.000000000
dxz 0 -0.006926802 -0.006926802 -0.013853605 0.000000000
dyz 0 -0.006929891 -0.006929891 -0.013859782 0.000000000
sum over m -0.030739393 -0.030739393 -0.061478786 0.000000000
sum over m+mul -0.030739393 -0.030739393 -0.061478786 0.000000000
898 O Up spin Down spin Sum Diff
multiple
s 0 0.893909360 0.893909360 1.787818719 0.000000000
sum over m 0.893909360 0.893909360 1.787818719 0.000000000
s 1 -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m+mul 0.890867990 0.890867990 1.781735980 0.000000000
px 0 0.786826014 0.786826014 1.573652028 0.000000000
py 0 0.787144557 0.787144557 1.574289115 0.000000000
pz 0 0.779778083 0.779778083 1.559556166 0.000000000
sum over m 2.353748654 2.353748654 4.707497309 0.000000000
px 1 -0.008734595 -0.008734595 -0.017469191 0.000000000
py 1 -0.008747399 -0.008747399 -0.017494798 0.000000000
pz 1 -0.006462482 -0.006462482 -0.012924964 0.000000000
sum over m -0.023944477 -0.023944477 -0.047888953 0.000000000
sum over m+mul 2.329804178 2.329804178 4.659608355 0.000000000
d3z^2-r^2 0 -0.006392050 -0.006392050 -0.012784100 0.000000000
dx^2-y^2 0 -0.005058247 -0.005058247 -0.010116495 0.000000000
dxy 0 -0.005435091 -0.005435091 -0.010870182 0.000000000
dxz 0 -0.006932038 -0.006932038 -0.013864076 0.000000000
dyz 0 -0.006926612 -0.006926612 -0.013853224 0.000000000
sum over m -0.030744038 -0.030744038 -0.061488076 0.000000000
sum over m+mul -0.030744038 -0.030744038 -0.061488076 0.000000000
899 O Up spin Down spin Sum Diff
multiple
s 0 0.893910980 0.893910980 1.787821961 0.000000000
sum over m 0.893910980 0.893910980 1.787821961 0.000000000
s 1 -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m+mul 0.890868828 0.890868828 1.781737657 0.000000000
px 0 0.787056163 0.787056163 1.574112325 0.000000000
py 0 0.787000538 0.787000538 1.574001075 0.000000000
pz 0 0.779693219 0.779693219 1.559386439 0.000000000
sum over m 2.353749920 2.353749920 4.707499839 0.000000000
px 1 -0.008736779 -0.008736779 -0.017473557 0.000000000
py 1 -0.008736984 -0.008736984 -0.017473968 0.000000000
pz 1 -0.006460978 -0.006460978 -0.012921957 0.000000000
sum over m -0.023934741 -0.023934741 -0.047869482 0.000000000
sum over m+mul 2.329815179 2.329815179 4.659630357 0.000000000
d3z^2-r^2 0 -0.006391148 -0.006391148 -0.012782297 0.000000000
dx^2-y^2 0 -0.005053457 -0.005053457 -0.010106915 0.000000000
dxy 0 -0.005434790 -0.005434790 -0.010869579 0.000000000
dxz 0 -0.006924704 -0.006924704 -0.013849407 0.000000000
dyz 0 -0.006925110 -0.006925110 -0.013850219 0.000000000
sum over m -0.030729209 -0.030729209 -0.061458417 0.000000000
sum over m+mul -0.030729209 -0.030729209 -0.061458417 0.000000000
900 O Up spin Down spin Sum Diff
multiple
s 0 0.893846619 0.893846619 1.787693237 0.000000000
sum over m 0.893846619 0.893846619 1.787693237 0.000000000
s 1 -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m+mul 0.890804808 0.890804808 1.781609615 0.000000000
px 0 0.786881619 0.786881619 1.573763237 0.000000000
py 0 0.786881029 0.786881029 1.573762057 0.000000000
pz 0 0.779895839 0.779895839 1.559791679 0.000000000
sum over m 2.353658486 2.353658486 4.707316973 0.000000000
px 1 -0.008727087 -0.008727087 -0.017454174 0.000000000
py 1 -0.008730718 -0.008730718 -0.017461435 0.000000000
pz 1 -0.006467591 -0.006467591 -0.012935183 0.000000000
sum over m -0.023925396 -0.023925396 -0.047850792 0.000000000
sum over m+mul 2.329733091 2.329733091 4.659466181 0.000000000
d3z^2-r^2 0 -0.006389848 -0.006389848 -0.012779696 0.000000000
dx^2-y^2 0 -0.005061427 -0.005061427 -0.010122854 0.000000000
dxy 0 -0.005432516 -0.005432516 -0.010865032 0.000000000
dxz 0 -0.006934596 -0.006934596 -0.013869192 0.000000000
dyz 0 -0.006934084 -0.006934084 -0.013868168 0.000000000
sum over m -0.030752471 -0.030752471 -0.061504941 0.000000000
sum over m+mul -0.030752471 -0.030752471 -0.061504941 0.000000000
901 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000784858 1.000784858 2.001569716 0.000000000
sum over m 1.000784858 1.000784858 2.001569716 0.000000000
s 1 0.207406430 0.207406430 0.414812860 0.000000000
sum over m 0.207406430 0.207406430 0.414812860 0.000000000
s 2 0.014723064 0.014723064 0.029446129 0.000000000
sum over m 0.014723064 0.014723064 0.029446129 0.000000000
sum over m+mul 1.222914352 1.222914352 2.445828705 0.000000000
px 0 1.006363600 1.006363600 2.012727200 0.000000000
py 0 1.006381732 1.006381732 2.012763464 0.000000000
pz 0 1.006198562 1.006198562 2.012397125 0.000000000
sum over m 3.018943894 3.018943894 6.037887789 0.000000000
px 1 0.065442820 0.065442820 0.130885641 0.000000000
py 1 0.065428221 0.065428221 0.130856442 0.000000000
pz 1 0.040368160 0.040368160 0.080736319 0.000000000
sum over m 0.171239201 0.171239201 0.342478402 0.000000000
sum over m+mul 3.190183095 3.190183095 6.380366190 0.000000000
d3z^2-r^2 0 0.196306152 0.196306152 0.392612303 0.000000000
dx^2-y^2 0 0.201515767 0.201515767 0.403031534 0.000000000
dxy 0 0.250939758 0.250939758 0.501879517 0.000000000
dxz 0 0.268506732 0.268506732 0.537013464 0.000000000
dyz 0 0.268483613 0.268483613 0.536967227 0.000000000
sum over m 1.185752022 1.185752022 2.371504045 0.000000000
d3z^2-r^2 1 0.003471637 0.003471637 0.006943275 0.000000000
dx^2-y^2 1 -0.004480560 -0.004480560 -0.008961121 0.000000000
dxy 1 0.015341408 0.015341408 0.030682816 0.000000000
dxz 1 0.003488934 0.003488934 0.006977868 0.000000000
dyz 1 0.003487605 0.003487605 0.006975210 0.000000000
sum over m 0.021309024 0.021309024 0.042618048 0.000000000
sum over m+mul 1.207061046 1.207061046 2.414122093 0.000000000
902 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000783643 1.000783643 2.001567285 0.000000000
sum over m 1.000783643 1.000783643 2.001567285 0.000000000
s 1 0.207408351 0.207408351 0.414816702 0.000000000
sum over m 0.207408351 0.207408351 0.414816702 0.000000000
s 2 0.014721554 0.014721554 0.029443107 0.000000000
sum over m 0.014721554 0.014721554 0.029443107 0.000000000
sum over m+mul 1.222913547 1.222913547 2.445827094 0.000000000
px 0 1.006375218 1.006375218 2.012750436 0.000000000
py 0 1.006384949 1.006384949 2.012769897 0.000000000
pz 0 1.006197785 1.006197785 2.012395570 0.000000000
sum over m 3.018957952 3.018957952 6.037915903 0.000000000
px 1 0.065438475 0.065438475 0.130876949 0.000000000
py 1 0.065427635 0.065427635 0.130855269 0.000000000
pz 1 0.040371962 0.040371962 0.080743925 0.000000000
sum over m 0.171238072 0.171238072 0.342476143 0.000000000
sum over m+mul 3.190196023 3.190196023 6.380392047 0.000000000
d3z^2-r^2 0 0.196324306 0.196324306 0.392648612 0.000000000
dx^2-y^2 0 0.201532272 0.201532272 0.403064544 0.000000000
dxy 0 0.250936209 0.250936209 0.501872418 0.000000000
dxz 0 0.268490663 0.268490663 0.536981325 0.000000000
dyz 0 0.268484247 0.268484247 0.536968494 0.000000000
sum over m 1.185767697 1.185767697 2.371535394 0.000000000
d3z^2-r^2 1 0.003473111 0.003473111 0.006946223 0.000000000
dx^2-y^2 1 -0.004482190 -0.004482190 -0.008964380 0.000000000
dxy 1 0.015344359 0.015344359 0.030688718 0.000000000
dxz 1 0.003494209 0.003494209 0.006988418 0.000000000
dyz 1 0.003493350 0.003493350 0.006986700 0.000000000
sum over m 0.021322840 0.021322840 0.042645679 0.000000000
sum over m+mul 1.207090537 1.207090537 2.414181073 0.000000000
903 O Up spin Down spin Sum Diff
multiple
s 0 0.893901335 0.893901335 1.787802670 0.000000000
sum over m 0.893901335 0.893901335 1.787802670 0.000000000
s 1 -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m+mul 0.890859315 0.890859315 1.781718630 0.000000000
px 0 0.787114197 0.787114197 1.574228393 0.000000000
py 0 0.786866759 0.786866759 1.573733517 0.000000000
pz 0 0.779754466 0.779754466 1.559508933 0.000000000
sum over m 2.353735422 2.353735422 4.707470843 0.000000000
px 1 -0.008742321 -0.008742321 -0.017484643 0.000000000
py 1 -0.008738330 -0.008738330 -0.017476661 0.000000000
pz 1 -0.006463117 -0.006463117 -0.012926233 0.000000000
sum over m -0.023943768 -0.023943768 -0.047887537 0.000000000
sum over m+mul 2.329791653 2.329791653 4.659583307 0.000000000
d3z^2-r^2 0 -0.006391142 -0.006391142 -0.012782285 0.000000000
dx^2-y^2 0 -0.005057147 -0.005057147 -0.010114295 0.000000000
dxy 0 -0.005434410 -0.005434410 -0.010868819 0.000000000
dxz 0 -0.006926802 -0.006926802 -0.013853605 0.000000000
dyz 0 -0.006929891 -0.006929891 -0.013859782 0.000000000
sum over m -0.030739393 -0.030739393 -0.061478786 0.000000000
sum over m+mul -0.030739393 -0.030739393 -0.061478786 0.000000000
904 O Up spin Down spin Sum Diff
multiple
s 0 0.893909360 0.893909360 1.787818719 0.000000000
sum over m 0.893909360 0.893909360 1.787818719 0.000000000
s 1 -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m+mul 0.890867990 0.890867990 1.781735980 0.000000000
px 0 0.786826014 0.786826014 1.573652027 0.000000000
py 0 0.787144558 0.787144558 1.574289115 0.000000000
pz 0 0.779778083 0.779778083 1.559556165 0.000000000
sum over m 2.353748654 2.353748654 4.707497308 0.000000000
px 1 -0.008734595 -0.008734595 -0.017469191 0.000000000
py 1 -0.008747399 -0.008747399 -0.017494798 0.000000000
pz 1 -0.006462482 -0.006462482 -0.012924964 0.000000000
sum over m -0.023944477 -0.023944477 -0.047888953 0.000000000
sum over m+mul 2.329804177 2.329804177 4.659608355 0.000000000
d3z^2-r^2 0 -0.006392050 -0.006392050 -0.012784100 0.000000000
dx^2-y^2 0 -0.005058247 -0.005058247 -0.010116495 0.000000000
dxy 0 -0.005435091 -0.005435091 -0.010870182 0.000000000
dxz 0 -0.006932038 -0.006932038 -0.013864076 0.000000000
dyz 0 -0.006926612 -0.006926612 -0.013853224 0.000000000
sum over m -0.030744038 -0.030744038 -0.061488076 0.000000000
sum over m+mul -0.030744038 -0.030744038 -0.061488076 0.000000000
905 O Up spin Down spin Sum Diff
multiple
s 0 0.893910980 0.893910980 1.787821961 0.000000000
sum over m 0.893910980 0.893910980 1.787821961 0.000000000
s 1 -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m+mul 0.890868828 0.890868828 1.781737657 0.000000000
px 0 0.787056163 0.787056163 1.574112325 0.000000000
py 0 0.787000538 0.787000538 1.574001075 0.000000000
pz 0 0.779693219 0.779693219 1.559386438 0.000000000
sum over m 2.353749920 2.353749920 4.707499839 0.000000000
px 1 -0.008736779 -0.008736779 -0.017473557 0.000000000
py 1 -0.008736984 -0.008736984 -0.017473968 0.000000000
pz 1 -0.006460978 -0.006460978 -0.012921957 0.000000000
sum over m -0.023934741 -0.023934741 -0.047869482 0.000000000
sum over m+mul 2.329815179 2.329815179 4.659630358 0.000000000
d3z^2-r^2 0 -0.006391148 -0.006391148 -0.012782297 0.000000000
dx^2-y^2 0 -0.005053457 -0.005053457 -0.010106915 0.000000000
dxy 0 -0.005434790 -0.005434790 -0.010869579 0.000000000
dxz 0 -0.006924704 -0.006924704 -0.013849407 0.000000000
dyz 0 -0.006925110 -0.006925110 -0.013850219 0.000000000
sum over m -0.030729209 -0.030729209 -0.061458417 0.000000000
sum over m+mul -0.030729209 -0.030729209 -0.061458417 0.000000000
906 O Up spin Down spin Sum Diff
multiple
s 0 0.893846619 0.893846619 1.787693238 0.000000000
sum over m 0.893846619 0.893846619 1.787693238 0.000000000
s 1 -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m+mul 0.890804808 0.890804808 1.781609616 0.000000000
px 0 0.786881619 0.786881619 1.573763237 0.000000000
py 0 0.786881029 0.786881029 1.573762057 0.000000000
pz 0 0.779895839 0.779895839 1.559791679 0.000000000
sum over m 2.353658487 2.353658487 4.707316973 0.000000000
px 1 -0.008727087 -0.008727087 -0.017454174 0.000000000
py 1 -0.008730718 -0.008730718 -0.017461435 0.000000000
pz 1 -0.006467591 -0.006467591 -0.012935183 0.000000000
sum over m -0.023925396 -0.023925396 -0.047850792 0.000000000
sum over m+mul 2.329733091 2.329733091 4.659466182 0.000000000
d3z^2-r^2 0 -0.006389848 -0.006389848 -0.012779696 0.000000000
dx^2-y^2 0 -0.005061427 -0.005061427 -0.010122854 0.000000000
dxy 0 -0.005432516 -0.005432516 -0.010865032 0.000000000
dxz 0 -0.006934596 -0.006934596 -0.013869192 0.000000000
dyz 0 -0.006934084 -0.006934084 -0.013868168 0.000000000
sum over m -0.030752471 -0.030752471 -0.061504941 0.000000000
sum over m+mul -0.030752471 -0.030752471 -0.061504941 0.000000000
907 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000784858 1.000784858 2.001569716 0.000000000
sum over m 1.000784858 1.000784858 2.001569716 0.000000000
s 1 0.207406430 0.207406430 0.414812860 0.000000000
sum over m 0.207406430 0.207406430 0.414812860 0.000000000
s 2 0.014723064 0.014723064 0.029446129 0.000000000
sum over m 0.014723064 0.014723064 0.029446129 0.000000000
sum over m+mul 1.222914352 1.222914352 2.445828704 0.000000000
px 0 1.006363600 1.006363600 2.012727200 0.000000000
py 0 1.006381732 1.006381732 2.012763464 0.000000000
pz 0 1.006198562 1.006198562 2.012397125 0.000000000
sum over m 3.018943894 3.018943894 6.037887789 0.000000000
px 1 0.065442820 0.065442820 0.130885640 0.000000000
py 1 0.065428221 0.065428221 0.130856442 0.000000000
pz 1 0.040368159 0.040368159 0.080736319 0.000000000
sum over m 0.171239201 0.171239201 0.342478401 0.000000000
sum over m+mul 3.190183095 3.190183095 6.380366190 0.000000000
d3z^2-r^2 0 0.196306152 0.196306152 0.392612304 0.000000000
dx^2-y^2 0 0.201515767 0.201515767 0.403031535 0.000000000
dxy 0 0.250939758 0.250939758 0.501879517 0.000000000
dxz 0 0.268506732 0.268506732 0.537013464 0.000000000
dyz 0 0.268483614 0.268483614 0.536967227 0.000000000
sum over m 1.185752023 1.185752023 2.371504046 0.000000000
d3z^2-r^2 1 0.003471637 0.003471637 0.006943275 0.000000000
dx^2-y^2 1 -0.004480560 -0.004480560 -0.008961121 0.000000000
dxy 1 0.015341408 0.015341408 0.030682816 0.000000000
dxz 1 0.003488934 0.003488934 0.006977868 0.000000000
dyz 1 0.003487605 0.003487605 0.006975210 0.000000000
sum over m 0.021309024 0.021309024 0.042618048 0.000000000
sum over m+mul 1.207061047 1.207061047 2.414122094 0.000000000
908 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000783643 1.000783643 2.001567285 0.000000000
sum over m 1.000783643 1.000783643 2.001567285 0.000000000
s 1 0.207408351 0.207408351 0.414816702 0.000000000
sum over m 0.207408351 0.207408351 0.414816702 0.000000000
s 2 0.014721554 0.014721554 0.029443107 0.000000000
sum over m 0.014721554 0.014721554 0.029443107 0.000000000
sum over m+mul 1.222913547 1.222913547 2.445827095 0.000000000
px 0 1.006375218 1.006375218 2.012750436 0.000000000
py 0 1.006384949 1.006384949 2.012769898 0.000000000
pz 0 1.006197785 1.006197785 2.012395569 0.000000000
sum over m 3.018957952 3.018957952 6.037915903 0.000000000
px 1 0.065438475 0.065438475 0.130876949 0.000000000
py 1 0.065427635 0.065427635 0.130855270 0.000000000
pz 1 0.040371962 0.040371962 0.080743925 0.000000000
sum over m 0.171238072 0.171238072 0.342476144 0.000000000
sum over m+mul 3.190196024 3.190196024 6.380392047 0.000000000
d3z^2-r^2 0 0.196324306 0.196324306 0.392648612 0.000000000
dx^2-y^2 0 0.201532272 0.201532272 0.403064544 0.000000000
dxy 0 0.250936209 0.250936209 0.501872418 0.000000000
dxz 0 0.268490663 0.268490663 0.536981326 0.000000000
dyz 0 0.268484247 0.268484247 0.536968494 0.000000000
sum over m 1.185767697 1.185767697 2.371535395 0.000000000
d3z^2-r^2 1 0.003473111 0.003473111 0.006946223 0.000000000
dx^2-y^2 1 -0.004482190 -0.004482190 -0.008964380 0.000000000
dxy 1 0.015344359 0.015344359 0.030688718 0.000000000
dxz 1 0.003494209 0.003494209 0.006988418 0.000000000
dyz 1 0.003493350 0.003493350 0.006986700 0.000000000
sum over m 0.021322840 0.021322840 0.042645679 0.000000000
sum over m+mul 1.207090537 1.207090537 2.414181074 0.000000000
909 O Up spin Down spin Sum Diff
multiple
s 0 0.893901335 0.893901335 1.787802670 0.000000000
sum over m 0.893901335 0.893901335 1.787802670 0.000000000
s 1 -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m+mul 0.890859315 0.890859315 1.781718630 0.000000000
px 0 0.787114197 0.787114197 1.574228393 0.000000000
py 0 0.786866759 0.786866759 1.573733517 0.000000000
pz 0 0.779754466 0.779754466 1.559508933 0.000000000
sum over m 2.353735422 2.353735422 4.707470843 0.000000000
px 1 -0.008742321 -0.008742321 -0.017484643 0.000000000
py 1 -0.008738330 -0.008738330 -0.017476661 0.000000000
pz 1 -0.006463117 -0.006463117 -0.012926233 0.000000000
sum over m -0.023943768 -0.023943768 -0.047887537 0.000000000
sum over m+mul 2.329791653 2.329791653 4.659583307 0.000000000
d3z^2-r^2 0 -0.006391142 -0.006391142 -0.012782285 0.000000000
dx^2-y^2 0 -0.005057147 -0.005057147 -0.010114295 0.000000000
dxy 0 -0.005434410 -0.005434410 -0.010868819 0.000000000
dxz 0 -0.006926802 -0.006926802 -0.013853605 0.000000000
dyz 0 -0.006929891 -0.006929891 -0.013859782 0.000000000
sum over m -0.030739393 -0.030739393 -0.061478786 0.000000000
sum over m+mul -0.030739393 -0.030739393 -0.061478786 0.000000000
910 O Up spin Down spin Sum Diff
multiple
s 0 0.893909360 0.893909360 1.787818719 0.000000000
sum over m 0.893909360 0.893909360 1.787818719 0.000000000
s 1 -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m+mul 0.890867990 0.890867990 1.781735980 0.000000000
px 0 0.786826014 0.786826014 1.573652027 0.000000000
py 0 0.787144558 0.787144558 1.574289115 0.000000000
pz 0 0.779778083 0.779778083 1.559556166 0.000000000
sum over m 2.353748654 2.353748654 4.707497308 0.000000000
px 1 -0.008734595 -0.008734595 -0.017469191 0.000000000
py 1 -0.008747399 -0.008747399 -0.017494798 0.000000000
pz 1 -0.006462482 -0.006462482 -0.012924964 0.000000000
sum over m -0.023944477 -0.023944477 -0.047888953 0.000000000
sum over m+mul 2.329804178 2.329804178 4.659608355 0.000000000
d3z^2-r^2 0 -0.006392050 -0.006392050 -0.012784100 0.000000000
dx^2-y^2 0 -0.005058247 -0.005058247 -0.010116495 0.000000000
dxy 0 -0.005435091 -0.005435091 -0.010870182 0.000000000
dxz 0 -0.006932038 -0.006932038 -0.013864076 0.000000000
dyz 0 -0.006926612 -0.006926612 -0.013853224 0.000000000
sum over m -0.030744038 -0.030744038 -0.061488076 0.000000000
sum over m+mul -0.030744038 -0.030744038 -0.061488076 0.000000000
911 O Up spin Down spin Sum Diff
multiple
s 0 0.893910980 0.893910980 1.787821961 0.000000000
sum over m 0.893910980 0.893910980 1.787821961 0.000000000
s 1 -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m+mul 0.890868828 0.890868828 1.781737657 0.000000000
px 0 0.787056163 0.787056163 1.574112326 0.000000000
py 0 0.787000538 0.787000538 1.574001075 0.000000000
pz 0 0.779693219 0.779693219 1.559386439 0.000000000
sum over m 2.353749920 2.353749920 4.707499840 0.000000000
px 1 -0.008736779 -0.008736779 -0.017473557 0.000000000
py 1 -0.008736984 -0.008736984 -0.017473968 0.000000000
pz 1 -0.006460978 -0.006460978 -0.012921957 0.000000000
sum over m -0.023934741 -0.023934741 -0.047869482 0.000000000
sum over m+mul 2.329815179 2.329815179 4.659630358 0.000000000
d3z^2-r^2 0 -0.006391148 -0.006391148 -0.012782297 0.000000000
dx^2-y^2 0 -0.005053457 -0.005053457 -0.010106915 0.000000000
dxy 0 -0.005434790 -0.005434790 -0.010869579 0.000000000
dxz 0 -0.006924704 -0.006924704 -0.013849407 0.000000000
dyz 0 -0.006925110 -0.006925110 -0.013850219 0.000000000
sum over m -0.030729209 -0.030729209 -0.061458417 0.000000000
sum over m+mul -0.030729209 -0.030729209 -0.061458417 0.000000000
912 O Up spin Down spin Sum Diff
multiple
s 0 0.893846619 0.893846619 1.787693237 0.000000000
sum over m 0.893846619 0.893846619 1.787693237 0.000000000
s 1 -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m+mul 0.890804808 0.890804808 1.781609615 0.000000000
px 0 0.786881619 0.786881619 1.573763237 0.000000000
py 0 0.786881029 0.786881029 1.573762057 0.000000000
pz 0 0.779895839 0.779895839 1.559791679 0.000000000
sum over m 2.353658486 2.353658486 4.707316973 0.000000000
px 1 -0.008727087 -0.008727087 -0.017454174 0.000000000
py 1 -0.008730718 -0.008730718 -0.017461435 0.000000000
pz 1 -0.006467591 -0.006467591 -0.012935183 0.000000000
sum over m -0.023925396 -0.023925396 -0.047850792 0.000000000
sum over m+mul 2.329733091 2.329733091 4.659466181 0.000000000
d3z^2-r^2 0 -0.006389848 -0.006389848 -0.012779696 0.000000000
dx^2-y^2 0 -0.005061427 -0.005061427 -0.010122854 0.000000000
dxy 0 -0.005432516 -0.005432516 -0.010865032 0.000000000
dxz 0 -0.006934596 -0.006934596 -0.013869192 0.000000000
dyz 0 -0.006934084 -0.006934084 -0.013868168 0.000000000
sum over m -0.030752471 -0.030752471 -0.061504941 0.000000000
sum over m+mul -0.030752471 -0.030752471 -0.061504941 0.000000000
913 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000784858 1.000784858 2.001569716 0.000000000
sum over m 1.000784858 1.000784858 2.001569716 0.000000000
s 1 0.207406430 0.207406430 0.414812860 0.000000000
sum over m 0.207406430 0.207406430 0.414812860 0.000000000
s 2 0.014723064 0.014723064 0.029446129 0.000000000
sum over m 0.014723064 0.014723064 0.029446129 0.000000000
sum over m+mul 1.222914352 1.222914352 2.445828704 0.000000000
px 0 1.006363600 1.006363600 2.012727200 0.000000000
py 0 1.006381732 1.006381732 2.012763464 0.000000000
pz 0 1.006198562 1.006198562 2.012397125 0.000000000
sum over m 3.018943894 3.018943894 6.037887789 0.000000000
px 1 0.065442820 0.065442820 0.130885640 0.000000000
py 1 0.065428221 0.065428221 0.130856442 0.000000000
pz 1 0.040368160 0.040368160 0.080736319 0.000000000
sum over m 0.171239201 0.171239201 0.342478401 0.000000000
sum over m+mul 3.190183095 3.190183095 6.380366190 0.000000000
d3z^2-r^2 0 0.196306152 0.196306152 0.392612304 0.000000000
dx^2-y^2 0 0.201515767 0.201515767 0.403031535 0.000000000
dxy 0 0.250939759 0.250939759 0.501879517 0.000000000
dxz 0 0.268506732 0.268506732 0.537013464 0.000000000
dyz 0 0.268483614 0.268483614 0.536967227 0.000000000
sum over m 1.185752023 1.185752023 2.371504046 0.000000000
d3z^2-r^2 1 0.003471637 0.003471637 0.006943275 0.000000000
dx^2-y^2 1 -0.004480560 -0.004480560 -0.008961121 0.000000000
dxy 1 0.015341408 0.015341408 0.030682816 0.000000000
dxz 1 0.003488934 0.003488934 0.006977868 0.000000000
dyz 1 0.003487605 0.003487605 0.006975210 0.000000000
sum over m 0.021309024 0.021309024 0.042618048 0.000000000
sum over m+mul 1.207061047 1.207061047 2.414122094 0.000000000
914 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000783643 1.000783643 2.001567285 0.000000000
sum over m 1.000783643 1.000783643 2.001567285 0.000000000
s 1 0.207408351 0.207408351 0.414816702 0.000000000
sum over m 0.207408351 0.207408351 0.414816702 0.000000000
s 2 0.014721554 0.014721554 0.029443107 0.000000000
sum over m 0.014721554 0.014721554 0.029443107 0.000000000
sum over m+mul 1.222913547 1.222913547 2.445827095 0.000000000
px 0 1.006375218 1.006375218 2.012750436 0.000000000
py 0 1.006384949 1.006384949 2.012769898 0.000000000
pz 0 1.006197785 1.006197785 2.012395569 0.000000000
sum over m 3.018957952 3.018957952 6.037915903 0.000000000
px 1 0.065438475 0.065438475 0.130876949 0.000000000
py 1 0.065427635 0.065427635 0.130855270 0.000000000
pz 1 0.040371962 0.040371962 0.080743925 0.000000000
sum over m 0.171238072 0.171238072 0.342476144 0.000000000
sum over m+mul 3.190196024 3.190196024 6.380392047 0.000000000
d3z^2-r^2 0 0.196324306 0.196324306 0.392648612 0.000000000
dx^2-y^2 0 0.201532272 0.201532272 0.403064545 0.000000000
dxy 0 0.250936209 0.250936209 0.501872418 0.000000000
dxz 0 0.268490663 0.268490663 0.536981325 0.000000000
dyz 0 0.268484247 0.268484247 0.536968494 0.000000000
sum over m 1.185767697 1.185767697 2.371535395 0.000000000
d3z^2-r^2 1 0.003473111 0.003473111 0.006946223 0.000000000
dx^2-y^2 1 -0.004482190 -0.004482190 -0.008964379 0.000000000
dxy 1 0.015344359 0.015344359 0.030688718 0.000000000
dxz 1 0.003494209 0.003494209 0.006988418 0.000000000
dyz 1 0.003493350 0.003493350 0.006986700 0.000000000
sum over m 0.021322840 0.021322840 0.042645679 0.000000000
sum over m+mul 1.207090537 1.207090537 2.414181074 0.000000000
915 O Up spin Down spin Sum Diff
multiple
s 0 0.893901335 0.893901335 1.787802670 0.000000000
sum over m 0.893901335 0.893901335 1.787802670 0.000000000
s 1 -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m+mul 0.890859315 0.890859315 1.781718630 0.000000000
px 0 0.787114197 0.787114197 1.574228393 0.000000000
py 0 0.786866759 0.786866759 1.573733517 0.000000000
pz 0 0.779754467 0.779754467 1.559508933 0.000000000
sum over m 2.353735422 2.353735422 4.707470844 0.000000000
px 1 -0.008742321 -0.008742321 -0.017484643 0.000000000
py 1 -0.008738330 -0.008738330 -0.017476661 0.000000000
pz 1 -0.006463117 -0.006463117 -0.012926233 0.000000000
sum over m -0.023943768 -0.023943768 -0.047887537 0.000000000
sum over m+mul 2.329791653 2.329791653 4.659583307 0.000000000
d3z^2-r^2 0 -0.006391142 -0.006391142 -0.012782285 0.000000000
dx^2-y^2 0 -0.005057147 -0.005057147 -0.010114295 0.000000000
dxy 0 -0.005434410 -0.005434410 -0.010868819 0.000000000
dxz 0 -0.006926802 -0.006926802 -0.013853605 0.000000000
dyz 0 -0.006929891 -0.006929891 -0.013859782 0.000000000
sum over m -0.030739393 -0.030739393 -0.061478786 0.000000000
sum over m+mul -0.030739393 -0.030739393 -0.061478786 0.000000000
916 O Up spin Down spin Sum Diff
multiple
s 0 0.893909360 0.893909360 1.787818719 0.000000000
sum over m 0.893909360 0.893909360 1.787818719 0.000000000
s 1 -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m+mul 0.890867990 0.890867990 1.781735980 0.000000000
px 0 0.786826014 0.786826014 1.573652028 0.000000000
py 0 0.787144557 0.787144557 1.574289115 0.000000000
pz 0 0.779778083 0.779778083 1.559556165 0.000000000
sum over m 2.353748654 2.353748654 4.707497308 0.000000000
px 1 -0.008734595 -0.008734595 -0.017469191 0.000000000
py 1 -0.008747399 -0.008747399 -0.017494798 0.000000000
pz 1 -0.006462482 -0.006462482 -0.012924964 0.000000000
sum over m -0.023944477 -0.023944477 -0.047888953 0.000000000
sum over m+mul 2.329804177 2.329804177 4.659608355 0.000000000
d3z^2-r^2 0 -0.006392050 -0.006392050 -0.012784100 0.000000000
dx^2-y^2 0 -0.005058247 -0.005058247 -0.010116495 0.000000000
dxy 0 -0.005435091 -0.005435091 -0.010870182 0.000000000
dxz 0 -0.006932038 -0.006932038 -0.013864076 0.000000000
dyz 0 -0.006926612 -0.006926612 -0.013853224 0.000000000
sum over m -0.030744038 -0.030744038 -0.061488076 0.000000000
sum over m+mul -0.030744038 -0.030744038 -0.061488076 0.000000000
917 O Up spin Down spin Sum Diff
multiple
s 0 0.893910980 0.893910980 1.787821961 0.000000000
sum over m 0.893910980 0.893910980 1.787821961 0.000000000
s 1 -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m+mul 0.890868828 0.890868828 1.781737657 0.000000000
px 0 0.787056163 0.787056163 1.574112326 0.000000000
py 0 0.787000538 0.787000538 1.574001075 0.000000000
pz 0 0.779693219 0.779693219 1.559386438 0.000000000
sum over m 2.353749920 2.353749920 4.707499839 0.000000000
px 1 -0.008736779 -0.008736779 -0.017473557 0.000000000
py 1 -0.008736984 -0.008736984 -0.017473968 0.000000000
pz 1 -0.006460978 -0.006460978 -0.012921957 0.000000000
sum over m -0.023934741 -0.023934741 -0.047869482 0.000000000
sum over m+mul 2.329815179 2.329815179 4.659630357 0.000000000
d3z^2-r^2 0 -0.006391148 -0.006391148 -0.012782297 0.000000000
dx^2-y^2 0 -0.005053457 -0.005053457 -0.010106915 0.000000000
dxy 0 -0.005434790 -0.005434790 -0.010869579 0.000000000
dxz 0 -0.006924704 -0.006924704 -0.013849407 0.000000000
dyz 0 -0.006925110 -0.006925110 -0.013850219 0.000000000
sum over m -0.030729209 -0.030729209 -0.061458417 0.000000000
sum over m+mul -0.030729209 -0.030729209 -0.061458417 0.000000000
918 O Up spin Down spin Sum Diff
multiple
s 0 0.893846619 0.893846619 1.787693238 0.000000000
sum over m 0.893846619 0.893846619 1.787693238 0.000000000
s 1 -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m+mul 0.890804808 0.890804808 1.781609616 0.000000000
px 0 0.786881618 0.786881618 1.573763237 0.000000000
py 0 0.786881029 0.786881029 1.573762057 0.000000000
pz 0 0.779895839 0.779895839 1.559791679 0.000000000
sum over m 2.353658487 2.353658487 4.707316973 0.000000000
px 1 -0.008727087 -0.008727087 -0.017454174 0.000000000
py 1 -0.008730718 -0.008730718 -0.017461435 0.000000000
pz 1 -0.006467591 -0.006467591 -0.012935183 0.000000000
sum over m -0.023925396 -0.023925396 -0.047850792 0.000000000
sum over m+mul 2.329733091 2.329733091 4.659466182 0.000000000
d3z^2-r^2 0 -0.006389848 -0.006389848 -0.012779696 0.000000000
dx^2-y^2 0 -0.005061427 -0.005061427 -0.010122854 0.000000000
dxy 0 -0.005432516 -0.005432516 -0.010865032 0.000000000
dxz 0 -0.006934596 -0.006934596 -0.013869192 0.000000000
dyz 0 -0.006934084 -0.006934084 -0.013868168 0.000000000
sum over m -0.030752471 -0.030752471 -0.061504941 0.000000000
sum over m+mul -0.030752471 -0.030752471 -0.061504941 0.000000000
919 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000784858 1.000784858 2.001569716 0.000000000
sum over m 1.000784858 1.000784858 2.001569716 0.000000000
s 1 0.207406430 0.207406430 0.414812860 0.000000000
sum over m 0.207406430 0.207406430 0.414812860 0.000000000
s 2 0.014723064 0.014723064 0.029446129 0.000000000
sum over m 0.014723064 0.014723064 0.029446129 0.000000000
sum over m+mul 1.222914352 1.222914352 2.445828704 0.000000000
px 0 1.006363600 1.006363600 2.012727200 0.000000000
py 0 1.006381732 1.006381732 2.012763464 0.000000000
pz 0 1.006198562 1.006198562 2.012397125 0.000000000
sum over m 3.018943894 3.018943894 6.037887789 0.000000000
px 1 0.065442820 0.065442820 0.130885641 0.000000000
py 1 0.065428221 0.065428221 0.130856442 0.000000000
pz 1 0.040368160 0.040368160 0.080736319 0.000000000
sum over m 0.171239201 0.171239201 0.342478402 0.000000000
sum over m+mul 3.190183096 3.190183096 6.380366191 0.000000000
d3z^2-r^2 0 0.196306152 0.196306152 0.392612304 0.000000000
dx^2-y^2 0 0.201515767 0.201515767 0.403031535 0.000000000
dxy 0 0.250939758 0.250939758 0.501879517 0.000000000
dxz 0 0.268506732 0.268506732 0.537013463 0.000000000
dyz 0 0.268483614 0.268483614 0.536967227 0.000000000
sum over m 1.185752023 1.185752023 2.371504046 0.000000000
d3z^2-r^2 1 0.003471637 0.003471637 0.006943275 0.000000000
dx^2-y^2 1 -0.004480560 -0.004480560 -0.008961121 0.000000000
dxy 1 0.015341408 0.015341408 0.030682816 0.000000000
dxz 1 0.003488934 0.003488934 0.006977868 0.000000000
dyz 1 0.003487605 0.003487605 0.006975210 0.000000000
sum over m 0.021309024 0.021309024 0.042618048 0.000000000
sum over m+mul 1.207061047 1.207061047 2.414122094 0.000000000
920 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000783643 1.000783643 2.001567285 0.000000000
sum over m 1.000783643 1.000783643 2.001567285 0.000000000
s 1 0.207408351 0.207408351 0.414816702 0.000000000
sum over m 0.207408351 0.207408351 0.414816702 0.000000000
s 2 0.014721554 0.014721554 0.029443107 0.000000000
sum over m 0.014721554 0.014721554 0.029443107 0.000000000
sum over m+mul 1.222913547 1.222913547 2.445827094 0.000000000
px 0 1.006375218 1.006375218 2.012750436 0.000000000
py 0 1.006384949 1.006384949 2.012769898 0.000000000
pz 0 1.006197785 1.006197785 2.012395569 0.000000000
sum over m 3.018957952 3.018957952 6.037915903 0.000000000
px 1 0.065438475 0.065438475 0.130876949 0.000000000
py 1 0.065427635 0.065427635 0.130855270 0.000000000
pz 1 0.040371962 0.040371962 0.080743925 0.000000000
sum over m 0.171238072 0.171238072 0.342476144 0.000000000
sum over m+mul 3.190196023 3.190196023 6.380392047 0.000000000
d3z^2-r^2 0 0.196324306 0.196324306 0.392648612 0.000000000
dx^2-y^2 0 0.201532272 0.201532272 0.403064545 0.000000000
dxy 0 0.250936209 0.250936209 0.501872418 0.000000000
dxz 0 0.268490663 0.268490663 0.536981326 0.000000000
dyz 0 0.268484247 0.268484247 0.536968494 0.000000000
sum over m 1.185767698 1.185767698 2.371535395 0.000000000
d3z^2-r^2 1 0.003473111 0.003473111 0.006946223 0.000000000
dx^2-y^2 1 -0.004482190 -0.004482190 -0.008964379 0.000000000
dxy 1 0.015344359 0.015344359 0.030688719 0.000000000
dxz 1 0.003494209 0.003494209 0.006988418 0.000000000
dyz 1 0.003493350 0.003493350 0.006986700 0.000000000
sum over m 0.021322840 0.021322840 0.042645679 0.000000000
sum over m+mul 1.207090537 1.207090537 2.414181075 0.000000000
921 O Up spin Down spin Sum Diff
multiple
s 0 0.893901335 0.893901335 1.787802670 0.000000000
sum over m 0.893901335 0.893901335 1.787802670 0.000000000
s 1 -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m -0.003042020 -0.003042020 -0.006084040 0.000000000
sum over m+mul 0.890859315 0.890859315 1.781718630 0.000000000
px 0 0.787114197 0.787114197 1.574228393 0.000000000
py 0 0.786866758 0.786866758 1.573733517 0.000000000
pz 0 0.779754467 0.779754467 1.559508933 0.000000000
sum over m 2.353735422 2.353735422 4.707470843 0.000000000
px 1 -0.008742321 -0.008742321 -0.017484643 0.000000000
py 1 -0.008738330 -0.008738330 -0.017476661 0.000000000
pz 1 -0.006463117 -0.006463117 -0.012926233 0.000000000
sum over m -0.023943768 -0.023943768 -0.047887537 0.000000000
sum over m+mul 2.329791653 2.329791653 4.659583306 0.000000000
d3z^2-r^2 0 -0.006391142 -0.006391142 -0.012782285 0.000000000
dx^2-y^2 0 -0.005057147 -0.005057147 -0.010114295 0.000000000
dxy 0 -0.005434410 -0.005434410 -0.010868819 0.000000000
dxz 0 -0.006926802 -0.006926802 -0.013853605 0.000000000
dyz 0 -0.006929891 -0.006929891 -0.013859782 0.000000000
sum over m -0.030739393 -0.030739393 -0.061478786 0.000000000
sum over m+mul -0.030739393 -0.030739393 -0.061478786 0.000000000
922 O Up spin Down spin Sum Diff
multiple
s 0 0.893909360 0.893909360 1.787818719 0.000000000
sum over m 0.893909360 0.893909360 1.787818719 0.000000000
s 1 -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m -0.003041370 -0.003041370 -0.006082739 0.000000000
sum over m+mul 0.890867990 0.890867990 1.781735980 0.000000000
px 0 0.786826014 0.786826014 1.573652028 0.000000000
py 0 0.787144558 0.787144558 1.574289115 0.000000000
pz 0 0.779778083 0.779778083 1.559556165 0.000000000
sum over m 2.353748654 2.353748654 4.707497309 0.000000000
px 1 -0.008734595 -0.008734595 -0.017469191 0.000000000
py 1 -0.008747399 -0.008747399 -0.017494798 0.000000000
pz 1 -0.006462482 -0.006462482 -0.012924964 0.000000000
sum over m -0.023944477 -0.023944477 -0.047888953 0.000000000
sum over m+mul 2.329804178 2.329804178 4.659608356 0.000000000
d3z^2-r^2 0 -0.006392050 -0.006392050 -0.012784100 0.000000000
dx^2-y^2 0 -0.005058247 -0.005058247 -0.010116495 0.000000000
dxy 0 -0.005435091 -0.005435091 -0.010870182 0.000000000
dxz 0 -0.006932038 -0.006932038 -0.013864076 0.000000000
dyz 0 -0.006926612 -0.006926612 -0.013853224 0.000000000
sum over m -0.030744038 -0.030744038 -0.061488076 0.000000000
sum over m+mul -0.030744038 -0.030744038 -0.061488076 0.000000000
923 O Up spin Down spin Sum Diff
multiple
s 0 0.893910980 0.893910980 1.787821960 0.000000000
sum over m 0.893910980 0.893910980 1.787821960 0.000000000
s 1 -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m -0.003042152 -0.003042152 -0.006084304 0.000000000
sum over m+mul 0.890868828 0.890868828 1.781737656 0.000000000
px 0 0.787056163 0.787056163 1.574112326 0.000000000
py 0 0.787000538 0.787000538 1.574001075 0.000000000
pz 0 0.779693219 0.779693219 1.559386438 0.000000000
sum over m 2.353749920 2.353749920 4.707499839 0.000000000
px 1 -0.008736779 -0.008736779 -0.017473557 0.000000000
py 1 -0.008736984 -0.008736984 -0.017473968 0.000000000
pz 1 -0.006460978 -0.006460978 -0.012921957 0.000000000
sum over m -0.023934741 -0.023934741 -0.047869482 0.000000000
sum over m+mul 2.329815179 2.329815179 4.659630358 0.000000000
d3z^2-r^2 0 -0.006391148 -0.006391148 -0.012782297 0.000000000
dx^2-y^2 0 -0.005053457 -0.005053457 -0.010106915 0.000000000
dxy 0 -0.005434790 -0.005434790 -0.010869579 0.000000000
dxz 0 -0.006924704 -0.006924704 -0.013849407 0.000000000
dyz 0 -0.006925110 -0.006925110 -0.013850219 0.000000000
sum over m -0.030729209 -0.030729209 -0.061458417 0.000000000
sum over m+mul -0.030729209 -0.030729209 -0.061458417 0.000000000
924 O Up spin Down spin Sum Diff
multiple
s 0 0.893846619 0.893846619 1.787693238 0.000000000
sum over m 0.893846619 0.893846619 1.787693238 0.000000000
s 1 -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m -0.003041811 -0.003041811 -0.006083622 0.000000000
sum over m+mul 0.890804808 0.890804808 1.781609616 0.000000000
px 0 0.786881619 0.786881619 1.573763237 0.000000000
py 0 0.786881029 0.786881029 1.573762057 0.000000000
pz 0 0.779895839 0.779895839 1.559791678 0.000000000
sum over m 2.353658486 2.353658486 4.707316973 0.000000000
px 1 -0.008727087 -0.008727087 -0.017454174 0.000000000
py 1 -0.008730718 -0.008730718 -0.017461435 0.000000000
pz 1 -0.006467591 -0.006467591 -0.012935183 0.000000000
sum over m -0.023925396 -0.023925396 -0.047850792 0.000000000
sum over m+mul 2.329733091 2.329733091 4.659466181 0.000000000
d3z^2-r^2 0 -0.006389848 -0.006389848 -0.012779696 0.000000000
dx^2-y^2 0 -0.005061427 -0.005061427 -0.010122854 0.000000000
dxy 0 -0.005432516 -0.005432516 -0.010865032 0.000000000
dxz 0 -0.006934596 -0.006934596 -0.013869192 0.000000000
dyz 0 -0.006934084 -0.006934084 -0.013868168 0.000000000
sum over m -0.030752471 -0.030752471 -0.061504941 0.000000000
sum over m+mul -0.030752471 -0.030752471 -0.061504941 0.000000000
925 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000754531 1.000754531 2.001509062 0.000000000
sum over m 1.000754531 1.000754531 2.001509062 0.000000000
s 1 0.207411818 0.207411818 0.414823637 0.000000000
sum over m 0.207411818 0.207411818 0.414823637 0.000000000
s 2 0.014724175 0.014724175 0.029448350 0.000000000
sum over m 0.014724175 0.014724175 0.029448350 0.000000000
sum over m+mul 1.222890524 1.222890524 2.445781048 0.000000000
px 0 1.006383481 1.006383481 2.012766962 0.000000000
py 0 1.006397581 1.006397581 2.012795162 0.000000000
pz 0 1.006194369 1.006194369 2.012388738 0.000000000
sum over m 3.018975431 3.018975431 6.037950862 0.000000000
px 1 0.065410391 0.065410391 0.130820783 0.000000000
py 1 0.065420473 0.065420473 0.130840946 0.000000000
pz 1 0.040382927 0.040382927 0.080765854 0.000000000
sum over m 0.171213791 0.171213791 0.342427583 0.000000000
sum over m+mul 3.190189222 3.190189222 6.380378445 0.000000000
d3z^2-r^2 0 0.196288897 0.196288897 0.392577793 0.000000000
dx^2-y^2 0 0.201525016 0.201525016 0.403050033 0.000000000
dxy 0 0.250915966 0.250915966 0.501831932 0.000000000
dxz 0 0.268517838 0.268517838 0.537035675 0.000000000
dyz 0 0.268508678 0.268508678 0.537017356 0.000000000
sum over m 1.185756394 1.185756394 2.371512789 0.000000000
d3z^2-r^2 1 0.003474672 0.003474672 0.006949344 0.000000000
dx^2-y^2 1 -0.004474966 -0.004474966 -0.008949932 0.000000000
dxy 1 0.015340900 0.015340900 0.030681800 0.000000000
dxz 1 0.003486522 0.003486522 0.006973045 0.000000000
dyz 1 0.003487410 0.003487410 0.006974819 0.000000000
sum over m 0.021314538 0.021314538 0.042629076 0.000000000
sum over m+mul 1.207070932 1.207070932 2.414141865 0.000000000
926 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758743 1.000758743 2.001517485 0.000000000
sum over m 1.000758743 1.000758743 2.001517485 0.000000000
s 1 0.207414910 0.207414910 0.414829820 0.000000000
sum over m 0.207414910 0.207414910 0.414829820 0.000000000
s 2 0.014725535 0.014725535 0.029451070 0.000000000
sum over m 0.014725535 0.014725535 0.029451070 0.000000000
sum over m+mul 1.222899187 1.222899187 2.445798375 0.000000000
px 0 1.006384943 1.006384943 2.012769885 0.000000000
py 0 1.006372704 1.006372704 2.012745408 0.000000000
pz 0 1.006196973 1.006196973 2.012393946 0.000000000
sum over m 3.018954620 3.018954620 6.037909239 0.000000000
px 1 0.065431299 0.065431299 0.130862598 0.000000000
py 1 0.065439817 0.065439817 0.130879633 0.000000000
pz 1 0.040384285 0.040384285 0.080768570 0.000000000
sum over m 0.171255401 0.171255401 0.342510802 0.000000000
sum over m+mul 3.190210021 3.190210021 6.380420041 0.000000000
d3z^2-r^2 0 0.196319114 0.196319114 0.392638228 0.000000000
dx^2-y^2 0 0.201523315 0.201523315 0.403046631 0.000000000
dxy 0 0.250932369 0.250932369 0.501864739 0.000000000
dxz 0 0.268496820 0.268496820 0.536993639 0.000000000
dyz 0 0.268505638 0.268505638 0.537011276 0.000000000
sum over m 1.185777256 1.185777256 2.371554513 0.000000000
d3z^2-r^2 1 0.003478698 0.003478698 0.006957395 0.000000000
dx^2-y^2 1 -0.004474298 -0.004474298 -0.008948596 0.000000000
dxy 1 0.015342454 0.015342454 0.030684909 0.000000000
dxz 1 0.003496402 0.003496402 0.006992803 0.000000000
dyz 1 0.003497584 0.003497584 0.006995168 0.000000000
sum over m 0.021340839 0.021340839 0.042681678 0.000000000
sum over m+mul 1.207118096 1.207118096 2.414236191 0.000000000
927 O Up spin Down spin Sum Diff
multiple
s 0 0.893905933 0.893905933 1.787811867 0.000000000
sum over m 0.893905933 0.893905933 1.787811867 0.000000000
s 1 -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m+mul 0.890863858 0.890863858 1.781727717 0.000000000
px 0 0.787143493 0.787143493 1.574286987 0.000000000
py 0 0.786822811 0.786822811 1.573645622 0.000000000
pz 0 0.779781122 0.779781122 1.559562245 0.000000000
sum over m 2.353747427 2.353747427 4.707494853 0.000000000
px 1 -0.008746988 -0.008746988 -0.017493976 0.000000000
py 1 -0.008735009 -0.008735009 -0.017470018 0.000000000
pz 1 -0.006461732 -0.006461732 -0.012923463 0.000000000
sum over m -0.023943729 -0.023943729 -0.047887457 0.000000000
sum over m+mul 2.329803698 2.329803698 4.659607396 0.000000000
d3z^2-r^2 0 -0.006391211 -0.006391211 -0.012782421 0.000000000
dx^2-y^2 0 -0.005058570 -0.005058570 -0.010117141 0.000000000
dxy 0 -0.005434801 -0.005434801 -0.010869602 0.000000000
dxz 0 -0.006926741 -0.006926741 -0.013853482 0.000000000
dyz 0 -0.006933434 -0.006933434 -0.013866868 0.000000000
sum over m -0.030744757 -0.030744757 -0.061489514 0.000000000
sum over m+mul -0.030744757 -0.030744757 -0.061489514 0.000000000
928 O Up spin Down spin Sum Diff
multiple
s 0 0.893886844 0.893886844 1.787773688 0.000000000
sum over m 0.893886844 0.893886844 1.787773688 0.000000000
s 1 -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m+mul 0.890844535 0.890844535 1.781689070 0.000000000
px 0 0.786825603 0.786825603 1.573651206 0.000000000
py 0 0.787087238 0.787087238 1.574174476 0.000000000
pz 0 0.779800672 0.779800672 1.559601343 0.000000000
sum over m 2.353713512 2.353713512 4.707427025 0.000000000
px 1 -0.008737361 -0.008737361 -0.017474723 0.000000000
py 1 -0.008741148 -0.008741148 -0.017482296 0.000000000
pz 1 -0.006464051 -0.006464051 -0.012928103 0.000000000
sum over m -0.023942560 -0.023942560 -0.047885121 0.000000000
sum over m+mul 2.329770952 2.329770952 4.659541904 0.000000000
d3z^2-r^2 0 -0.006390264 -0.006390264 -0.012780528 0.000000000
dx^2-y^2 0 -0.005059183 -0.005059183 -0.010118366 0.000000000
dxy 0 -0.005433461 -0.005433461 -0.010866922 0.000000000
dxz 0 -0.006932932 -0.006932932 -0.013865865 0.000000000
dyz 0 -0.006928949 -0.006928949 -0.013857898 0.000000000
sum over m -0.030744789 -0.030744789 -0.061489578 0.000000000
sum over m+mul -0.030744789 -0.030744789 -0.061489578 0.000000000
929 O Up spin Down spin Sum Diff
multiple
s 0 0.893907585 0.893907585 1.787815171 0.000000000
sum over m 0.893907585 0.893907585 1.787815171 0.000000000
s 1 -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m+mul 0.890865012 0.890865012 1.781730024 0.000000000
px 0 0.787044942 0.787044942 1.574089885 0.000000000
py 0 0.787047565 0.787047565 1.574095130 0.000000000
pz 0 0.779681978 0.779681978 1.559363955 0.000000000
sum over m 2.353774485 2.353774485 4.707548969 0.000000000
px 1 -0.008732352 -0.008732352 -0.017464704 0.000000000
py 1 -0.008730546 -0.008730546 -0.017461092 0.000000000
pz 1 -0.006453076 -0.006453076 -0.012906152 0.000000000
sum over m -0.023915974 -0.023915974 -0.047831948 0.000000000
sum over m+mul 2.329858511 2.329858511 4.659717021 0.000000000
d3z^2-r^2 0 -0.006390178 -0.006390178 -0.012780355 0.000000000
dx^2-y^2 0 -0.005052335 -0.005052335 -0.010104670 0.000000000
dxy 0 -0.005435478 -0.005435478 -0.010870956 0.000000000
dxz 0 -0.006923240 -0.006923240 -0.013846479 0.000000000
dyz 0 -0.006924277 -0.006924277 -0.013848555 0.000000000
sum over m -0.030725507 -0.030725507 -0.061451015 0.000000000
sum over m+mul -0.030725507 -0.030725507 -0.061451015 0.000000000
930 O Up spin Down spin Sum Diff
multiple
s 0 0.893853134 0.893853134 1.787706267 0.000000000
sum over m 0.893853134 0.893853134 1.787706267 0.000000000
s 1 -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m+mul 0.890810709 0.890810709 1.781621418 0.000000000
px 0 0.786858059 0.786858059 1.573716119 0.000000000
py 0 0.786921166 0.786921166 1.573842332 0.000000000
pz 0 0.779871468 0.779871468 1.559742937 0.000000000
sum over m 2.353650694 2.353650694 4.707301388 0.000000000
px 1 -0.008736997 -0.008736997 -0.017473994 0.000000000
py 1 -0.008736407 -0.008736407 -0.017472815 0.000000000
pz 1 -0.006466568 -0.006466568 -0.012933136 0.000000000
sum over m -0.023939972 -0.023939972 -0.047879944 0.000000000
sum over m+mul 2.329710722 2.329710722 4.659421443 0.000000000
d3z^2-r^2 0 -0.006389349 -0.006389349 -0.012778697 0.000000000
dx^2-y^2 0 -0.005061152 -0.005061152 -0.010122305 0.000000000
dxy 0 -0.005431835 -0.005431835 -0.010863669 0.000000000
dxz 0 -0.006935035 -0.006935035 -0.013870070 0.000000000
dyz 0 -0.006934510 -0.006934510 -0.013869019 0.000000000
sum over m -0.030751880 -0.030751880 -0.061503761 0.000000000
sum over m+mul -0.030751880 -0.030751880 -0.061503761 0.000000000
931 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000754531 1.000754531 2.001509062 0.000000000
sum over m 1.000754531 1.000754531 2.001509062 0.000000000
s 1 0.207411818 0.207411818 0.414823636 0.000000000
sum over m 0.207411818 0.207411818 0.414823636 0.000000000
s 2 0.014724175 0.014724175 0.029448350 0.000000000
sum over m 0.014724175 0.014724175 0.029448350 0.000000000
sum over m+mul 1.222890524 1.222890524 2.445781048 0.000000000
px 0 1.006383481 1.006383481 2.012766962 0.000000000
py 0 1.006397581 1.006397581 2.012795162 0.000000000
pz 0 1.006194369 1.006194369 2.012388738 0.000000000
sum over m 3.018975431 3.018975431 6.037950862 0.000000000
px 1 0.065410391 0.065410391 0.130820783 0.000000000
py 1 0.065420473 0.065420473 0.130840947 0.000000000
pz 1 0.040382927 0.040382927 0.080765854 0.000000000
sum over m 0.171213792 0.171213792 0.342427583 0.000000000
sum over m+mul 3.190189223 3.190189223 6.380378445 0.000000000
d3z^2-r^2 0 0.196288897 0.196288897 0.392577794 0.000000000
dx^2-y^2 0 0.201525017 0.201525017 0.403050033 0.000000000
dxy 0 0.250915966 0.250915966 0.501831931 0.000000000
dxz 0 0.268517838 0.268517838 0.537035675 0.000000000
dyz 0 0.268508678 0.268508678 0.537017356 0.000000000
sum over m 1.185756395 1.185756395 2.371512789 0.000000000
d3z^2-r^2 1 0.003474672 0.003474672 0.006949344 0.000000000
dx^2-y^2 1 -0.004474966 -0.004474966 -0.008949931 0.000000000
dxy 1 0.015340900 0.015340900 0.030681800 0.000000000
dxz 1 0.003486522 0.003486522 0.006973045 0.000000000
dyz 1 0.003487410 0.003487410 0.006974819 0.000000000
sum over m 0.021314538 0.021314538 0.042629076 0.000000000
sum over m+mul 1.207070933 1.207070933 2.414141865 0.000000000
932 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758743 1.000758743 2.001517485 0.000000000
sum over m 1.000758743 1.000758743 2.001517485 0.000000000
s 1 0.207414910 0.207414910 0.414829820 0.000000000
sum over m 0.207414910 0.207414910 0.414829820 0.000000000
s 2 0.014725535 0.014725535 0.029451070 0.000000000
sum over m 0.014725535 0.014725535 0.029451070 0.000000000
sum over m+mul 1.222899188 1.222899188 2.445798376 0.000000000
px 0 1.006384943 1.006384943 2.012769885 0.000000000
py 0 1.006372704 1.006372704 2.012745408 0.000000000
pz 0 1.006196973 1.006196973 2.012393946 0.000000000
sum over m 3.018954620 3.018954620 6.037909239 0.000000000
px 1 0.065431299 0.065431299 0.130862599 0.000000000
py 1 0.065439817 0.065439817 0.130879633 0.000000000
pz 1 0.040384286 0.040384286 0.080768571 0.000000000
sum over m 0.171255402 0.171255402 0.342510803 0.000000000
sum over m+mul 3.190210021 3.190210021 6.380420042 0.000000000
d3z^2-r^2 0 0.196319114 0.196319114 0.392638228 0.000000000
dx^2-y^2 0 0.201523316 0.201523316 0.403046631 0.000000000
dxy 0 0.250932369 0.250932369 0.501864739 0.000000000
dxz 0 0.268496819 0.268496819 0.536993639 0.000000000
dyz 0 0.268505638 0.268505638 0.537011276 0.000000000
sum over m 1.185777256 1.185777256 2.371554512 0.000000000
d3z^2-r^2 1 0.003478698 0.003478698 0.006957395 0.000000000
dx^2-y^2 1 -0.004474298 -0.004474298 -0.008948596 0.000000000
dxy 1 0.015342454 0.015342454 0.030684909 0.000000000
dxz 1 0.003496402 0.003496402 0.006992803 0.000000000
dyz 1 0.003497584 0.003497584 0.006995168 0.000000000
sum over m 0.021340839 0.021340839 0.042681678 0.000000000
sum over m+mul 1.207118095 1.207118095 2.414236190 0.000000000
933 O Up spin Down spin Sum Diff
multiple
s 0 0.893905933 0.893905933 1.787811867 0.000000000
sum over m 0.893905933 0.893905933 1.787811867 0.000000000
s 1 -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m+mul 0.890863858 0.890863858 1.781727717 0.000000000
px 0 0.787143494 0.787143494 1.574286987 0.000000000
py 0 0.786822811 0.786822811 1.573645622 0.000000000
pz 0 0.779781123 0.779781123 1.559562245 0.000000000
sum over m 2.353747427 2.353747427 4.707494855 0.000000000
px 1 -0.008746988 -0.008746988 -0.017493976 0.000000000
py 1 -0.008735009 -0.008735009 -0.017470018 0.000000000
pz 1 -0.006461732 -0.006461732 -0.012923463 0.000000000
sum over m -0.023943729 -0.023943729 -0.047887457 0.000000000
sum over m+mul 2.329803699 2.329803699 4.659607397 0.000000000
d3z^2-r^2 0 -0.006391211 -0.006391211 -0.012782421 0.000000000
dx^2-y^2 0 -0.005058570 -0.005058570 -0.010117140 0.000000000
dxy 0 -0.005434801 -0.005434801 -0.010869602 0.000000000
dxz 0 -0.006926741 -0.006926741 -0.013853482 0.000000000
dyz 0 -0.006933434 -0.006933434 -0.013866868 0.000000000
sum over m -0.030744757 -0.030744757 -0.061489514 0.000000000
sum over m+mul -0.030744757 -0.030744757 -0.061489514 0.000000000
934 O Up spin Down spin Sum Diff
multiple
s 0 0.893886844 0.893886844 1.787773688 0.000000000
sum over m 0.893886844 0.893886844 1.787773688 0.000000000
s 1 -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m+mul 0.890844535 0.890844535 1.781689070 0.000000000
px 0 0.786825603 0.786825603 1.573651206 0.000000000
py 0 0.787087238 0.787087238 1.574174476 0.000000000
pz 0 0.779800671 0.779800671 1.559601343 0.000000000
sum over m 2.353713512 2.353713512 4.707427024 0.000000000
px 1 -0.008737361 -0.008737361 -0.017474723 0.000000000
py 1 -0.008741148 -0.008741148 -0.017482296 0.000000000
pz 1 -0.006464051 -0.006464051 -0.012928103 0.000000000
sum over m -0.023942560 -0.023942560 -0.047885121 0.000000000
sum over m+mul 2.329770952 2.329770952 4.659541903 0.000000000
d3z^2-r^2 0 -0.006390264 -0.006390264 -0.012780528 0.000000000
dx^2-y^2 0 -0.005059183 -0.005059183 -0.010118366 0.000000000
dxy 0 -0.005433461 -0.005433461 -0.010866922 0.000000000
dxz 0 -0.006932932 -0.006932932 -0.013865865 0.000000000
dyz 0 -0.006928949 -0.006928949 -0.013857898 0.000000000
sum over m -0.030744789 -0.030744789 -0.061489578 0.000000000
sum over m+mul -0.030744789 -0.030744789 -0.061489578 0.000000000
935 O Up spin Down spin Sum Diff
multiple
s 0 0.893907585 0.893907585 1.787815171 0.000000000
sum over m 0.893907585 0.893907585 1.787815171 0.000000000
s 1 -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m+mul 0.890865012 0.890865012 1.781730024 0.000000000
px 0 0.787044942 0.787044942 1.574089885 0.000000000
py 0 0.787047565 0.787047565 1.574095129 0.000000000
pz 0 0.779681978 0.779681978 1.559363955 0.000000000
sum over m 2.353774485 2.353774485 4.707548970 0.000000000
px 1 -0.008732352 -0.008732352 -0.017464704 0.000000000
py 1 -0.008730546 -0.008730546 -0.017461092 0.000000000
pz 1 -0.006453076 -0.006453076 -0.012906152 0.000000000
sum over m -0.023915974 -0.023915974 -0.047831948 0.000000000
sum over m+mul 2.329858511 2.329858511 4.659717022 0.000000000
d3z^2-r^2 0 -0.006390178 -0.006390178 -0.012780355 0.000000000
dx^2-y^2 0 -0.005052335 -0.005052335 -0.010104670 0.000000000
dxy 0 -0.005435478 -0.005435478 -0.010870956 0.000000000
dxz 0 -0.006923240 -0.006923240 -0.013846479 0.000000000
dyz 0 -0.006924277 -0.006924277 -0.013848555 0.000000000
sum over m -0.030725507 -0.030725507 -0.061451015 0.000000000
sum over m+mul -0.030725507 -0.030725507 -0.061451015 0.000000000
936 O Up spin Down spin Sum Diff
multiple
s 0 0.893853134 0.893853134 1.787706267 0.000000000
sum over m 0.893853134 0.893853134 1.787706267 0.000000000
s 1 -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m+mul 0.890810709 0.890810709 1.781621419 0.000000000
px 0 0.786858059 0.786858059 1.573716119 0.000000000
py 0 0.786921166 0.786921166 1.573842333 0.000000000
pz 0 0.779871468 0.779871468 1.559742937 0.000000000
sum over m 2.353650694 2.353650694 4.707301389 0.000000000
px 1 -0.008736997 -0.008736997 -0.017473994 0.000000000
py 1 -0.008736407 -0.008736407 -0.017472815 0.000000000
pz 1 -0.006466568 -0.006466568 -0.012933136 0.000000000
sum over m -0.023939972 -0.023939972 -0.047879944 0.000000000
sum over m+mul 2.329710722 2.329710722 4.659421444 0.000000000
d3z^2-r^2 0 -0.006389349 -0.006389349 -0.012778697 0.000000000
dx^2-y^2 0 -0.005061152 -0.005061152 -0.010122305 0.000000000
dxy 0 -0.005431835 -0.005431835 -0.010863669 0.000000000
dxz 0 -0.006935035 -0.006935035 -0.013870070 0.000000000
dyz 0 -0.006934510 -0.006934510 -0.013869019 0.000000000
sum over m -0.030751880 -0.030751880 -0.061503761 0.000000000
sum over m+mul -0.030751880 -0.030751880 -0.061503761 0.000000000
937 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000754531 1.000754531 2.001509062 0.000000000
sum over m 1.000754531 1.000754531 2.001509062 0.000000000
s 1 0.207411818 0.207411818 0.414823636 0.000000000
sum over m 0.207411818 0.207411818 0.414823636 0.000000000
s 2 0.014724175 0.014724175 0.029448350 0.000000000
sum over m 0.014724175 0.014724175 0.029448350 0.000000000
sum over m+mul 1.222890524 1.222890524 2.445781048 0.000000000
px 0 1.006383481 1.006383481 2.012766962 0.000000000
py 0 1.006397581 1.006397581 2.012795161 0.000000000
pz 0 1.006194369 1.006194369 2.012388738 0.000000000
sum over m 3.018975431 3.018975431 6.037950861 0.000000000
px 1 0.065410391 0.065410391 0.130820783 0.000000000
py 1 0.065420473 0.065420473 0.130840947 0.000000000
pz 1 0.040382927 0.040382927 0.080765854 0.000000000
sum over m 0.171213792 0.171213792 0.342427583 0.000000000
sum over m+mul 3.190189222 3.190189222 6.380378445 0.000000000
d3z^2-r^2 0 0.196288897 0.196288897 0.392577794 0.000000000
dx^2-y^2 0 0.201525017 0.201525017 0.403050033 0.000000000
dxy 0 0.250915965 0.250915965 0.501831931 0.000000000
dxz 0 0.268517838 0.268517838 0.537035675 0.000000000
dyz 0 0.268508678 0.268508678 0.537017356 0.000000000
sum over m 1.185756395 1.185756395 2.371512789 0.000000000
d3z^2-r^2 1 0.003474672 0.003474672 0.006949344 0.000000000
dx^2-y^2 1 -0.004474966 -0.004474966 -0.008949931 0.000000000
dxy 1 0.015340900 0.015340900 0.030681800 0.000000000
dxz 1 0.003486522 0.003486522 0.006973045 0.000000000
dyz 1 0.003487410 0.003487410 0.006974820 0.000000000
sum over m 0.021314538 0.021314538 0.042629076 0.000000000
sum over m+mul 1.207070933 1.207070933 2.414141865 0.000000000
938 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758742 1.000758742 2.001517485 0.000000000
sum over m 1.000758742 1.000758742 2.001517485 0.000000000
s 1 0.207414909 0.207414909 0.414829819 0.000000000
sum over m 0.207414909 0.207414909 0.414829819 0.000000000
s 2 0.014725535 0.014725535 0.029451070 0.000000000
sum over m 0.014725535 0.014725535 0.029451070 0.000000000
sum over m+mul 1.222899187 1.222899187 2.445798374 0.000000000
px 0 1.006384943 1.006384943 2.012769885 0.000000000
py 0 1.006372704 1.006372704 2.012745408 0.000000000
pz 0 1.006196973 1.006196973 2.012393946 0.000000000
sum over m 3.018954620 3.018954620 6.037909239 0.000000000
px 1 0.065431299 0.065431299 0.130862599 0.000000000
py 1 0.065439816 0.065439816 0.130879633 0.000000000
pz 1 0.040384285 0.040384285 0.080768571 0.000000000
sum over m 0.171255401 0.171255401 0.342510803 0.000000000
sum over m+mul 3.190210021 3.190210021 6.380420042 0.000000000
d3z^2-r^2 0 0.196319114 0.196319114 0.392638228 0.000000000
dx^2-y^2 0 0.201523316 0.201523316 0.403046632 0.000000000
dxy 0 0.250932369 0.250932369 0.501864739 0.000000000
dxz 0 0.268496820 0.268496820 0.536993639 0.000000000
dyz 0 0.268505638 0.268505638 0.537011276 0.000000000
sum over m 1.185777257 1.185777257 2.371554513 0.000000000
d3z^2-r^2 1 0.003478698 0.003478698 0.006957395 0.000000000
dx^2-y^2 1 -0.004474298 -0.004474298 -0.008948596 0.000000000
dxy 1 0.015342454 0.015342454 0.030684909 0.000000000
dxz 1 0.003496402 0.003496402 0.006992803 0.000000000
dyz 1 0.003497584 0.003497584 0.006995168 0.000000000
sum over m 0.021340839 0.021340839 0.042681678 0.000000000
sum over m+mul 1.207118096 1.207118096 2.414236192 0.000000000
939 O Up spin Down spin Sum Diff
multiple
s 0 0.893905933 0.893905933 1.787811867 0.000000000
sum over m 0.893905933 0.893905933 1.787811867 0.000000000
s 1 -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m+mul 0.890863858 0.890863858 1.781727717 0.000000000
px 0 0.787143494 0.787143494 1.574286987 0.000000000
py 0 0.786822811 0.786822811 1.573645622 0.000000000
pz 0 0.779781122 0.779781122 1.559562245 0.000000000
sum over m 2.353747427 2.353747427 4.707494854 0.000000000
px 1 -0.008746988 -0.008746988 -0.017493976 0.000000000
py 1 -0.008735009 -0.008735009 -0.017470018 0.000000000
pz 1 -0.006461732 -0.006461732 -0.012923463 0.000000000
sum over m -0.023943729 -0.023943729 -0.047887457 0.000000000
sum over m+mul 2.329803698 2.329803698 4.659607397 0.000000000
d3z^2-r^2 0 -0.006391211 -0.006391211 -0.012782421 0.000000000
dx^2-y^2 0 -0.005058570 -0.005058570 -0.010117140 0.000000000
dxy 0 -0.005434801 -0.005434801 -0.010869602 0.000000000
dxz 0 -0.006926741 -0.006926741 -0.013853482 0.000000000
dyz 0 -0.006933434 -0.006933434 -0.013866868 0.000000000
sum over m -0.030744757 -0.030744757 -0.061489514 0.000000000
sum over m+mul -0.030744757 -0.030744757 -0.061489514 0.000000000
940 O Up spin Down spin Sum Diff
multiple
s 0 0.893886844 0.893886844 1.787773688 0.000000000
sum over m 0.893886844 0.893886844 1.787773688 0.000000000
s 1 -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m+mul 0.890844535 0.890844535 1.781689070 0.000000000
px 0 0.786825603 0.786825603 1.573651206 0.000000000
py 0 0.787087238 0.787087238 1.574174475 0.000000000
pz 0 0.779800671 0.779800671 1.559601343 0.000000000
sum over m 2.353713512 2.353713512 4.707427024 0.000000000
px 1 -0.008737361 -0.008737361 -0.017474723 0.000000000
py 1 -0.008741148 -0.008741148 -0.017482296 0.000000000
pz 1 -0.006464051 -0.006464051 -0.012928103 0.000000000
sum over m -0.023942560 -0.023942560 -0.047885121 0.000000000
sum over m+mul 2.329770952 2.329770952 4.659541904 0.000000000
d3z^2-r^2 0 -0.006390264 -0.006390264 -0.012780528 0.000000000
dx^2-y^2 0 -0.005059183 -0.005059183 -0.010118366 0.000000000
dxy 0 -0.005433461 -0.005433461 -0.010866922 0.000000000
dxz 0 -0.006932932 -0.006932932 -0.013865865 0.000000000
dyz 0 -0.006928949 -0.006928949 -0.013857898 0.000000000
sum over m -0.030744789 -0.030744789 -0.061489578 0.000000000
sum over m+mul -0.030744789 -0.030744789 -0.061489578 0.000000000
941 O Up spin Down spin Sum Diff
multiple
s 0 0.893907585 0.893907585 1.787815171 0.000000000
sum over m 0.893907585 0.893907585 1.787815171 0.000000000
s 1 -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m+mul 0.890865012 0.890865012 1.781730024 0.000000000
px 0 0.787044942 0.787044942 1.574089884 0.000000000
py 0 0.787047565 0.787047565 1.574095129 0.000000000
pz 0 0.779681978 0.779681978 1.559363955 0.000000000
sum over m 2.353774484 2.353774484 4.707548969 0.000000000
px 1 -0.008732352 -0.008732352 -0.017464704 0.000000000
py 1 -0.008730546 -0.008730546 -0.017461092 0.000000000
pz 1 -0.006453076 -0.006453076 -0.012906152 0.000000000
sum over m -0.023915974 -0.023915974 -0.047831948 0.000000000
sum over m+mul 2.329858510 2.329858510 4.659717021 0.000000000
d3z^2-r^2 0 -0.006390178 -0.006390178 -0.012780355 0.000000000
dx^2-y^2 0 -0.005052335 -0.005052335 -0.010104670 0.000000000
dxy 0 -0.005435478 -0.005435478 -0.010870956 0.000000000
dxz 0 -0.006923240 -0.006923240 -0.013846479 0.000000000
dyz 0 -0.006924277 -0.006924277 -0.013848555 0.000000000
sum over m -0.030725507 -0.030725507 -0.061451015 0.000000000
sum over m+mul -0.030725507 -0.030725507 -0.061451015 0.000000000
942 O Up spin Down spin Sum Diff
multiple
s 0 0.893853134 0.893853134 1.787706267 0.000000000
sum over m 0.893853134 0.893853134 1.787706267 0.000000000
s 1 -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m+mul 0.890810709 0.890810709 1.781621419 0.000000000
px 0 0.786858059 0.786858059 1.573716118 0.000000000
py 0 0.786921166 0.786921166 1.573842333 0.000000000
pz 0 0.779871468 0.779871468 1.559742937 0.000000000
sum over m 2.353650694 2.353650694 4.707301388 0.000000000
px 1 -0.008736997 -0.008736997 -0.017473994 0.000000000
py 1 -0.008736407 -0.008736407 -0.017472815 0.000000000
pz 1 -0.006466568 -0.006466568 -0.012933136 0.000000000
sum over m -0.023939972 -0.023939972 -0.047879944 0.000000000
sum over m+mul 2.329710722 2.329710722 4.659421443 0.000000000
d3z^2-r^2 0 -0.006389349 -0.006389349 -0.012778697 0.000000000
dx^2-y^2 0 -0.005061152 -0.005061152 -0.010122305 0.000000000
dxy 0 -0.005431835 -0.005431835 -0.010863669 0.000000000
dxz 0 -0.006935035 -0.006935035 -0.013870070 0.000000000
dyz 0 -0.006934510 -0.006934510 -0.013869019 0.000000000
sum over m -0.030751880 -0.030751880 -0.061503761 0.000000000
sum over m+mul -0.030751880 -0.030751880 -0.061503761 0.000000000
943 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000754531 1.000754531 2.001509062 0.000000000
sum over m 1.000754531 1.000754531 2.001509062 0.000000000
s 1 0.207411818 0.207411818 0.414823636 0.000000000
sum over m 0.207411818 0.207411818 0.414823636 0.000000000
s 2 0.014724175 0.014724175 0.029448350 0.000000000
sum over m 0.014724175 0.014724175 0.029448350 0.000000000
sum over m+mul 1.222890524 1.222890524 2.445781048 0.000000000
px 0 1.006383481 1.006383481 2.012766962 0.000000000
py 0 1.006397581 1.006397581 2.012795162 0.000000000
pz 0 1.006194369 1.006194369 2.012388738 0.000000000
sum over m 3.018975431 3.018975431 6.037950862 0.000000000
px 1 0.065410391 0.065410391 0.130820782 0.000000000
py 1 0.065420473 0.065420473 0.130840947 0.000000000
pz 1 0.040382927 0.040382927 0.080765854 0.000000000
sum over m 0.171213792 0.171213792 0.342427583 0.000000000
sum over m+mul 3.190189223 3.190189223 6.380378445 0.000000000
d3z^2-r^2 0 0.196288897 0.196288897 0.392577794 0.000000000
dx^2-y^2 0 0.201525016 0.201525016 0.403050033 0.000000000
dxy 0 0.250915966 0.250915966 0.501831932 0.000000000
dxz 0 0.268517838 0.268517838 0.537035675 0.000000000
dyz 0 0.268508678 0.268508678 0.537017356 0.000000000
sum over m 1.185756395 1.185756395 2.371512789 0.000000000
d3z^2-r^2 1 0.003474672 0.003474672 0.006949344 0.000000000
dx^2-y^2 1 -0.004474966 -0.004474966 -0.008949931 0.000000000
dxy 1 0.015340900 0.015340900 0.030681800 0.000000000
dxz 1 0.003486522 0.003486522 0.006973045 0.000000000
dyz 1 0.003487410 0.003487410 0.006974819 0.000000000
sum over m 0.021314538 0.021314538 0.042629076 0.000000000
sum over m+mul 1.207070933 1.207070933 2.414141865 0.000000000
944 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758743 1.000758743 2.001517485 0.000000000
sum over m 1.000758743 1.000758743 2.001517485 0.000000000
s 1 0.207414910 0.207414910 0.414829820 0.000000000
sum over m 0.207414910 0.207414910 0.414829820 0.000000000
s 2 0.014725535 0.014725535 0.029451070 0.000000000
sum over m 0.014725535 0.014725535 0.029451070 0.000000000
sum over m+mul 1.222899188 1.222899188 2.445798375 0.000000000
px 0 1.006384943 1.006384943 2.012769885 0.000000000
py 0 1.006372704 1.006372704 2.012745408 0.000000000
pz 0 1.006196973 1.006196973 2.012393946 0.000000000
sum over m 3.018954620 3.018954620 6.037909240 0.000000000
px 1 0.065431299 0.065431299 0.130862598 0.000000000
py 1 0.065439816 0.065439816 0.130879633 0.000000000
pz 1 0.040384285 0.040384285 0.080768571 0.000000000
sum over m 0.171255401 0.171255401 0.342510802 0.000000000
sum over m+mul 3.190210021 3.190210021 6.380420042 0.000000000
d3z^2-r^2 0 0.196319114 0.196319114 0.392638228 0.000000000
dx^2-y^2 0 0.201523316 0.201523316 0.403046632 0.000000000
dxy 0 0.250932369 0.250932369 0.501864739 0.000000000
dxz 0 0.268496819 0.268496819 0.536993639 0.000000000
dyz 0 0.268505638 0.268505638 0.537011276 0.000000000
sum over m 1.185777257 1.185777257 2.371554513 0.000000000
d3z^2-r^2 1 0.003478698 0.003478698 0.006957395 0.000000000
dx^2-y^2 1 -0.004474298 -0.004474298 -0.008948596 0.000000000
dxy 1 0.015342454 0.015342454 0.030684909 0.000000000
dxz 1 0.003496402 0.003496402 0.006992803 0.000000000
dyz 1 0.003497584 0.003497584 0.006995168 0.000000000
sum over m 0.021340839 0.021340839 0.042681678 0.000000000
sum over m+mul 1.207118096 1.207118096 2.414236191 0.000000000
945 O Up spin Down spin Sum Diff
multiple
s 0 0.893905933 0.893905933 1.787811867 0.000000000
sum over m 0.893905933 0.893905933 1.787811867 0.000000000
s 1 -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m+mul 0.890863858 0.890863858 1.781727717 0.000000000
px 0 0.787143493 0.787143493 1.574286987 0.000000000
py 0 0.786822811 0.786822811 1.573645622 0.000000000
pz 0 0.779781122 0.779781122 1.559562245 0.000000000
sum over m 2.353747427 2.353747427 4.707494854 0.000000000
px 1 -0.008746988 -0.008746988 -0.017493976 0.000000000
py 1 -0.008735009 -0.008735009 -0.017470018 0.000000000
pz 1 -0.006461732 -0.006461732 -0.012923463 0.000000000
sum over m -0.023943729 -0.023943729 -0.047887457 0.000000000
sum over m+mul 2.329803698 2.329803698 4.659607397 0.000000000
d3z^2-r^2 0 -0.006391211 -0.006391211 -0.012782421 0.000000000
dx^2-y^2 0 -0.005058570 -0.005058570 -0.010117140 0.000000000
dxy 0 -0.005434801 -0.005434801 -0.010869602 0.000000000
dxz 0 -0.006926741 -0.006926741 -0.013853482 0.000000000
dyz 0 -0.006933434 -0.006933434 -0.013866868 0.000000000
sum over m -0.030744757 -0.030744757 -0.061489514 0.000000000
sum over m+mul -0.030744757 -0.030744757 -0.061489514 0.000000000
946 O Up spin Down spin Sum Diff
multiple
s 0 0.893886844 0.893886844 1.787773688 0.000000000
sum over m 0.893886844 0.893886844 1.787773688 0.000000000
s 1 -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m+mul 0.890844535 0.890844535 1.781689070 0.000000000
px 0 0.786825603 0.786825603 1.573651206 0.000000000
py 0 0.787087238 0.787087238 1.574174476 0.000000000
pz 0 0.779800672 0.779800672 1.559601343 0.000000000
sum over m 2.353713512 2.353713512 4.707427025 0.000000000
px 1 -0.008737361 -0.008737361 -0.017474723 0.000000000
py 1 -0.008741148 -0.008741148 -0.017482296 0.000000000
pz 1 -0.006464051 -0.006464051 -0.012928103 0.000000000
sum over m -0.023942561 -0.023942561 -0.047885121 0.000000000
sum over m+mul 2.329770952 2.329770952 4.659541904 0.000000000
d3z^2-r^2 0 -0.006390264 -0.006390264 -0.012780528 0.000000000
dx^2-y^2 0 -0.005059183 -0.005059183 -0.010118366 0.000000000
dxy 0 -0.005433461 -0.005433461 -0.010866922 0.000000000
dxz 0 -0.006932932 -0.006932932 -0.013865865 0.000000000
dyz 0 -0.006928949 -0.006928949 -0.013857898 0.000000000
sum over m -0.030744789 -0.030744789 -0.061489578 0.000000000
sum over m+mul -0.030744789 -0.030744789 -0.061489578 0.000000000
947 O Up spin Down spin Sum Diff
multiple
s 0 0.893907585 0.893907585 1.787815171 0.000000000
sum over m 0.893907585 0.893907585 1.787815171 0.000000000
s 1 -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m+mul 0.890865012 0.890865012 1.781730024 0.000000000
px 0 0.787044942 0.787044942 1.574089884 0.000000000
py 0 0.787047565 0.787047565 1.574095130 0.000000000
pz 0 0.779681978 0.779681978 1.559363955 0.000000000
sum over m 2.353774485 2.353774485 4.707548969 0.000000000
px 1 -0.008732352 -0.008732352 -0.017464704 0.000000000
py 1 -0.008730546 -0.008730546 -0.017461092 0.000000000
pz 1 -0.006453076 -0.006453076 -0.012906152 0.000000000
sum over m -0.023915974 -0.023915974 -0.047831948 0.000000000
sum over m+mul 2.329858511 2.329858511 4.659717021 0.000000000
d3z^2-r^2 0 -0.006390178 -0.006390178 -0.012780355 0.000000000
dx^2-y^2 0 -0.005052335 -0.005052335 -0.010104670 0.000000000
dxy 0 -0.005435478 -0.005435478 -0.010870956 0.000000000
dxz 0 -0.006923240 -0.006923240 -0.013846479 0.000000000
dyz 0 -0.006924277 -0.006924277 -0.013848555 0.000000000
sum over m -0.030725507 -0.030725507 -0.061451015 0.000000000
sum over m+mul -0.030725507 -0.030725507 -0.061451015 0.000000000
948 O Up spin Down spin Sum Diff
multiple
s 0 0.893853134 0.893853134 1.787706267 0.000000000
sum over m 0.893853134 0.893853134 1.787706267 0.000000000
s 1 -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m+mul 0.890810709 0.890810709 1.781621419 0.000000000
px 0 0.786858059 0.786858059 1.573716118 0.000000000
py 0 0.786921166 0.786921166 1.573842333 0.000000000
pz 0 0.779871468 0.779871468 1.559742937 0.000000000
sum over m 2.353650694 2.353650694 4.707301388 0.000000000
px 1 -0.008736997 -0.008736997 -0.017473994 0.000000000
py 1 -0.008736407 -0.008736407 -0.017472815 0.000000000
pz 1 -0.006466568 -0.006466568 -0.012933136 0.000000000
sum over m -0.023939972 -0.023939972 -0.047879944 0.000000000
sum over m+mul 2.329710722 2.329710722 4.659421444 0.000000000
d3z^2-r^2 0 -0.006389349 -0.006389349 -0.012778697 0.000000000
dx^2-y^2 0 -0.005061152 -0.005061152 -0.010122305 0.000000000
dxy 0 -0.005431835 -0.005431835 -0.010863669 0.000000000
dxz 0 -0.006935035 -0.006935035 -0.013870070 0.000000000
dyz 0 -0.006934510 -0.006934510 -0.013869019 0.000000000
sum over m -0.030751880 -0.030751880 -0.061503761 0.000000000
sum over m+mul -0.030751880 -0.030751880 -0.061503761 0.000000000
949 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000754531 1.000754531 2.001509062 0.000000000
sum over m 1.000754531 1.000754531 2.001509062 0.000000000
s 1 0.207411818 0.207411818 0.414823636 0.000000000
sum over m 0.207411818 0.207411818 0.414823636 0.000000000
s 2 0.014724175 0.014724175 0.029448350 0.000000000
sum over m 0.014724175 0.014724175 0.029448350 0.000000000
sum over m+mul 1.222890524 1.222890524 2.445781047 0.000000000
px 0 1.006383481 1.006383481 2.012766962 0.000000000
py 0 1.006397581 1.006397581 2.012795162 0.000000000
pz 0 1.006194369 1.006194369 2.012388738 0.000000000
sum over m 3.018975431 3.018975431 6.037950862 0.000000000
px 1 0.065410391 0.065410391 0.130820783 0.000000000
py 1 0.065420473 0.065420473 0.130840947 0.000000000
pz 1 0.040382927 0.040382927 0.080765854 0.000000000
sum over m 0.171213792 0.171213792 0.342427583 0.000000000
sum over m+mul 3.190189223 3.190189223 6.380378445 0.000000000
d3z^2-r^2 0 0.196288897 0.196288897 0.392577794 0.000000000
dx^2-y^2 0 0.201525016 0.201525016 0.403050033 0.000000000
dxy 0 0.250915966 0.250915966 0.501831931 0.000000000
dxz 0 0.268517838 0.268517838 0.537035675 0.000000000
dyz 0 0.268508678 0.268508678 0.537017356 0.000000000
sum over m 1.185756394 1.185756394 2.371512789 0.000000000
d3z^2-r^2 1 0.003474672 0.003474672 0.006949344 0.000000000
dx^2-y^2 1 -0.004474966 -0.004474966 -0.008949931 0.000000000
dxy 1 0.015340900 0.015340900 0.030681800 0.000000000
dxz 1 0.003486522 0.003486522 0.006973045 0.000000000
dyz 1 0.003487410 0.003487410 0.006974819 0.000000000
sum over m 0.021314538 0.021314538 0.042629076 0.000000000
sum over m+mul 1.207070933 1.207070933 2.414141865 0.000000000
950 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758743 1.000758743 2.001517485 0.000000000
sum over m 1.000758743 1.000758743 2.001517485 0.000000000
s 1 0.207414910 0.207414910 0.414829819 0.000000000
sum over m 0.207414910 0.207414910 0.414829819 0.000000000
s 2 0.014725535 0.014725535 0.029451070 0.000000000
sum over m 0.014725535 0.014725535 0.029451070 0.000000000
sum over m+mul 1.222899188 1.222899188 2.445798375 0.000000000
px 0 1.006384943 1.006384943 2.012769885 0.000000000
py 0 1.006372704 1.006372704 2.012745408 0.000000000
pz 0 1.006196973 1.006196973 2.012393946 0.000000000
sum over m 3.018954620 3.018954620 6.037909239 0.000000000
px 1 0.065431299 0.065431299 0.130862598 0.000000000
py 1 0.065439817 0.065439817 0.130879633 0.000000000
pz 1 0.040384285 0.040384285 0.080768571 0.000000000
sum over m 0.171255401 0.171255401 0.342510802 0.000000000
sum over m+mul 3.190210021 3.190210021 6.380420041 0.000000000
d3z^2-r^2 0 0.196319114 0.196319114 0.392638228 0.000000000
dx^2-y^2 0 0.201523316 0.201523316 0.403046632 0.000000000
dxy 0 0.250932369 0.250932369 0.501864738 0.000000000
dxz 0 0.268496820 0.268496820 0.536993639 0.000000000
dyz 0 0.268505638 0.268505638 0.537011276 0.000000000
sum over m 1.185777257 1.185777257 2.371554513 0.000000000
d3z^2-r^2 1 0.003478698 0.003478698 0.006957395 0.000000000
dx^2-y^2 1 -0.004474298 -0.004474298 -0.008948596 0.000000000
dxy 1 0.015342454 0.015342454 0.030684909 0.000000000
dxz 1 0.003496402 0.003496402 0.006992803 0.000000000
dyz 1 0.003497584 0.003497584 0.006995168 0.000000000
sum over m 0.021340839 0.021340839 0.042681678 0.000000000
sum over m+mul 1.207118096 1.207118096 2.414236192 0.000000000
951 O Up spin Down spin Sum Diff
multiple
s 0 0.893905933 0.893905933 1.787811867 0.000000000
sum over m 0.893905933 0.893905933 1.787811867 0.000000000
s 1 -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m+mul 0.890863858 0.890863858 1.781727717 0.000000000
px 0 0.787143493 0.787143493 1.574286987 0.000000000
py 0 0.786822811 0.786822811 1.573645622 0.000000000
pz 0 0.779781122 0.779781122 1.559562245 0.000000000
sum over m 2.353747427 2.353747427 4.707494853 0.000000000
px 1 -0.008746988 -0.008746988 -0.017493976 0.000000000
py 1 -0.008735009 -0.008735009 -0.017470018 0.000000000
pz 1 -0.006461732 -0.006461732 -0.012923463 0.000000000
sum over m -0.023943729 -0.023943729 -0.047887457 0.000000000
sum over m+mul 2.329803698 2.329803698 4.659607396 0.000000000
d3z^2-r^2 0 -0.006391211 -0.006391211 -0.012782421 0.000000000
dx^2-y^2 0 -0.005058570 -0.005058570 -0.010117140 0.000000000
dxy 0 -0.005434801 -0.005434801 -0.010869602 0.000000000
dxz 0 -0.006926741 -0.006926741 -0.013853482 0.000000000
dyz 0 -0.006933434 -0.006933434 -0.013866868 0.000000000
sum over m -0.030744757 -0.030744757 -0.061489514 0.000000000
sum over m+mul -0.030744757 -0.030744757 -0.061489514 0.000000000
952 O Up spin Down spin Sum Diff
multiple
s 0 0.893886844 0.893886844 1.787773688 0.000000000
sum over m 0.893886844 0.893886844 1.787773688 0.000000000
s 1 -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m+mul 0.890844535 0.890844535 1.781689070 0.000000000
px 0 0.786825603 0.786825603 1.573651206 0.000000000
py 0 0.787087238 0.787087238 1.574174476 0.000000000
pz 0 0.779800671 0.779800671 1.559601343 0.000000000
sum over m 2.353713512 2.353713512 4.707427025 0.000000000
px 1 -0.008737361 -0.008737361 -0.017474723 0.000000000
py 1 -0.008741148 -0.008741148 -0.017482296 0.000000000
pz 1 -0.006464051 -0.006464051 -0.012928103 0.000000000
sum over m -0.023942560 -0.023942560 -0.047885121 0.000000000
sum over m+mul 2.329770952 2.329770952 4.659541904 0.000000000
d3z^2-r^2 0 -0.006390264 -0.006390264 -0.012780528 0.000000000
dx^2-y^2 0 -0.005059183 -0.005059183 -0.010118366 0.000000000
dxy 0 -0.005433461 -0.005433461 -0.010866922 0.000000000
dxz 0 -0.006932932 -0.006932932 -0.013865865 0.000000000
dyz 0 -0.006928949 -0.006928949 -0.013857898 0.000000000
sum over m -0.030744789 -0.030744789 -0.061489578 0.000000000
sum over m+mul -0.030744789 -0.030744789 -0.061489578 0.000000000
953 O Up spin Down spin Sum Diff
multiple
s 0 0.893907585 0.893907585 1.787815171 0.000000000
sum over m 0.893907585 0.893907585 1.787815171 0.000000000
s 1 -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m+mul 0.890865012 0.890865012 1.781730024 0.000000000
px 0 0.787044942 0.787044942 1.574089884 0.000000000
py 0 0.787047565 0.787047565 1.574095130 0.000000000
pz 0 0.779681978 0.779681978 1.559363955 0.000000000
sum over m 2.353774485 2.353774485 4.707548969 0.000000000
px 1 -0.008732352 -0.008732352 -0.017464704 0.000000000
py 1 -0.008730546 -0.008730546 -0.017461092 0.000000000
pz 1 -0.006453076 -0.006453076 -0.012906152 0.000000000
sum over m -0.023915974 -0.023915974 -0.047831948 0.000000000
sum over m+mul 2.329858511 2.329858511 4.659717021 0.000000000
d3z^2-r^2 0 -0.006390178 -0.006390178 -0.012780355 0.000000000
dx^2-y^2 0 -0.005052335 -0.005052335 -0.010104670 0.000000000
dxy 0 -0.005435478 -0.005435478 -0.010870956 0.000000000
dxz 0 -0.006923240 -0.006923240 -0.013846479 0.000000000
dyz 0 -0.006924277 -0.006924277 -0.013848555 0.000000000
sum over m -0.030725507 -0.030725507 -0.061451015 0.000000000
sum over m+mul -0.030725507 -0.030725507 -0.061451015 0.000000000
954 O Up spin Down spin Sum Diff
multiple
s 0 0.893853134 0.893853134 1.787706267 0.000000000
sum over m 0.893853134 0.893853134 1.787706267 0.000000000
s 1 -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m+mul 0.890810709 0.890810709 1.781621419 0.000000000
px 0 0.786858059 0.786858059 1.573716119 0.000000000
py 0 0.786921166 0.786921166 1.573842333 0.000000000
pz 0 0.779871468 0.779871468 1.559742936 0.000000000
sum over m 2.353650694 2.353650694 4.707301388 0.000000000
px 1 -0.008736997 -0.008736997 -0.017473994 0.000000000
py 1 -0.008736407 -0.008736407 -0.017472815 0.000000000
pz 1 -0.006466568 -0.006466568 -0.012933136 0.000000000
sum over m -0.023939972 -0.023939972 -0.047879944 0.000000000
sum over m+mul 2.329710722 2.329710722 4.659421444 0.000000000
d3z^2-r^2 0 -0.006389349 -0.006389349 -0.012778697 0.000000000
dx^2-y^2 0 -0.005061152 -0.005061152 -0.010122305 0.000000000
dxy 0 -0.005431835 -0.005431835 -0.010863669 0.000000000
dxz 0 -0.006935035 -0.006935035 -0.013870070 0.000000000
dyz 0 -0.006934510 -0.006934510 -0.013869019 0.000000000
sum over m -0.030751880 -0.030751880 -0.061503761 0.000000000
sum over m+mul -0.030751880 -0.030751880 -0.061503761 0.000000000
955 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000754531 1.000754531 2.001509062 0.000000000
sum over m 1.000754531 1.000754531 2.001509062 0.000000000
s 1 0.207411818 0.207411818 0.414823636 0.000000000
sum over m 0.207411818 0.207411818 0.414823636 0.000000000
s 2 0.014724175 0.014724175 0.029448350 0.000000000
sum over m 0.014724175 0.014724175 0.029448350 0.000000000
sum over m+mul 1.222890524 1.222890524 2.445781048 0.000000000
px 0 1.006383481 1.006383481 2.012766962 0.000000000
py 0 1.006397581 1.006397581 2.012795162 0.000000000
pz 0 1.006194369 1.006194369 2.012388738 0.000000000
sum over m 3.018975431 3.018975431 6.037950862 0.000000000
px 1 0.065410391 0.065410391 0.130820783 0.000000000
py 1 0.065420473 0.065420473 0.130840947 0.000000000
pz 1 0.040382927 0.040382927 0.080765854 0.000000000
sum over m 0.171213791 0.171213791 0.342427583 0.000000000
sum over m+mul 3.190189222 3.190189222 6.380378445 0.000000000
d3z^2-r^2 0 0.196288897 0.196288897 0.392577794 0.000000000
dx^2-y^2 0 0.201525017 0.201525017 0.403050033 0.000000000
dxy 0 0.250915966 0.250915966 0.501831931 0.000000000
dxz 0 0.268517838 0.268517838 0.537035675 0.000000000
dyz 0 0.268508678 0.268508678 0.537017356 0.000000000
sum over m 1.185756395 1.185756395 2.371512789 0.000000000
d3z^2-r^2 1 0.003474672 0.003474672 0.006949344 0.000000000
dx^2-y^2 1 -0.004474966 -0.004474966 -0.008949932 0.000000000
dxy 1 0.015340900 0.015340900 0.030681800 0.000000000
dxz 1 0.003486522 0.003486522 0.006973045 0.000000000
dyz 1 0.003487410 0.003487410 0.006974819 0.000000000
sum over m 0.021314538 0.021314538 0.042629076 0.000000000
sum over m+mul 1.207070933 1.207070933 2.414141865 0.000000000
956 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758742 1.000758742 2.001517485 0.000000000
sum over m 1.000758742 1.000758742 2.001517485 0.000000000
s 1 0.207414910 0.207414910 0.414829819 0.000000000
sum over m 0.207414910 0.207414910 0.414829819 0.000000000
s 2 0.014725535 0.014725535 0.029451070 0.000000000
sum over m 0.014725535 0.014725535 0.029451070 0.000000000
sum over m+mul 1.222899187 1.222899187 2.445798375 0.000000000
px 0 1.006384943 1.006384943 2.012769885 0.000000000
py 0 1.006372704 1.006372704 2.012745408 0.000000000
pz 0 1.006196973 1.006196973 2.012393946 0.000000000
sum over m 3.018954620 3.018954620 6.037909240 0.000000000
px 1 0.065431299 0.065431299 0.130862598 0.000000000
py 1 0.065439816 0.065439816 0.130879633 0.000000000
pz 1 0.040384286 0.040384286 0.080768571 0.000000000
sum over m 0.171255401 0.171255401 0.342510803 0.000000000
sum over m+mul 3.190210021 3.190210021 6.380420042 0.000000000
d3z^2-r^2 0 0.196319114 0.196319114 0.392638228 0.000000000
dx^2-y^2 0 0.201523316 0.201523316 0.403046631 0.000000000
dxy 0 0.250932369 0.250932369 0.501864738 0.000000000
dxz 0 0.268496820 0.268496820 0.536993639 0.000000000
dyz 0 0.268505638 0.268505638 0.537011276 0.000000000
sum over m 1.185777256 1.185777256 2.371554512 0.000000000
d3z^2-r^2 1 0.003478698 0.003478698 0.006957395 0.000000000
dx^2-y^2 1 -0.004474298 -0.004474298 -0.008948596 0.000000000
dxy 1 0.015342454 0.015342454 0.030684909 0.000000000
dxz 1 0.003496402 0.003496402 0.006992803 0.000000000
dyz 1 0.003497584 0.003497584 0.006995168 0.000000000
sum over m 0.021340839 0.021340839 0.042681678 0.000000000
sum over m+mul 1.207118095 1.207118095 2.414236191 0.000000000
957 O Up spin Down spin Sum Diff
multiple
s 0 0.893905933 0.893905933 1.787811867 0.000000000
sum over m 0.893905933 0.893905933 1.787811867 0.000000000
s 1 -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m+mul 0.890863858 0.890863858 1.781727717 0.000000000
px 0 0.787143494 0.787143494 1.574286987 0.000000000
py 0 0.786822811 0.786822811 1.573645622 0.000000000
pz 0 0.779781122 0.779781122 1.559562245 0.000000000
sum over m 2.353747427 2.353747427 4.707494854 0.000000000
px 1 -0.008746988 -0.008746988 -0.017493976 0.000000000
py 1 -0.008735009 -0.008735009 -0.017470018 0.000000000
pz 1 -0.006461732 -0.006461732 -0.012923463 0.000000000
sum over m -0.023943729 -0.023943729 -0.047887457 0.000000000
sum over m+mul 2.329803699 2.329803699 4.659607397 0.000000000
d3z^2-r^2 0 -0.006391211 -0.006391211 -0.012782421 0.000000000
dx^2-y^2 0 -0.005058570 -0.005058570 -0.010117140 0.000000000
dxy 0 -0.005434801 -0.005434801 -0.010869602 0.000000000
dxz 0 -0.006926741 -0.006926741 -0.013853482 0.000000000
dyz 0 -0.006933434 -0.006933434 -0.013866868 0.000000000
sum over m -0.030744757 -0.030744757 -0.061489514 0.000000000
sum over m+mul -0.030744757 -0.030744757 -0.061489514 0.000000000
958 O Up spin Down spin Sum Diff
multiple
s 0 0.893886844 0.893886844 1.787773688 0.000000000
sum over m 0.893886844 0.893886844 1.787773688 0.000000000
s 1 -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m+mul 0.890844535 0.890844535 1.781689070 0.000000000
px 0 0.786825603 0.786825603 1.573651206 0.000000000
py 0 0.787087238 0.787087238 1.574174476 0.000000000
pz 0 0.779800672 0.779800672 1.559601343 0.000000000
sum over m 2.353713512 2.353713512 4.707427025 0.000000000
px 1 -0.008737361 -0.008737361 -0.017474723 0.000000000
py 1 -0.008741148 -0.008741148 -0.017482296 0.000000000
pz 1 -0.006464051 -0.006464051 -0.012928103 0.000000000
sum over m -0.023942560 -0.023942560 -0.047885121 0.000000000
sum over m+mul 2.329770952 2.329770952 4.659541904 0.000000000
d3z^2-r^2 0 -0.006390264 -0.006390264 -0.012780528 0.000000000
dx^2-y^2 0 -0.005059183 -0.005059183 -0.010118366 0.000000000
dxy 0 -0.005433461 -0.005433461 -0.010866922 0.000000000
dxz 0 -0.006932932 -0.006932932 -0.013865865 0.000000000
dyz 0 -0.006928949 -0.006928949 -0.013857898 0.000000000
sum over m -0.030744789 -0.030744789 -0.061489578 0.000000000
sum over m+mul -0.030744789 -0.030744789 -0.061489578 0.000000000
959 O Up spin Down spin Sum Diff
multiple
s 0 0.893907585 0.893907585 1.787815171 0.000000000
sum over m 0.893907585 0.893907585 1.787815171 0.000000000
s 1 -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m+mul 0.890865012 0.890865012 1.781730024 0.000000000
px 0 0.787044942 0.787044942 1.574089884 0.000000000
py 0 0.787047565 0.787047565 1.574095129 0.000000000
pz 0 0.779681978 0.779681978 1.559363955 0.000000000
sum over m 2.353774484 2.353774484 4.707548969 0.000000000
px 1 -0.008732352 -0.008732352 -0.017464704 0.000000000
py 1 -0.008730546 -0.008730546 -0.017461092 0.000000000
pz 1 -0.006453076 -0.006453076 -0.012906152 0.000000000
sum over m -0.023915974 -0.023915974 -0.047831948 0.000000000
sum over m+mul 2.329858510 2.329858510 4.659717021 0.000000000
d3z^2-r^2 0 -0.006390178 -0.006390178 -0.012780355 0.000000000
dx^2-y^2 0 -0.005052335 -0.005052335 -0.010104670 0.000000000
dxy 0 -0.005435478 -0.005435478 -0.010870956 0.000000000
dxz 0 -0.006923240 -0.006923240 -0.013846479 0.000000000
dyz 0 -0.006924277 -0.006924277 -0.013848555 0.000000000
sum over m -0.030725507 -0.030725507 -0.061451015 0.000000000
sum over m+mul -0.030725507 -0.030725507 -0.061451015 0.000000000
960 O Up spin Down spin Sum Diff
multiple
s 0 0.893853134 0.893853134 1.787706267 0.000000000
sum over m 0.893853134 0.893853134 1.787706267 0.000000000
s 1 -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m+mul 0.890810709 0.890810709 1.781621419 0.000000000
px 0 0.786858059 0.786858059 1.573716118 0.000000000
py 0 0.786921166 0.786921166 1.573842333 0.000000000
pz 0 0.779871468 0.779871468 1.559742936 0.000000000
sum over m 2.353650694 2.353650694 4.707301387 0.000000000
px 1 -0.008736997 -0.008736997 -0.017473994 0.000000000
py 1 -0.008736407 -0.008736407 -0.017472815 0.000000000
pz 1 -0.006466568 -0.006466568 -0.012933136 0.000000000
sum over m -0.023939972 -0.023939972 -0.047879944 0.000000000
sum over m+mul 2.329710721 2.329710721 4.659421443 0.000000000
d3z^2-r^2 0 -0.006389349 -0.006389349 -0.012778697 0.000000000
dx^2-y^2 0 -0.005061152 -0.005061152 -0.010122305 0.000000000
dxy 0 -0.005431835 -0.005431835 -0.010863669 0.000000000
dxz 0 -0.006935035 -0.006935035 -0.013870070 0.000000000
dyz 0 -0.006934510 -0.006934510 -0.013869019 0.000000000
sum over m -0.030751880 -0.030751880 -0.061503761 0.000000000
sum over m+mul -0.030751880 -0.030751880 -0.061503761 0.000000000
961 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000754531 1.000754531 2.001509062 0.000000000
sum over m 1.000754531 1.000754531 2.001509062 0.000000000
s 1 0.207411818 0.207411818 0.414823636 0.000000000
sum over m 0.207411818 0.207411818 0.414823636 0.000000000
s 2 0.014724175 0.014724175 0.029448350 0.000000000
sum over m 0.014724175 0.014724175 0.029448350 0.000000000
sum over m+mul 1.222890524 1.222890524 2.445781048 0.000000000
px 0 1.006383481 1.006383481 2.012766962 0.000000000
py 0 1.006397581 1.006397581 2.012795162 0.000000000
pz 0 1.006194369 1.006194369 2.012388739 0.000000000
sum over m 3.018975431 3.018975431 6.037950862 0.000000000
px 1 0.065410391 0.065410391 0.130820783 0.000000000
py 1 0.065420473 0.065420473 0.130840947 0.000000000
pz 1 0.040382927 0.040382927 0.080765854 0.000000000
sum over m 0.171213792 0.171213792 0.342427583 0.000000000
sum over m+mul 3.190189223 3.190189223 6.380378446 0.000000000
d3z^2-r^2 0 0.196288897 0.196288897 0.392577793 0.000000000
dx^2-y^2 0 0.201525017 0.201525017 0.403050033 0.000000000
dxy 0 0.250915966 0.250915966 0.501831931 0.000000000
dxz 0 0.268517838 0.268517838 0.537035675 0.000000000
dyz 0 0.268508678 0.268508678 0.537017355 0.000000000
sum over m 1.185756394 1.185756394 2.371512789 0.000000000
d3z^2-r^2 1 0.003474672 0.003474672 0.006949344 0.000000000
dx^2-y^2 1 -0.004474966 -0.004474966 -0.008949931 0.000000000
dxy 1 0.015340900 0.015340900 0.030681800 0.000000000
dxz 1 0.003486522 0.003486522 0.006973045 0.000000000
dyz 1 0.003487410 0.003487410 0.006974819 0.000000000
sum over m 0.021314538 0.021314538 0.042629076 0.000000000
sum over m+mul 1.207070932 1.207070932 2.414141865 0.000000000
962 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000758743 1.000758743 2.001517485 0.000000000
sum over m 1.000758743 1.000758743 2.001517485 0.000000000
s 1 0.207414910 0.207414910 0.414829820 0.000000000
sum over m 0.207414910 0.207414910 0.414829820 0.000000000
s 2 0.014725535 0.014725535 0.029451070 0.000000000
sum over m 0.014725535 0.014725535 0.029451070 0.000000000
sum over m+mul 1.222899188 1.222899188 2.445798375 0.000000000
px 0 1.006384943 1.006384943 2.012769885 0.000000000
py 0 1.006372704 1.006372704 2.012745408 0.000000000
pz 0 1.006196973 1.006196973 2.012393946 0.000000000
sum over m 3.018954620 3.018954620 6.037909239 0.000000000
px 1 0.065431299 0.065431299 0.130862599 0.000000000
py 1 0.065439817 0.065439817 0.130879633 0.000000000
pz 1 0.040384285 0.040384285 0.080768571 0.000000000
sum over m 0.171255401 0.171255401 0.342510802 0.000000000
sum over m+mul 3.190210021 3.190210021 6.380420042 0.000000000
d3z^2-r^2 0 0.196319114 0.196319114 0.392638228 0.000000000
dx^2-y^2 0 0.201523316 0.201523316 0.403046631 0.000000000
dxy 0 0.250932369 0.250932369 0.501864739 0.000000000
dxz 0 0.268496820 0.268496820 0.536993639 0.000000000
dyz 0 0.268505638 0.268505638 0.537011276 0.000000000
sum over m 1.185777256 1.185777256 2.371554513 0.000000000
d3z^2-r^2 1 0.003478698 0.003478698 0.006957395 0.000000000
dx^2-y^2 1 -0.004474298 -0.004474298 -0.008948596 0.000000000
dxy 1 0.015342454 0.015342454 0.030684909 0.000000000
dxz 1 0.003496402 0.003496402 0.006992803 0.000000000
dyz 1 0.003497584 0.003497584 0.006995168 0.000000000
sum over m 0.021340839 0.021340839 0.042681678 0.000000000
sum over m+mul 1.207118096 1.207118096 2.414236191 0.000000000
963 O Up spin Down spin Sum Diff
multiple
s 0 0.893905933 0.893905933 1.787811867 0.000000000
sum over m 0.893905933 0.893905933 1.787811867 0.000000000
s 1 -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m -0.003042075 -0.003042075 -0.006084150 0.000000000
sum over m+mul 0.890863858 0.890863858 1.781727717 0.000000000
px 0 0.787143493 0.787143493 1.574286987 0.000000000
py 0 0.786822811 0.786822811 1.573645622 0.000000000
pz 0 0.779781122 0.779781122 1.559562245 0.000000000
sum over m 2.353747427 2.353747427 4.707494854 0.000000000
px 1 -0.008746988 -0.008746988 -0.017493976 0.000000000
py 1 -0.008735009 -0.008735009 -0.017470018 0.000000000
pz 1 -0.006461732 -0.006461732 -0.012923463 0.000000000
sum over m -0.023943729 -0.023943729 -0.047887457 0.000000000
sum over m+mul 2.329803698 2.329803698 4.659607396 0.000000000
d3z^2-r^2 0 -0.006391211 -0.006391211 -0.012782421 0.000000000
dx^2-y^2 0 -0.005058570 -0.005058570 -0.010117140 0.000000000
dxy 0 -0.005434801 -0.005434801 -0.010869602 0.000000000
dxz 0 -0.006926741 -0.006926741 -0.013853482 0.000000000
dyz 0 -0.006933434 -0.006933434 -0.013866868 0.000000000
sum over m -0.030744757 -0.030744757 -0.061489514 0.000000000
sum over m+mul -0.030744757 -0.030744757 -0.061489514 0.000000000
964 O Up spin Down spin Sum Diff
multiple
s 0 0.893886844 0.893886844 1.787773688 0.000000000
sum over m 0.893886844 0.893886844 1.787773688 0.000000000
s 1 -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m -0.003042309 -0.003042309 -0.006084618 0.000000000
sum over m+mul 0.890844535 0.890844535 1.781689070 0.000000000
px 0 0.786825603 0.786825603 1.573651206 0.000000000
py 0 0.787087238 0.787087238 1.574174475 0.000000000
pz 0 0.779800671 0.779800671 1.559601343 0.000000000
sum over m 2.353713512 2.353713512 4.707427024 0.000000000
px 1 -0.008737361 -0.008737361 -0.017474723 0.000000000
py 1 -0.008741148 -0.008741148 -0.017482296 0.000000000
pz 1 -0.006464051 -0.006464051 -0.012928103 0.000000000
sum over m -0.023942560 -0.023942560 -0.047885121 0.000000000
sum over m+mul 2.329770952 2.329770952 4.659541903 0.000000000
d3z^2-r^2 0 -0.006390264 -0.006390264 -0.012780528 0.000000000
dx^2-y^2 0 -0.005059183 -0.005059183 -0.010118366 0.000000000
dxy 0 -0.005433461 -0.005433461 -0.010866922 0.000000000
dxz 0 -0.006932932 -0.006932932 -0.013865865 0.000000000
dyz 0 -0.006928949 -0.006928949 -0.013857898 0.000000000
sum over m -0.030744789 -0.030744789 -0.061489578 0.000000000
sum over m+mul -0.030744789 -0.030744789 -0.061489578 0.000000000
965 O Up spin Down spin Sum Diff
multiple
s 0 0.893907585 0.893907585 1.787815171 0.000000000
sum over m 0.893907585 0.893907585 1.787815171 0.000000000
s 1 -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m -0.003042573 -0.003042573 -0.006085146 0.000000000
sum over m+mul 0.890865012 0.890865012 1.781730024 0.000000000
px 0 0.787044942 0.787044942 1.574089884 0.000000000
py 0 0.787047565 0.787047565 1.574095130 0.000000000
pz 0 0.779681978 0.779681978 1.559363956 0.000000000
sum over m 2.353774485 2.353774485 4.707548970 0.000000000
px 1 -0.008732352 -0.008732352 -0.017464704 0.000000000
py 1 -0.008730546 -0.008730546 -0.017461092 0.000000000
pz 1 -0.006453076 -0.006453076 -0.012906152 0.000000000
sum over m -0.023915974 -0.023915974 -0.047831948 0.000000000
sum over m+mul 2.329858511 2.329858511 4.659717022 0.000000000
d3z^2-r^2 0 -0.006390178 -0.006390178 -0.012780355 0.000000000
dx^2-y^2 0 -0.005052335 -0.005052335 -0.010104670 0.000000000
dxy 0 -0.005435478 -0.005435478 -0.010870956 0.000000000
dxz 0 -0.006923240 -0.006923240 -0.013846479 0.000000000
dyz 0 -0.006924277 -0.006924277 -0.013848555 0.000000000
sum over m -0.030725507 -0.030725507 -0.061451015 0.000000000
sum over m+mul -0.030725507 -0.030725507 -0.061451015 0.000000000
966 O Up spin Down spin Sum Diff
multiple
s 0 0.893853134 0.893853134 1.787706267 0.000000000
sum over m 0.893853134 0.893853134 1.787706267 0.000000000
s 1 -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m -0.003042424 -0.003042424 -0.006084849 0.000000000
sum over m+mul 0.890810709 0.890810709 1.781621419 0.000000000
px 0 0.786858059 0.786858059 1.573716119 0.000000000
py 0 0.786921166 0.786921166 1.573842333 0.000000000
pz 0 0.779871468 0.779871468 1.559742937 0.000000000
sum over m 2.353650694 2.353650694 4.707301389 0.000000000
px 1 -0.008736997 -0.008736997 -0.017473994 0.000000000
py 1 -0.008736407 -0.008736407 -0.017472815 0.000000000
pz 1 -0.006466568 -0.006466568 -0.012933136 0.000000000
sum over m -0.023939972 -0.023939972 -0.047879944 0.000000000
sum over m+mul 2.329710722 2.329710722 4.659421444 0.000000000
d3z^2-r^2 0 -0.006389349 -0.006389349 -0.012778697 0.000000000
dx^2-y^2 0 -0.005061152 -0.005061152 -0.010122305 0.000000000
dxy 0 -0.005431835 -0.005431835 -0.010863669 0.000000000
dxz 0 -0.006935035 -0.006935035 -0.013870070 0.000000000
dyz 0 -0.006934510 -0.006934510 -0.013869019 0.000000000
sum over m -0.030751880 -0.030751880 -0.061503761 0.000000000
sum over m+mul -0.030751880 -0.030751880 -0.061503761 0.000000000
967 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742384 1.000742384 2.001484767 0.000000000
sum over m 1.000742384 1.000742384 2.001484767 0.000000000
s 1 0.207419860 0.207419860 0.414839720 0.000000000
sum over m 0.207419860 0.207419860 0.414839720 0.000000000
s 2 0.014726842 0.014726842 0.029453685 0.000000000
sum over m 0.014726842 0.014726842 0.029453685 0.000000000
sum over m+mul 1.222889086 1.222889086 2.445778172 0.000000000
px 0 1.006389813 1.006389813 2.012779625 0.000000000
py 0 1.006382190 1.006382190 2.012764379 0.000000000
pz 0 1.006209268 1.006209268 2.012418536 0.000000000
sum over m 3.018981270 3.018981270 6.037962541 0.000000000
px 1 0.065419256 0.065419256 0.130838512 0.000000000
py 1 0.065407996 0.065407996 0.130815992 0.000000000
pz 1 0.040404373 0.040404373 0.080808746 0.000000000
sum over m 0.171231625 0.171231625 0.342463250 0.000000000
sum over m+mul 3.190212895 3.190212895 6.380425790 0.000000000
d3z^2-r^2 0 0.196292287 0.196292287 0.392584573 0.000000000
dx^2-y^2 0 0.201528144 0.201528144 0.403056287 0.000000000
dxy 0 0.250900631 0.250900631 0.501801262 0.000000000
dxz 0 0.268518199 0.268518199 0.537036398 0.000000000
dyz 0 0.268523414 0.268523414 0.537046828 0.000000000
sum over m 1.185762674 1.185762674 2.371525348 0.000000000
d3z^2-r^2 1 0.003481533 0.003481533 0.006963067 0.000000000
dx^2-y^2 1 -0.004468526 -0.004468526 -0.008937052 0.000000000
dxy 1 0.015338662 0.015338662 0.030677323 0.000000000
dxz 1 0.003492549 0.003492549 0.006985098 0.000000000
dyz 1 0.003491426 0.003491426 0.006982852 0.000000000
sum over m 0.021335644 0.021335644 0.042671288 0.000000000
sum over m+mul 1.207098318 1.207098318 2.414196636 0.000000000
968 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000756856 1.000756856 2.001513713 0.000000000
sum over m 1.000756856 1.000756856 2.001513713 0.000000000
s 1 0.207409960 0.207409960 0.414819920 0.000000000
sum over m 0.207409960 0.207409960 0.414819920 0.000000000
s 2 0.014725999 0.014725999 0.029451998 0.000000000
sum over m 0.014725999 0.014725999 0.029451998 0.000000000
sum over m+mul 1.222892816 1.222892816 2.445785631 0.000000000
px 0 1.006375870 1.006375870 2.012751739 0.000000000
py 0 1.006373475 1.006373475 2.012746950 0.000000000
pz 0 1.006214911 1.006214911 2.012429822 0.000000000
sum over m 3.018964255 3.018964255 6.037928511 0.000000000
px 1 0.065439993 0.065439993 0.130879987 0.000000000
py 1 0.065418425 0.065418425 0.130836850 0.000000000
pz 1 0.040380762 0.040380762 0.080761523 0.000000000
sum over m 0.171239180 0.171239180 0.342478361 0.000000000
sum over m+mul 3.190203436 3.190203436 6.380406871 0.000000000
d3z^2-r^2 0 0.196294767 0.196294767 0.392589534 0.000000000
dx^2-y^2 0 0.201520194 0.201520194 0.403040388 0.000000000
dxy 0 0.250918860 0.250918860 0.501837721 0.000000000
dxz 0 0.268505238 0.268505238 0.537010476 0.000000000
dyz 0 0.268520644 0.268520644 0.537041287 0.000000000
sum over m 1.185759703 1.185759703 2.371519406 0.000000000
d3z^2-r^2 1 0.003478828 0.003478828 0.006957656 0.000000000
dx^2-y^2 1 -0.004472687 -0.004472687 -0.008945374 0.000000000
dxy 1 0.015340656 0.015340656 0.030681312 0.000000000
dxz 1 0.003491008 0.003491008 0.006982015 0.000000000
dyz 1 0.003489489 0.003489489 0.006978978 0.000000000
sum over m 0.021327293 0.021327293 0.042654586 0.000000000
sum over m+mul 1.207086996 1.207086996 2.414173992 0.000000000
969 O Up spin Down spin Sum Diff
multiple
s 0 0.893912940 0.893912940 1.787825881 0.000000000
sum over m 0.893912940 0.893912940 1.787825881 0.000000000
s 1 -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m+mul 0.890870277 0.890870277 1.781740554 0.000000000
px 0 0.787099819 0.787099819 1.574199637 0.000000000
py 0 0.786955523 0.786955523 1.573911047 0.000000000
pz 0 0.779726273 0.779726273 1.559452546 0.000000000
sum over m 2.353781615 2.353781615 4.707563230 0.000000000
px 1 -0.008741820 -0.008741820 -0.017483640 0.000000000
py 1 -0.008737472 -0.008737472 -0.017474944 0.000000000
pz 1 -0.006459855 -0.006459855 -0.012919711 0.000000000
sum over m -0.023939147 -0.023939147 -0.047878295 0.000000000
sum over m+mul 2.329842468 2.329842468 4.659684935 0.000000000
d3z^2-r^2 0 -0.006390642 -0.006390642 -0.012781283 0.000000000
dx^2-y^2 0 -0.005055774 -0.005055774 -0.010111549 0.000000000
dxy 0 -0.005436133 -0.005436133 -0.010872267 0.000000000
dxz 0 -0.006925393 -0.006925393 -0.013850787 0.000000000
dyz 0 -0.006930509 -0.006930509 -0.013861018 0.000000000
sum over m -0.030738452 -0.030738452 -0.061476904 0.000000000
sum over m+mul -0.030738452 -0.030738452 -0.061476904 0.000000000
970 O Up spin Down spin Sum Diff
multiple
s 0 0.893852153 0.893852153 1.787704305 0.000000000
sum over m 0.893852153 0.893852153 1.787704305 0.000000000
s 1 -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m+mul 0.890809938 0.890809938 1.781619875 0.000000000
px 0 0.786865166 0.786865166 1.573730332 0.000000000
py 0 0.786926851 0.786926851 1.573853701 0.000000000
pz 0 0.779871065 0.779871065 1.559742130 0.000000000
sum over m 2.353663082 2.353663082 4.707326164 0.000000000
px 1 -0.008735735 -0.008735735 -0.017471470 0.000000000
py 1 -0.008731742 -0.008731742 -0.017463485 0.000000000
pz 1 -0.006466435 -0.006466435 -0.012932870 0.000000000
sum over m -0.023933912 -0.023933912 -0.047867824 0.000000000
sum over m+mul 2.329729170 2.329729170 4.659458339 0.000000000
d3z^2-r^2 0 -0.006389061 -0.006389061 -0.012778123 0.000000000
dx^2-y^2 0 -0.005061139 -0.005061139 -0.010122278 0.000000000
dxy 0 -0.005432262 -0.005432262 -0.010864524 0.000000000
dxz 0 -0.006934207 -0.006934207 -0.013868414 0.000000000
dyz 0 -0.006934030 -0.006934030 -0.013868061 0.000000000
sum over m -0.030750700 -0.030750700 -0.061501399 0.000000000
sum over m+mul -0.030750700 -0.030750700 -0.061501399 0.000000000
971 O Up spin Down spin Sum Diff
multiple
s 0 0.893907478 0.893907478 1.787814956 0.000000000
sum over m 0.893907478 0.893907478 1.787814956 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m+mul 0.890865303 0.890865303 1.781730606 0.000000000
px 0 0.787102518 0.787102518 1.574205035 0.000000000
py 0 0.786958584 0.786958584 1.573917168 0.000000000
pz 0 0.779724466 0.779724466 1.559448933 0.000000000
sum over m 2.353785568 2.353785568 4.707571136 0.000000000
px 1 -0.008740799 -0.008740799 -0.017481598 0.000000000
py 1 -0.008733424 -0.008733424 -0.017466849 0.000000000
pz 1 -0.006457641 -0.006457641 -0.012915282 0.000000000
sum over m -0.023931864 -0.023931864 -0.047863729 0.000000000
sum over m+mul 2.329853704 2.329853704 4.659707407 0.000000000
d3z^2-r^2 0 -0.006390204 -0.006390204 -0.012780408 0.000000000
dx^2-y^2 0 -0.005055858 -0.005055858 -0.010111717 0.000000000
dxy 0 -0.005435946 -0.005435946 -0.010871892 0.000000000
dxz 0 -0.006924124 -0.006924124 -0.013848248 0.000000000
dyz 0 -0.006929974 -0.006929974 -0.013859947 0.000000000
sum over m -0.030736106 -0.030736106 -0.061472212 0.000000000
sum over m+mul -0.030736106 -0.030736106 -0.061472212 0.000000000
972 O Up spin Down spin Sum Diff
multiple
s 0 0.893893680 0.893893680 1.787787361 0.000000000
sum over m 0.893893680 0.893893680 1.787787361 0.000000000
s 1 -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m+mul 0.890851350 0.890851350 1.781702699 0.000000000
px 0 0.786824065 0.786824065 1.573648131 0.000000000
py 0 0.787088608 0.787088608 1.574177217 0.000000000
pz 0 0.779803270 0.779803270 1.559606540 0.000000000
sum over m 2.353715944 2.353715944 4.707431887 0.000000000
px 1 -0.008736146 -0.008736146 -0.017472292 0.000000000
py 1 -0.008743572 -0.008743572 -0.017487144 0.000000000
pz 1 -0.006463076 -0.006463076 -0.012926152 0.000000000
sum over m -0.023942794 -0.023942794 -0.047885589 0.000000000
sum over m+mul 2.329773149 2.329773149 4.659546299 0.000000000
d3z^2-r^2 0 -0.006390493 -0.006390493 -0.012780986 0.000000000
dx^2-y^2 0 -0.005059161 -0.005059161 -0.010118322 0.000000000
dxy 0 -0.005434201 -0.005434201 -0.010868403 0.000000000
dxz 0 -0.006933940 -0.006933940 -0.013867881 0.000000000
dyz 0 -0.006929332 -0.006929332 -0.013858665 0.000000000
sum over m -0.030747128 -0.030747128 -0.061494256 0.000000000
sum over m+mul -0.030747128 -0.030747128 -0.061494256 0.000000000
973 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742384 1.000742384 2.001484767 0.000000000
sum over m 1.000742384 1.000742384 2.001484767 0.000000000
s 1 0.207419860 0.207419860 0.414839720 0.000000000
sum over m 0.207419860 0.207419860 0.414839720 0.000000000
s 2 0.014726842 0.014726842 0.029453685 0.000000000
sum over m 0.014726842 0.014726842 0.029453685 0.000000000
sum over m+mul 1.222889086 1.222889086 2.445778172 0.000000000
px 0 1.006389813 1.006389813 2.012779625 0.000000000
py 0 1.006382190 1.006382190 2.012764379 0.000000000
pz 0 1.006209268 1.006209268 2.012418536 0.000000000
sum over m 3.018981270 3.018981270 6.037962541 0.000000000
px 1 0.065419256 0.065419256 0.130838512 0.000000000
py 1 0.065407996 0.065407996 0.130815992 0.000000000
pz 1 0.040404373 0.040404373 0.080808746 0.000000000
sum over m 0.171231625 0.171231625 0.342463249 0.000000000
sum over m+mul 3.190212895 3.190212895 6.380425790 0.000000000
d3z^2-r^2 0 0.196292287 0.196292287 0.392584573 0.000000000
dx^2-y^2 0 0.201528144 0.201528144 0.403056287 0.000000000
dxy 0 0.250900631 0.250900631 0.501801262 0.000000000
dxz 0 0.268518199 0.268518199 0.537036398 0.000000000
dyz 0 0.268523414 0.268523414 0.537046827 0.000000000
sum over m 1.185762674 1.185762674 2.371525347 0.000000000
d3z^2-r^2 1 0.003481533 0.003481533 0.006963067 0.000000000
dx^2-y^2 1 -0.004468526 -0.004468526 -0.008937052 0.000000000
dxy 1 0.015338662 0.015338662 0.030677323 0.000000000
dxz 1 0.003492549 0.003492549 0.006985098 0.000000000
dyz 1 0.003491426 0.003491426 0.006982852 0.000000000
sum over m 0.021335644 0.021335644 0.042671289 0.000000000
sum over m+mul 1.207098318 1.207098318 2.414196636 0.000000000
974 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000756856 1.000756856 2.001513712 0.000000000
sum over m 1.000756856 1.000756856 2.001513712 0.000000000
s 1 0.207409960 0.207409960 0.414819921 0.000000000
sum over m 0.207409960 0.207409960 0.414819921 0.000000000
s 2 0.014725999 0.014725999 0.029451998 0.000000000
sum over m 0.014725999 0.014725999 0.029451998 0.000000000
sum over m+mul 1.222892816 1.222892816 2.445785631 0.000000000
px 0 1.006375870 1.006375870 2.012751739 0.000000000
py 0 1.006373475 1.006373475 2.012746950 0.000000000
pz 0 1.006214911 1.006214911 2.012429822 0.000000000
sum over m 3.018964255 3.018964255 6.037928511 0.000000000
px 1 0.065439993 0.065439993 0.130879987 0.000000000
py 1 0.065418425 0.065418425 0.130836851 0.000000000
pz 1 0.040380762 0.040380762 0.080761523 0.000000000
sum over m 0.171239180 0.171239180 0.342478361 0.000000000
sum over m+mul 3.190203436 3.190203436 6.380406871 0.000000000
d3z^2-r^2 0 0.196294767 0.196294767 0.392589534 0.000000000
dx^2-y^2 0 0.201520194 0.201520194 0.403040388 0.000000000
dxy 0 0.250918861 0.250918861 0.501837721 0.000000000
dxz 0 0.268505238 0.268505238 0.537010475 0.000000000
dyz 0 0.268520644 0.268520644 0.537041287 0.000000000
sum over m 1.185759703 1.185759703 2.371519406 0.000000000
d3z^2-r^2 1 0.003478828 0.003478828 0.006957656 0.000000000
dx^2-y^2 1 -0.004472687 -0.004472687 -0.008945374 0.000000000
dxy 1 0.015340656 0.015340656 0.030681312 0.000000000
dxz 1 0.003491008 0.003491008 0.006982015 0.000000000
dyz 1 0.003489489 0.003489489 0.006978978 0.000000000
sum over m 0.021327293 0.021327293 0.042654587 0.000000000
sum over m+mul 1.207086996 1.207086996 2.414173993 0.000000000
975 O Up spin Down spin Sum Diff
multiple
s 0 0.893912940 0.893912940 1.787825881 0.000000000
sum over m 0.893912940 0.893912940 1.787825881 0.000000000
s 1 -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m+mul 0.890870277 0.890870277 1.781740554 0.000000000
px 0 0.787099819 0.787099819 1.574199637 0.000000000
py 0 0.786955523 0.786955523 1.573911047 0.000000000
pz 0 0.779726273 0.779726273 1.559452547 0.000000000
sum over m 2.353781615 2.353781615 4.707563231 0.000000000
px 1 -0.008741820 -0.008741820 -0.017483639 0.000000000
py 1 -0.008737472 -0.008737472 -0.017474944 0.000000000
pz 1 -0.006459855 -0.006459855 -0.012919711 0.000000000
sum over m -0.023939147 -0.023939147 -0.047878295 0.000000000
sum over m+mul 2.329842468 2.329842468 4.659684936 0.000000000
d3z^2-r^2 0 -0.006390642 -0.006390642 -0.012781283 0.000000000
dx^2-y^2 0 -0.005055774 -0.005055774 -0.010111549 0.000000000
dxy 0 -0.005436133 -0.005436133 -0.010872267 0.000000000
dxz 0 -0.006925393 -0.006925393 -0.013850787 0.000000000
dyz 0 -0.006930509 -0.006930509 -0.013861018 0.000000000
sum over m -0.030738452 -0.030738452 -0.061476904 0.000000000
sum over m+mul -0.030738452 -0.030738452 -0.061476904 0.000000000
976 O Up spin Down spin Sum Diff
multiple
s 0 0.893852153 0.893852153 1.787704306 0.000000000
sum over m 0.893852153 0.893852153 1.787704306 0.000000000
s 1 -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m+mul 0.890809938 0.890809938 1.781619875 0.000000000
px 0 0.786865166 0.786865166 1.573730332 0.000000000
py 0 0.786926850 0.786926850 1.573853701 0.000000000
pz 0 0.779871065 0.779871065 1.559742131 0.000000000
sum over m 2.353663082 2.353663082 4.707326163 0.000000000
px 1 -0.008735735 -0.008735735 -0.017471470 0.000000000
py 1 -0.008731742 -0.008731742 -0.017463485 0.000000000
pz 1 -0.006466435 -0.006466435 -0.012932870 0.000000000
sum over m -0.023933912 -0.023933912 -0.047867824 0.000000000
sum over m+mul 2.329729170 2.329729170 4.659458339 0.000000000
d3z^2-r^2 0 -0.006389061 -0.006389061 -0.012778123 0.000000000
dx^2-y^2 0 -0.005061139 -0.005061139 -0.010122278 0.000000000
dxy 0 -0.005432262 -0.005432262 -0.010864524 0.000000000
dxz 0 -0.006934207 -0.006934207 -0.013868414 0.000000000
dyz 0 -0.006934030 -0.006934030 -0.013868061 0.000000000
sum over m -0.030750700 -0.030750700 -0.061501399 0.000000000
sum over m+mul -0.030750700 -0.030750700 -0.061501399 0.000000000
977 O Up spin Down spin Sum Diff
multiple
s 0 0.893907478 0.893907478 1.787814955 0.000000000
sum over m 0.893907478 0.893907478 1.787814955 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m+mul 0.890865303 0.890865303 1.781730606 0.000000000
px 0 0.787102517 0.787102517 1.574205035 0.000000000
py 0 0.786958584 0.786958584 1.573917168 0.000000000
pz 0 0.779724467 0.779724467 1.559448933 0.000000000
sum over m 2.353785568 2.353785568 4.707571135 0.000000000
px 1 -0.008740799 -0.008740799 -0.017481598 0.000000000
py 1 -0.008733424 -0.008733424 -0.017466849 0.000000000
pz 1 -0.006457641 -0.006457641 -0.012915282 0.000000000
sum over m -0.023931864 -0.023931864 -0.047863729 0.000000000
sum over m+mul 2.329853703 2.329853703 4.659707407 0.000000000
d3z^2-r^2 0 -0.006390204 -0.006390204 -0.012780408 0.000000000
dx^2-y^2 0 -0.005055858 -0.005055858 -0.010111717 0.000000000
dxy 0 -0.005435946 -0.005435946 -0.010871892 0.000000000
dxz 0 -0.006924124 -0.006924124 -0.013848248 0.000000000
dyz 0 -0.006929974 -0.006929974 -0.013859947 0.000000000
sum over m -0.030736106 -0.030736106 -0.061472212 0.000000000
sum over m+mul -0.030736106 -0.030736106 -0.061472212 0.000000000
978 O Up spin Down spin Sum Diff
multiple
s 0 0.893893680 0.893893680 1.787787361 0.000000000
sum over m 0.893893680 0.893893680 1.787787361 0.000000000
s 1 -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m+mul 0.890851350 0.890851350 1.781702699 0.000000000
px 0 0.786824065 0.786824065 1.573648131 0.000000000
py 0 0.787088608 0.787088608 1.574177217 0.000000000
pz 0 0.779803270 0.779803270 1.559606540 0.000000000
sum over m 2.353715944 2.353715944 4.707431887 0.000000000
px 1 -0.008736146 -0.008736146 -0.017472292 0.000000000
py 1 -0.008743572 -0.008743572 -0.017487144 0.000000000
pz 1 -0.006463076 -0.006463076 -0.012926152 0.000000000
sum over m -0.023942794 -0.023942794 -0.047885589 0.000000000
sum over m+mul 2.329773149 2.329773149 4.659546299 0.000000000
d3z^2-r^2 0 -0.006390493 -0.006390493 -0.012780986 0.000000000
dx^2-y^2 0 -0.005059161 -0.005059161 -0.010118322 0.000000000
dxy 0 -0.005434201 -0.005434201 -0.010868403 0.000000000
dxz 0 -0.006933940 -0.006933940 -0.013867881 0.000000000
dyz 0 -0.006929332 -0.006929332 -0.013858665 0.000000000
sum over m -0.030747128 -0.030747128 -0.061494256 0.000000000
sum over m+mul -0.030747128 -0.030747128 -0.061494256 0.000000000
979 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742384 1.000742384 2.001484767 0.000000000
sum over m 1.000742384 1.000742384 2.001484767 0.000000000
s 1 0.207419860 0.207419860 0.414839720 0.000000000
sum over m 0.207419860 0.207419860 0.414839720 0.000000000
s 2 0.014726842 0.014726842 0.029453685 0.000000000
sum over m 0.014726842 0.014726842 0.029453685 0.000000000
sum over m+mul 1.222889086 1.222889086 2.445778173 0.000000000
px 0 1.006389813 1.006389813 2.012779625 0.000000000
py 0 1.006382190 1.006382190 2.012764379 0.000000000
pz 0 1.006209268 1.006209268 2.012418536 0.000000000
sum over m 3.018981270 3.018981270 6.037962540 0.000000000
px 1 0.065419256 0.065419256 0.130838511 0.000000000
py 1 0.065407996 0.065407996 0.130815992 0.000000000
pz 1 0.040404373 0.040404373 0.080808746 0.000000000
sum over m 0.171231625 0.171231625 0.342463249 0.000000000
sum over m+mul 3.190212895 3.190212895 6.380425789 0.000000000
d3z^2-r^2 0 0.196292287 0.196292287 0.392584573 0.000000000
dx^2-y^2 0 0.201528144 0.201528144 0.403056288 0.000000000
dxy 0 0.250900631 0.250900631 0.501801261 0.000000000
dxz 0 0.268518199 0.268518199 0.537036398 0.000000000
dyz 0 0.268523414 0.268523414 0.537046828 0.000000000
sum over m 1.185762674 1.185762674 2.371525349 0.000000000
d3z^2-r^2 1 0.003481533 0.003481533 0.006963067 0.000000000
dx^2-y^2 1 -0.004468526 -0.004468526 -0.008937052 0.000000000
dxy 1 0.015338662 0.015338662 0.030677323 0.000000000
dxz 1 0.003492549 0.003492549 0.006985098 0.000000000
dyz 1 0.003491426 0.003491426 0.006982852 0.000000000
sum over m 0.021335644 0.021335644 0.042671289 0.000000000
sum over m+mul 1.207098319 1.207098319 2.414196637 0.000000000
980 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000756856 1.000756856 2.001513712 0.000000000
sum over m 1.000756856 1.000756856 2.001513712 0.000000000
s 1 0.207409960 0.207409960 0.414819920 0.000000000
sum over m 0.207409960 0.207409960 0.414819920 0.000000000
s 2 0.014725999 0.014725999 0.029451998 0.000000000
sum over m 0.014725999 0.014725999 0.029451998 0.000000000
sum over m+mul 1.222892815 1.222892815 2.445785631 0.000000000
px 0 1.006375870 1.006375870 2.012751739 0.000000000
py 0 1.006373475 1.006373475 2.012746950 0.000000000
pz 0 1.006214911 1.006214911 2.012429822 0.000000000
sum over m 3.018964256 3.018964256 6.037928511 0.000000000
px 1 0.065439994 0.065439994 0.130879987 0.000000000
py 1 0.065418425 0.065418425 0.130836851 0.000000000
pz 1 0.040380762 0.040380762 0.080761523 0.000000000
sum over m 0.171239181 0.171239181 0.342478361 0.000000000
sum over m+mul 3.190203436 3.190203436 6.380406872 0.000000000
d3z^2-r^2 0 0.196294767 0.196294767 0.392589534 0.000000000
dx^2-y^2 0 0.201520194 0.201520194 0.403040388 0.000000000
dxy 0 0.250918861 0.250918861 0.501837721 0.000000000
dxz 0 0.268505238 0.268505238 0.537010476 0.000000000
dyz 0 0.268520643 0.268520643 0.537041287 0.000000000
sum over m 1.185759703 1.185759703 2.371519405 0.000000000
d3z^2-r^2 1 0.003478828 0.003478828 0.006957656 0.000000000
dx^2-y^2 1 -0.004472687 -0.004472687 -0.008945374 0.000000000
dxy 1 0.015340656 0.015340656 0.030681312 0.000000000
dxz 1 0.003491007 0.003491007 0.006982015 0.000000000
dyz 1 0.003489489 0.003489489 0.006978978 0.000000000
sum over m 0.021327293 0.021327293 0.042654586 0.000000000
sum over m+mul 1.207086996 1.207086996 2.414173992 0.000000000
981 O Up spin Down spin Sum Diff
multiple
s 0 0.893912940 0.893912940 1.787825881 0.000000000
sum over m 0.893912940 0.893912940 1.787825881 0.000000000
s 1 -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m+mul 0.890870277 0.890870277 1.781740554 0.000000000
px 0 0.787099819 0.787099819 1.574199637 0.000000000
py 0 0.786955523 0.786955523 1.573911046 0.000000000
pz 0 0.779726273 0.779726273 1.559452547 0.000000000
sum over m 2.353781615 2.353781615 4.707563230 0.000000000
px 1 -0.008741820 -0.008741820 -0.017483640 0.000000000
py 1 -0.008737472 -0.008737472 -0.017474944 0.000000000
pz 1 -0.006459855 -0.006459855 -0.012919711 0.000000000
sum over m -0.023939147 -0.023939147 -0.047878295 0.000000000
sum over m+mul 2.329842468 2.329842468 4.659684935 0.000000000
d3z^2-r^2 0 -0.006390642 -0.006390642 -0.012781283 0.000000000
dx^2-y^2 0 -0.005055774 -0.005055774 -0.010111549 0.000000000
dxy 0 -0.005436133 -0.005436133 -0.010872267 0.000000000
dxz 0 -0.006925393 -0.006925393 -0.013850787 0.000000000
dyz 0 -0.006930509 -0.006930509 -0.013861018 0.000000000
sum over m -0.030738452 -0.030738452 -0.061476904 0.000000000
sum over m+mul -0.030738452 -0.030738452 -0.061476904 0.000000000
982 O Up spin Down spin Sum Diff
multiple
s 0 0.893852153 0.893852153 1.787704305 0.000000000
sum over m 0.893852153 0.893852153 1.787704305 0.000000000
s 1 -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m+mul 0.890809938 0.890809938 1.781619875 0.000000000
px 0 0.786865166 0.786865166 1.573730332 0.000000000
py 0 0.786926851 0.786926851 1.573853701 0.000000000
pz 0 0.779871065 0.779871065 1.559742131 0.000000000
sum over m 2.353663082 2.353663082 4.707326164 0.000000000
px 1 -0.008735735 -0.008735735 -0.017471470 0.000000000
py 1 -0.008731742 -0.008731742 -0.017463485 0.000000000
pz 1 -0.006466435 -0.006466435 -0.012932870 0.000000000
sum over m -0.023933912 -0.023933912 -0.047867824 0.000000000
sum over m+mul 2.329729170 2.329729170 4.659458340 0.000000000
d3z^2-r^2 0 -0.006389061 -0.006389061 -0.012778123 0.000000000
dx^2-y^2 0 -0.005061139 -0.005061139 -0.010122278 0.000000000
dxy 0 -0.005432262 -0.005432262 -0.010864524 0.000000000
dxz 0 -0.006934207 -0.006934207 -0.013868413 0.000000000
dyz 0 -0.006934030 -0.006934030 -0.013868061 0.000000000
sum over m -0.030750700 -0.030750700 -0.061501399 0.000000000
sum over m+mul -0.030750700 -0.030750700 -0.061501399 0.000000000
983 O Up spin Down spin Sum Diff
multiple
s 0 0.893907478 0.893907478 1.787814955 0.000000000
sum over m 0.893907478 0.893907478 1.787814955 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m+mul 0.890865303 0.890865303 1.781730606 0.000000000
px 0 0.787102518 0.787102518 1.574205035 0.000000000
py 0 0.786958584 0.786958584 1.573917167 0.000000000
pz 0 0.779724466 0.779724466 1.559448933 0.000000000
sum over m 2.353785568 2.353785568 4.707571136 0.000000000
px 1 -0.008740799 -0.008740799 -0.017481598 0.000000000
py 1 -0.008733424 -0.008733424 -0.017466849 0.000000000
pz 1 -0.006457641 -0.006457641 -0.012915282 0.000000000
sum over m -0.023931864 -0.023931864 -0.047863729 0.000000000
sum over m+mul 2.329853703 2.329853703 4.659707407 0.000000000
d3z^2-r^2 0 -0.006390204 -0.006390204 -0.012780408 0.000000000
dx^2-y^2 0 -0.005055858 -0.005055858 -0.010111717 0.000000000
dxy 0 -0.005435946 -0.005435946 -0.010871892 0.000000000
dxz 0 -0.006924124 -0.006924124 -0.013848248 0.000000000
dyz 0 -0.006929974 -0.006929974 -0.013859947 0.000000000
sum over m -0.030736106 -0.030736106 -0.061472212 0.000000000
sum over m+mul -0.030736106 -0.030736106 -0.061472212 0.000000000
984 O Up spin Down spin Sum Diff
multiple
s 0 0.893893680 0.893893680 1.787787361 0.000000000
sum over m 0.893893680 0.893893680 1.787787361 0.000000000
s 1 -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m+mul 0.890851350 0.890851350 1.781702699 0.000000000
px 0 0.786824066 0.786824066 1.573648131 0.000000000
py 0 0.787088608 0.787088608 1.574177217 0.000000000
pz 0 0.779803270 0.779803270 1.559606540 0.000000000
sum over m 2.353715944 2.353715944 4.707431887 0.000000000
px 1 -0.008736146 -0.008736146 -0.017472292 0.000000000
py 1 -0.008743572 -0.008743572 -0.017487144 0.000000000
pz 1 -0.006463076 -0.006463076 -0.012926152 0.000000000
sum over m -0.023942794 -0.023942794 -0.047885589 0.000000000
sum over m+mul 2.329773149 2.329773149 4.659546299 0.000000000
d3z^2-r^2 0 -0.006390493 -0.006390493 -0.012780986 0.000000000
dx^2-y^2 0 -0.005059161 -0.005059161 -0.010118322 0.000000000
dxy 0 -0.005434201 -0.005434201 -0.010868403 0.000000000
dxz 0 -0.006933940 -0.006933940 -0.013867881 0.000000000
dyz 0 -0.006929332 -0.006929332 -0.013858665 0.000000000
sum over m -0.030747128 -0.030747128 -0.061494256 0.000000000
sum over m+mul -0.030747128 -0.030747128 -0.061494256 0.000000000
985 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742383 1.000742383 2.001484767 0.000000000
sum over m 1.000742383 1.000742383 2.001484767 0.000000000
s 1 0.207419860 0.207419860 0.414839720 0.000000000
sum over m 0.207419860 0.207419860 0.414839720 0.000000000
s 2 0.014726842 0.014726842 0.029453685 0.000000000
sum over m 0.014726842 0.014726842 0.029453685 0.000000000
sum over m+mul 1.222889086 1.222889086 2.445778172 0.000000000
px 0 1.006389813 1.006389813 2.012779625 0.000000000
py 0 1.006382190 1.006382190 2.012764379 0.000000000
pz 0 1.006209268 1.006209268 2.012418536 0.000000000
sum over m 3.018981270 3.018981270 6.037962541 0.000000000
px 1 0.065419256 0.065419256 0.130838512 0.000000000
py 1 0.065407996 0.065407996 0.130815992 0.000000000
pz 1 0.040404373 0.040404373 0.080808745 0.000000000
sum over m 0.171231625 0.171231625 0.342463250 0.000000000
sum over m+mul 3.190212895 3.190212895 6.380425790 0.000000000
d3z^2-r^2 0 0.196292287 0.196292287 0.392584573 0.000000000
dx^2-y^2 0 0.201528144 0.201528144 0.403056288 0.000000000
dxy 0 0.250900631 0.250900631 0.501801262 0.000000000
dxz 0 0.268518199 0.268518199 0.537036398 0.000000000
dyz 0 0.268523414 0.268523414 0.537046827 0.000000000
sum over m 1.185762674 1.185762674 2.371525348 0.000000000
d3z^2-r^2 1 0.003481533 0.003481533 0.006963067 0.000000000
dx^2-y^2 1 -0.004468526 -0.004468526 -0.008937052 0.000000000
dxy 1 0.015338662 0.015338662 0.030677323 0.000000000
dxz 1 0.003492549 0.003492549 0.006985098 0.000000000
dyz 1 0.003491426 0.003491426 0.006982852 0.000000000
sum over m 0.021335644 0.021335644 0.042671289 0.000000000
sum over m+mul 1.207098318 1.207098318 2.414196636 0.000000000
986 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000756856 1.000756856 2.001513712 0.000000000
sum over m 1.000756856 1.000756856 2.001513712 0.000000000
s 1 0.207409960 0.207409960 0.414819920 0.000000000
sum over m 0.207409960 0.207409960 0.414819920 0.000000000
s 2 0.014725999 0.014725999 0.029451998 0.000000000
sum over m 0.014725999 0.014725999 0.029451998 0.000000000
sum over m+mul 1.222892815 1.222892815 2.445785630 0.000000000
px 0 1.006375870 1.006375870 2.012751739 0.000000000
py 0 1.006373475 1.006373475 2.012746950 0.000000000
pz 0 1.006214911 1.006214911 2.012429822 0.000000000
sum over m 3.018964256 3.018964256 6.037928511 0.000000000
px 1 0.065439994 0.065439994 0.130879987 0.000000000
py 1 0.065418425 0.065418425 0.130836850 0.000000000
pz 1 0.040380761 0.040380761 0.080761523 0.000000000
sum over m 0.171239180 0.171239180 0.342478361 0.000000000
sum over m+mul 3.190203436 3.190203436 6.380406872 0.000000000
d3z^2-r^2 0 0.196294767 0.196294767 0.392589534 0.000000000
dx^2-y^2 0 0.201520194 0.201520194 0.403040389 0.000000000
dxy 0 0.250918861 0.250918861 0.501837721 0.000000000
dxz 0 0.268505238 0.268505238 0.537010476 0.000000000
dyz 0 0.268520644 0.268520644 0.537041287 0.000000000
sum over m 1.185759704 1.185759704 2.371519407 0.000000000
d3z^2-r^2 1 0.003478828 0.003478828 0.006957656 0.000000000
dx^2-y^2 1 -0.004472687 -0.004472687 -0.008945374 0.000000000
dxy 1 0.015340656 0.015340656 0.030681312 0.000000000
dxz 1 0.003491008 0.003491008 0.006982015 0.000000000
dyz 1 0.003489489 0.003489489 0.006978978 0.000000000
sum over m 0.021327293 0.021327293 0.042654586 0.000000000
sum over m+mul 1.207086997 1.207086997 2.414173993 0.000000000
987 O Up spin Down spin Sum Diff
multiple
s 0 0.893912940 0.893912940 1.787825881 0.000000000
sum over m 0.893912940 0.893912940 1.787825881 0.000000000
s 1 -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m+mul 0.890870277 0.890870277 1.781740554 0.000000000
px 0 0.787099819 0.787099819 1.574199637 0.000000000
py 0 0.786955523 0.786955523 1.573911046 0.000000000
pz 0 0.779726273 0.779726273 1.559452546 0.000000000
sum over m 2.353781615 2.353781615 4.707563230 0.000000000
px 1 -0.008741820 -0.008741820 -0.017483639 0.000000000
py 1 -0.008737472 -0.008737472 -0.017474944 0.000000000
pz 1 -0.006459855 -0.006459855 -0.012919711 0.000000000
sum over m -0.023939147 -0.023939147 -0.047878295 0.000000000
sum over m+mul 2.329842468 2.329842468 4.659684935 0.000000000
d3z^2-r^2 0 -0.006390642 -0.006390642 -0.012781283 0.000000000
dx^2-y^2 0 -0.005055774 -0.005055774 -0.010111549 0.000000000
dxy 0 -0.005436133 -0.005436133 -0.010872267 0.000000000
dxz 0 -0.006925393 -0.006925393 -0.013850787 0.000000000
dyz 0 -0.006930509 -0.006930509 -0.013861018 0.000000000
sum over m -0.030738452 -0.030738452 -0.061476903 0.000000000
sum over m+mul -0.030738452 -0.030738452 -0.061476903 0.000000000
988 O Up spin Down spin Sum Diff
multiple
s 0 0.893852153 0.893852153 1.787704305 0.000000000
sum over m 0.893852153 0.893852153 1.787704305 0.000000000
s 1 -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m+mul 0.890809938 0.890809938 1.781619875 0.000000000
px 0 0.786865166 0.786865166 1.573730332 0.000000000
py 0 0.786926851 0.786926851 1.573853701 0.000000000
pz 0 0.779871065 0.779871065 1.559742130 0.000000000
sum over m 2.353663082 2.353663082 4.707326164 0.000000000
px 1 -0.008735735 -0.008735735 -0.017471470 0.000000000
py 1 -0.008731742 -0.008731742 -0.017463485 0.000000000
pz 1 -0.006466435 -0.006466435 -0.012932870 0.000000000
sum over m -0.023933912 -0.023933912 -0.047867824 0.000000000
sum over m+mul 2.329729170 2.329729170 4.659458340 0.000000000
d3z^2-r^2 0 -0.006389061 -0.006389061 -0.012778123 0.000000000
dx^2-y^2 0 -0.005061139 -0.005061139 -0.010122278 0.000000000
dxy 0 -0.005432262 -0.005432262 -0.010864524 0.000000000
dxz 0 -0.006934207 -0.006934207 -0.013868414 0.000000000
dyz 0 -0.006934030 -0.006934030 -0.013868061 0.000000000
sum over m -0.030750700 -0.030750700 -0.061501399 0.000000000
sum over m+mul -0.030750700 -0.030750700 -0.061501399 0.000000000
989 O Up spin Down spin Sum Diff
multiple
s 0 0.893907478 0.893907478 1.787814956 0.000000000
sum over m 0.893907478 0.893907478 1.787814956 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m+mul 0.890865303 0.890865303 1.781730606 0.000000000
px 0 0.787102517 0.787102517 1.574205035 0.000000000
py 0 0.786958584 0.786958584 1.573917168 0.000000000
pz 0 0.779724467 0.779724467 1.559448933 0.000000000
sum over m 2.353785568 2.353785568 4.707571136 0.000000000
px 1 -0.008740799 -0.008740799 -0.017481598 0.000000000
py 1 -0.008733424 -0.008733424 -0.017466848 0.000000000
pz 1 -0.006457641 -0.006457641 -0.012915282 0.000000000
sum over m -0.023931864 -0.023931864 -0.047863729 0.000000000
sum over m+mul 2.329853704 2.329853704 4.659707407 0.000000000
d3z^2-r^2 0 -0.006390204 -0.006390204 -0.012780408 0.000000000
dx^2-y^2 0 -0.005055858 -0.005055858 -0.010111717 0.000000000
dxy 0 -0.005435946 -0.005435946 -0.010871892 0.000000000
dxz 0 -0.006924124 -0.006924124 -0.013848248 0.000000000
dyz 0 -0.006929974 -0.006929974 -0.013859947 0.000000000
sum over m -0.030736106 -0.030736106 -0.061472212 0.000000000
sum over m+mul -0.030736106 -0.030736106 -0.061472212 0.000000000
990 O Up spin Down spin Sum Diff
multiple
s 0 0.893893680 0.893893680 1.787787361 0.000000000
sum over m 0.893893680 0.893893680 1.787787361 0.000000000
s 1 -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m+mul 0.890851350 0.890851350 1.781702699 0.000000000
px 0 0.786824066 0.786824066 1.573648131 0.000000000
py 0 0.787088608 0.787088608 1.574177217 0.000000000
pz 0 0.779803270 0.779803270 1.559606540 0.000000000
sum over m 2.353715944 2.353715944 4.707431888 0.000000000
px 1 -0.008736146 -0.008736146 -0.017472292 0.000000000
py 1 -0.008743572 -0.008743572 -0.017487144 0.000000000
pz 1 -0.006463076 -0.006463076 -0.012926152 0.000000000
sum over m -0.023942794 -0.023942794 -0.047885588 0.000000000
sum over m+mul 2.329773150 2.329773150 4.659546300 0.000000000
d3z^2-r^2 0 -0.006390493 -0.006390493 -0.012780986 0.000000000
dx^2-y^2 0 -0.005059161 -0.005059161 -0.010118322 0.000000000
dxy 0 -0.005434201 -0.005434201 -0.010868403 0.000000000
dxz 0 -0.006933940 -0.006933940 -0.013867881 0.000000000
dyz 0 -0.006929332 -0.006929332 -0.013858665 0.000000000
sum over m -0.030747128 -0.030747128 -0.061494256 0.000000000
sum over m+mul -0.030747128 -0.030747128 -0.061494256 0.000000000
991 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742384 1.000742384 2.001484767 0.000000000
sum over m 1.000742384 1.000742384 2.001484767 0.000000000
s 1 0.207419860 0.207419860 0.414839720 0.000000000
sum over m 0.207419860 0.207419860 0.414839720 0.000000000
s 2 0.014726842 0.014726842 0.029453685 0.000000000
sum over m 0.014726842 0.014726842 0.029453685 0.000000000
sum over m+mul 1.222889086 1.222889086 2.445778172 0.000000000
px 0 1.006389813 1.006389813 2.012779625 0.000000000
py 0 1.006382190 1.006382190 2.012764379 0.000000000
pz 0 1.006209268 1.006209268 2.012418536 0.000000000
sum over m 3.018981270 3.018981270 6.037962541 0.000000000
px 1 0.065419256 0.065419256 0.130838512 0.000000000
py 1 0.065407996 0.065407996 0.130815992 0.000000000
pz 1 0.040404373 0.040404373 0.080808746 0.000000000
sum over m 0.171231625 0.171231625 0.342463250 0.000000000
sum over m+mul 3.190212895 3.190212895 6.380425791 0.000000000
d3z^2-r^2 0 0.196292287 0.196292287 0.392584574 0.000000000
dx^2-y^2 0 0.201528144 0.201528144 0.403056288 0.000000000
dxy 0 0.250900631 0.250900631 0.501801262 0.000000000
dxz 0 0.268518199 0.268518199 0.537036398 0.000000000
dyz 0 0.268523414 0.268523414 0.537046827 0.000000000
sum over m 1.185762674 1.185762674 2.371525348 0.000000000
d3z^2-r^2 1 0.003481533 0.003481533 0.006963067 0.000000000
dx^2-y^2 1 -0.004468526 -0.004468526 -0.008937052 0.000000000
dxy 1 0.015338662 0.015338662 0.030677323 0.000000000
dxz 1 0.003492549 0.003492549 0.006985098 0.000000000
dyz 1 0.003491426 0.003491426 0.006982852 0.000000000
sum over m 0.021335644 0.021335644 0.042671289 0.000000000
sum over m+mul 1.207098318 1.207098318 2.414196637 0.000000000
992 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000756856 1.000756856 2.001513712 0.000000000
sum over m 1.000756856 1.000756856 2.001513712 0.000000000
s 1 0.207409960 0.207409960 0.414819920 0.000000000
sum over m 0.207409960 0.207409960 0.414819920 0.000000000
s 2 0.014725999 0.014725999 0.029451998 0.000000000
sum over m 0.014725999 0.014725999 0.029451998 0.000000000
sum over m+mul 1.222892816 1.222892816 2.445785631 0.000000000
px 0 1.006375870 1.006375870 2.012751739 0.000000000
py 0 1.006373475 1.006373475 2.012746950 0.000000000
pz 0 1.006214911 1.006214911 2.012429822 0.000000000
sum over m 3.018964256 3.018964256 6.037928511 0.000000000
px 1 0.065439993 0.065439993 0.130879987 0.000000000
py 1 0.065418425 0.065418425 0.130836850 0.000000000
pz 1 0.040380762 0.040380762 0.080761524 0.000000000
sum over m 0.171239181 0.171239181 0.342478361 0.000000000
sum over m+mul 3.190203436 3.190203436 6.380406873 0.000000000
d3z^2-r^2 0 0.196294767 0.196294767 0.392589534 0.000000000
dx^2-y^2 0 0.201520194 0.201520194 0.403040389 0.000000000
dxy 0 0.250918861 0.250918861 0.501837721 0.000000000
dxz 0 0.268505238 0.268505238 0.537010476 0.000000000
dyz 0 0.268520644 0.268520644 0.537041287 0.000000000
sum over m 1.185759703 1.185759703 2.371519406 0.000000000
d3z^2-r^2 1 0.003478828 0.003478828 0.006957656 0.000000000
dx^2-y^2 1 -0.004472687 -0.004472687 -0.008945374 0.000000000
dxy 1 0.015340656 0.015340656 0.030681312 0.000000000
dxz 1 0.003491007 0.003491007 0.006982015 0.000000000
dyz 1 0.003489489 0.003489489 0.006978978 0.000000000
sum over m 0.021327293 0.021327293 0.042654586 0.000000000
sum over m+mul 1.207086996 1.207086996 2.414173993 0.000000000
993 O Up spin Down spin Sum Diff
multiple
s 0 0.893912940 0.893912940 1.787825881 0.000000000
sum over m 0.893912940 0.893912940 1.787825881 0.000000000
s 1 -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m+mul 0.890870277 0.890870277 1.781740554 0.000000000
px 0 0.787099818 0.787099818 1.574199637 0.000000000
py 0 0.786955523 0.786955523 1.573911046 0.000000000
pz 0 0.779726273 0.779726273 1.559452547 0.000000000
sum over m 2.353781615 2.353781615 4.707563230 0.000000000
px 1 -0.008741820 -0.008741820 -0.017483640 0.000000000
py 1 -0.008737472 -0.008737472 -0.017474944 0.000000000
pz 1 -0.006459855 -0.006459855 -0.012919711 0.000000000
sum over m -0.023939147 -0.023939147 -0.047878295 0.000000000
sum over m+mul 2.329842468 2.329842468 4.659684935 0.000000000
d3z^2-r^2 0 -0.006390642 -0.006390642 -0.012781283 0.000000000
dx^2-y^2 0 -0.005055774 -0.005055774 -0.010111549 0.000000000
dxy 0 -0.005436133 -0.005436133 -0.010872267 0.000000000
dxz 0 -0.006925393 -0.006925393 -0.013850787 0.000000000
dyz 0 -0.006930509 -0.006930509 -0.013861018 0.000000000
sum over m -0.030738452 -0.030738452 -0.061476904 0.000000000
sum over m+mul -0.030738452 -0.030738452 -0.061476904 0.000000000
994 O Up spin Down spin Sum Diff
multiple
s 0 0.893852153 0.893852153 1.787704305 0.000000000
sum over m 0.893852153 0.893852153 1.787704305 0.000000000
s 1 -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m+mul 0.890809938 0.890809938 1.781619875 0.000000000
px 0 0.786865166 0.786865166 1.573730332 0.000000000
py 0 0.786926851 0.786926851 1.573853701 0.000000000
pz 0 0.779871065 0.779871065 1.559742131 0.000000000
sum over m 2.353663082 2.353663082 4.707326163 0.000000000
px 1 -0.008735735 -0.008735735 -0.017471470 0.000000000
py 1 -0.008731742 -0.008731742 -0.017463485 0.000000000
pz 1 -0.006466435 -0.006466435 -0.012932870 0.000000000
sum over m -0.023933912 -0.023933912 -0.047867824 0.000000000
sum over m+mul 2.329729170 2.329729170 4.659458339 0.000000000
d3z^2-r^2 0 -0.006389061 -0.006389061 -0.012778123 0.000000000
dx^2-y^2 0 -0.005061139 -0.005061139 -0.010122278 0.000000000
dxy 0 -0.005432262 -0.005432262 -0.010864524 0.000000000
dxz 0 -0.006934207 -0.006934207 -0.013868414 0.000000000
dyz 0 -0.006934030 -0.006934030 -0.013868061 0.000000000
sum over m -0.030750700 -0.030750700 -0.061501399 0.000000000
sum over m+mul -0.030750700 -0.030750700 -0.061501399 0.000000000
995 O Up spin Down spin Sum Diff
multiple
s 0 0.893907478 0.893907478 1.787814956 0.000000000
sum over m 0.893907478 0.893907478 1.787814956 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m+mul 0.890865303 0.890865303 1.781730606 0.000000000
px 0 0.787102518 0.787102518 1.574205035 0.000000000
py 0 0.786958584 0.786958584 1.573917167 0.000000000
pz 0 0.779724467 0.779724467 1.559448933 0.000000000
sum over m 2.353785568 2.353785568 4.707571136 0.000000000
px 1 -0.008740799 -0.008740799 -0.017481598 0.000000000
py 1 -0.008733424 -0.008733424 -0.017466849 0.000000000
pz 1 -0.006457641 -0.006457641 -0.012915282 0.000000000
sum over m -0.023931864 -0.023931864 -0.047863729 0.000000000
sum over m+mul 2.329853704 2.329853704 4.659707407 0.000000000
d3z^2-r^2 0 -0.006390204 -0.006390204 -0.012780408 0.000000000
dx^2-y^2 0 -0.005055858 -0.005055858 -0.010111717 0.000000000
dxy 0 -0.005435946 -0.005435946 -0.010871892 0.000000000
dxz 0 -0.006924124 -0.006924124 -0.013848248 0.000000000
dyz 0 -0.006929974 -0.006929974 -0.013859947 0.000000000
sum over m -0.030736106 -0.030736106 -0.061472212 0.000000000
sum over m+mul -0.030736106 -0.030736106 -0.061472212 0.000000000
996 O Up spin Down spin Sum Diff
multiple
s 0 0.893893680 0.893893680 1.787787361 0.000000000
sum over m 0.893893680 0.893893680 1.787787361 0.000000000
s 1 -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m+mul 0.890851350 0.890851350 1.781702699 0.000000000
px 0 0.786824065 0.786824065 1.573648131 0.000000000
py 0 0.787088608 0.787088608 1.574177217 0.000000000
pz 0 0.779803270 0.779803270 1.559606540 0.000000000
sum over m 2.353715944 2.353715944 4.707431888 0.000000000
px 1 -0.008736146 -0.008736146 -0.017472292 0.000000000
py 1 -0.008743572 -0.008743572 -0.017487144 0.000000000
pz 1 -0.006463076 -0.006463076 -0.012926152 0.000000000
sum over m -0.023942794 -0.023942794 -0.047885589 0.000000000
sum over m+mul 2.329773149 2.329773149 4.659546299 0.000000000
d3z^2-r^2 0 -0.006390493 -0.006390493 -0.012780986 0.000000000
dx^2-y^2 0 -0.005059161 -0.005059161 -0.010118322 0.000000000
dxy 0 -0.005434201 -0.005434201 -0.010868403 0.000000000
dxz 0 -0.006933940 -0.006933940 -0.013867881 0.000000000
dyz 0 -0.006929332 -0.006929332 -0.013858665 0.000000000
sum over m -0.030747128 -0.030747128 -0.061494256 0.000000000
sum over m+mul -0.030747128 -0.030747128 -0.061494256 0.000000000
997 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742384 1.000742384 2.001484767 0.000000000
sum over m 1.000742384 1.000742384 2.001484767 0.000000000
s 1 0.207419860 0.207419860 0.414839720 0.000000000
sum over m 0.207419860 0.207419860 0.414839720 0.000000000
s 2 0.014726842 0.014726842 0.029453685 0.000000000
sum over m 0.014726842 0.014726842 0.029453685 0.000000000
sum over m+mul 1.222889086 1.222889086 2.445778172 0.000000000
px 0 1.006389813 1.006389813 2.012779625 0.000000000
py 0 1.006382190 1.006382190 2.012764379 0.000000000
pz 0 1.006209268 1.006209268 2.012418536 0.000000000
sum over m 3.018981270 3.018981270 6.037962541 0.000000000
px 1 0.065419256 0.065419256 0.130838512 0.000000000
py 1 0.065407996 0.065407996 0.130815992 0.000000000
pz 1 0.040404373 0.040404373 0.080808746 0.000000000
sum over m 0.171231625 0.171231625 0.342463250 0.000000000
sum over m+mul 3.190212895 3.190212895 6.380425791 0.000000000
d3z^2-r^2 0 0.196292287 0.196292287 0.392584573 0.000000000
dx^2-y^2 0 0.201528144 0.201528144 0.403056288 0.000000000
dxy 0 0.250900631 0.250900631 0.501801262 0.000000000
dxz 0 0.268518199 0.268518199 0.537036398 0.000000000
dyz 0 0.268523414 0.268523414 0.537046828 0.000000000
sum over m 1.185762674 1.185762674 2.371525348 0.000000000
d3z^2-r^2 1 0.003481533 0.003481533 0.006963067 0.000000000
dx^2-y^2 1 -0.004468526 -0.004468526 -0.008937052 0.000000000
dxy 1 0.015338662 0.015338662 0.030677323 0.000000000
dxz 1 0.003492549 0.003492549 0.006985098 0.000000000
dyz 1 0.003491426 0.003491426 0.006982852 0.000000000
sum over m 0.021335644 0.021335644 0.042671289 0.000000000
sum over m+mul 1.207098318 1.207098318 2.414196637 0.000000000
998 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000756856 1.000756856 2.001513712 0.000000000
sum over m 1.000756856 1.000756856 2.001513712 0.000000000
s 1 0.207409960 0.207409960 0.414819920 0.000000000
sum over m 0.207409960 0.207409960 0.414819920 0.000000000
s 2 0.014725999 0.014725999 0.029451998 0.000000000
sum over m 0.014725999 0.014725999 0.029451998 0.000000000
sum over m+mul 1.222892815 1.222892815 2.445785630 0.000000000
px 0 1.006375870 1.006375870 2.012751739 0.000000000
py 0 1.006373475 1.006373475 2.012746950 0.000000000
pz 0 1.006214911 1.006214911 2.012429822 0.000000000
sum over m 3.018964256 3.018964256 6.037928511 0.000000000
px 1 0.065439993 0.065439993 0.130879987 0.000000000
py 1 0.065418425 0.065418425 0.130836851 0.000000000
pz 1 0.040380761 0.040380761 0.080761523 0.000000000
sum over m 0.171239180 0.171239180 0.342478360 0.000000000
sum over m+mul 3.190203436 3.190203436 6.380406871 0.000000000
d3z^2-r^2 0 0.196294767 0.196294767 0.392589535 0.000000000
dx^2-y^2 0 0.201520194 0.201520194 0.403040388 0.000000000
dxy 0 0.250918861 0.250918861 0.501837721 0.000000000
dxz 0 0.268505238 0.268505238 0.537010475 0.000000000
dyz 0 0.268520643 0.268520643 0.537041287 0.000000000
sum over m 1.185759703 1.185759703 2.371519406 0.000000000
d3z^2-r^2 1 0.003478828 0.003478828 0.006957656 0.000000000
dx^2-y^2 1 -0.004472687 -0.004472687 -0.008945374 0.000000000
dxy 1 0.015340656 0.015340656 0.030681312 0.000000000
dxz 1 0.003491007 0.003491007 0.006982015 0.000000000
dyz 1 0.003489489 0.003489489 0.006978978 0.000000000
sum over m 0.021327293 0.021327293 0.042654587 0.000000000
sum over m+mul 1.207086996 1.207086996 2.414173992 0.000000000
999 O Up spin Down spin Sum Diff
multiple
s 0 0.893912940 0.893912940 1.787825881 0.000000000
sum over m 0.893912940 0.893912940 1.787825881 0.000000000
s 1 -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m+mul 0.890870277 0.890870277 1.781740554 0.000000000
px 0 0.787099819 0.787099819 1.574199637 0.000000000
py 0 0.786955523 0.786955523 1.573911047 0.000000000
pz 0 0.779726273 0.779726273 1.559452547 0.000000000
sum over m 2.353781615 2.353781615 4.707563231 0.000000000
px 1 -0.008741820 -0.008741820 -0.017483640 0.000000000
py 1 -0.008737472 -0.008737472 -0.017474944 0.000000000
pz 1 -0.006459855 -0.006459855 -0.012919711 0.000000000
sum over m -0.023939147 -0.023939147 -0.047878295 0.000000000
sum over m+mul 2.329842468 2.329842468 4.659684936 0.000000000
d3z^2-r^2 0 -0.006390642 -0.006390642 -0.012781283 0.000000000
dx^2-y^2 0 -0.005055774 -0.005055774 -0.010111549 0.000000000
dxy 0 -0.005436133 -0.005436133 -0.010872267 0.000000000
dxz 0 -0.006925393 -0.006925393 -0.013850787 0.000000000
dyz 0 -0.006930509 -0.006930509 -0.013861018 0.000000000
sum over m -0.030738452 -0.030738452 -0.061476904 0.000000000
sum over m+mul -0.030738452 -0.030738452 -0.061476904 0.000000000
1000 O Up spin Down spin Sum Diff
multiple
s 0 0.893852153 0.893852153 1.787704305 0.000000000
sum over m 0.893852153 0.893852153 1.787704305 0.000000000
s 1 -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m+mul 0.890809938 0.890809938 1.781619875 0.000000000
px 0 0.786865166 0.786865166 1.573730332 0.000000000
py 0 0.786926851 0.786926851 1.573853701 0.000000000
pz 0 0.779871065 0.779871065 1.559742131 0.000000000
sum over m 2.353663082 2.353663082 4.707326164 0.000000000
px 1 -0.008735735 -0.008735735 -0.017471470 0.000000000
py 1 -0.008731742 -0.008731742 -0.017463485 0.000000000
pz 1 -0.006466435 -0.006466435 -0.012932870 0.000000000
sum over m -0.023933912 -0.023933912 -0.047867824 0.000000000
sum over m+mul 2.329729170 2.329729170 4.659458339 0.000000000
d3z^2-r^2 0 -0.006389061 -0.006389061 -0.012778123 0.000000000
dx^2-y^2 0 -0.005061139 -0.005061139 -0.010122278 0.000000000
dxy 0 -0.005432262 -0.005432262 -0.010864524 0.000000000
dxz 0 -0.006934207 -0.006934207 -0.013868413 0.000000000
dyz 0 -0.006934030 -0.006934030 -0.013868061 0.000000000
sum over m -0.030750700 -0.030750700 -0.061501399 0.000000000
sum over m+mul -0.030750700 -0.030750700 -0.061501399 0.000000000
1001 O Up spin Down spin Sum Diff
multiple
s 0 0.893907478 0.893907478 1.787814956 0.000000000
sum over m 0.893907478 0.893907478 1.787814956 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m+mul 0.890865303 0.890865303 1.781730606 0.000000000
px 0 0.787102518 0.787102518 1.574205035 0.000000000
py 0 0.786958584 0.786958584 1.573917168 0.000000000
pz 0 0.779724467 0.779724467 1.559448933 0.000000000
sum over m 2.353785568 2.353785568 4.707571136 0.000000000
px 1 -0.008740799 -0.008740799 -0.017481598 0.000000000
py 1 -0.008733424 -0.008733424 -0.017466849 0.000000000
pz 1 -0.006457641 -0.006457641 -0.012915282 0.000000000
sum over m -0.023931864 -0.023931864 -0.047863728 0.000000000
sum over m+mul 2.329853704 2.329853704 4.659707408 0.000000000
d3z^2-r^2 0 -0.006390204 -0.006390204 -0.012780408 0.000000000
dx^2-y^2 0 -0.005055858 -0.005055858 -0.010111717 0.000000000
dxy 0 -0.005435946 -0.005435946 -0.010871892 0.000000000
dxz 0 -0.006924124 -0.006924124 -0.013848248 0.000000000
dyz 0 -0.006929974 -0.006929974 -0.013859947 0.000000000
sum over m -0.030736106 -0.030736106 -0.061472212 0.000000000
sum over m+mul -0.030736106 -0.030736106 -0.061472212 0.000000000
1002 O Up spin Down spin Sum Diff
multiple
s 0 0.893893680 0.893893680 1.787787361 0.000000000
sum over m 0.893893680 0.893893680 1.787787361 0.000000000
s 1 -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m+mul 0.890851350 0.890851350 1.781702699 0.000000000
px 0 0.786824066 0.786824066 1.573648131 0.000000000
py 0 0.787088609 0.787088609 1.574177218 0.000000000
pz 0 0.779803270 0.779803270 1.559606540 0.000000000
sum over m 2.353715944 2.353715944 4.707431888 0.000000000
px 1 -0.008736146 -0.008736146 -0.017472292 0.000000000
py 1 -0.008743572 -0.008743572 -0.017487144 0.000000000
pz 1 -0.006463076 -0.006463076 -0.012926152 0.000000000
sum over m -0.023942794 -0.023942794 -0.047885589 0.000000000
sum over m+mul 2.329773150 2.329773150 4.659546300 0.000000000
d3z^2-r^2 0 -0.006390493 -0.006390493 -0.012780986 0.000000000
dx^2-y^2 0 -0.005059161 -0.005059161 -0.010118322 0.000000000
dxy 0 -0.005434201 -0.005434201 -0.010868403 0.000000000
dxz 0 -0.006933940 -0.006933940 -0.013867881 0.000000000
dyz 0 -0.006929332 -0.006929332 -0.013858665 0.000000000
sum over m -0.030747128 -0.030747128 -0.061494256 0.000000000
sum over m+mul -0.030747128 -0.030747128 -0.061494256 0.000000000
1003 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000742383 1.000742383 2.001484767 0.000000000
sum over m 1.000742383 1.000742383 2.001484767 0.000000000
s 1 0.207419860 0.207419860 0.414839720 0.000000000
sum over m 0.207419860 0.207419860 0.414839720 0.000000000
s 2 0.014726842 0.014726842 0.029453685 0.000000000
sum over m 0.014726842 0.014726842 0.029453685 0.000000000
sum over m+mul 1.222889086 1.222889086 2.445778172 0.000000000
px 0 1.006389813 1.006389813 2.012779625 0.000000000
py 0 1.006382190 1.006382190 2.012764379 0.000000000
pz 0 1.006209268 1.006209268 2.012418536 0.000000000
sum over m 3.018981270 3.018981270 6.037962541 0.000000000
px 1 0.065419256 0.065419256 0.130838512 0.000000000
py 1 0.065407996 0.065407996 0.130815992 0.000000000
pz 1 0.040404373 0.040404373 0.080808746 0.000000000
sum over m 0.171231625 0.171231625 0.342463250 0.000000000
sum over m+mul 3.190212895 3.190212895 6.380425791 0.000000000
d3z^2-r^2 0 0.196292287 0.196292287 0.392584573 0.000000000
dx^2-y^2 0 0.201528144 0.201528144 0.403056288 0.000000000
dxy 0 0.250900631 0.250900631 0.501801261 0.000000000
dxz 0 0.268518199 0.268518199 0.537036398 0.000000000
dyz 0 0.268523414 0.268523414 0.537046828 0.000000000
sum over m 1.185762674 1.185762674 2.371525348 0.000000000
d3z^2-r^2 1 0.003481533 0.003481533 0.006963067 0.000000000
dx^2-y^2 1 -0.004468526 -0.004468526 -0.008937052 0.000000000
dxy 1 0.015338662 0.015338662 0.030677323 0.000000000
dxz 1 0.003492549 0.003492549 0.006985098 0.000000000
dyz 1 0.003491426 0.003491426 0.006982852 0.000000000
sum over m 0.021335644 0.021335644 0.042671289 0.000000000
sum over m+mul 1.207098319 1.207098319 2.414196637 0.000000000
1004 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000756856 1.000756856 2.001513712 0.000000000
sum over m 1.000756856 1.000756856 2.001513712 0.000000000
s 1 0.207409960 0.207409960 0.414819920 0.000000000
sum over m 0.207409960 0.207409960 0.414819920 0.000000000
s 2 0.014725999 0.014725999 0.029451998 0.000000000
sum over m 0.014725999 0.014725999 0.029451998 0.000000000
sum over m+mul 1.222892815 1.222892815 2.445785631 0.000000000
px 0 1.006375870 1.006375870 2.012751740 0.000000000
py 0 1.006373475 1.006373475 2.012746950 0.000000000
pz 0 1.006214911 1.006214911 2.012429822 0.000000000
sum over m 3.018964256 3.018964256 6.037928512 0.000000000
px 1 0.065439994 0.065439994 0.130879987 0.000000000
py 1 0.065418425 0.065418425 0.130836850 0.000000000
pz 1 0.040380762 0.040380762 0.080761523 0.000000000
sum over m 0.171239180 0.171239180 0.342478361 0.000000000
sum over m+mul 3.190203436 3.190203436 6.380406872 0.000000000
d3z^2-r^2 0 0.196294767 0.196294767 0.392589534 0.000000000
dx^2-y^2 0 0.201520194 0.201520194 0.403040388 0.000000000
dxy 0 0.250918861 0.250918861 0.501837721 0.000000000
dxz 0 0.268505238 0.268505238 0.537010476 0.000000000
dyz 0 0.268520643 0.268520643 0.537041287 0.000000000
sum over m 1.185759703 1.185759703 2.371519406 0.000000000
d3z^2-r^2 1 0.003478828 0.003478828 0.006957656 0.000000000
dx^2-y^2 1 -0.004472687 -0.004472687 -0.008945374 0.000000000
dxy 1 0.015340656 0.015340656 0.030681312 0.000000000
dxz 1 0.003491007 0.003491007 0.006982015 0.000000000
dyz 1 0.003489489 0.003489489 0.006978978 0.000000000
sum over m 0.021327293 0.021327293 0.042654586 0.000000000
sum over m+mul 1.207086996 1.207086996 2.414173993 0.000000000
1005 O Up spin Down spin Sum Diff
multiple
s 0 0.893912940 0.893912940 1.787825881 0.000000000
sum over m 0.893912940 0.893912940 1.787825881 0.000000000
s 1 -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m -0.003042663 -0.003042663 -0.006085327 0.000000000
sum over m+mul 0.890870277 0.890870277 1.781740554 0.000000000
px 0 0.787099819 0.787099819 1.574199637 0.000000000
py 0 0.786955523 0.786955523 1.573911046 0.000000000
pz 0 0.779726273 0.779726273 1.559452547 0.000000000
sum over m 2.353781615 2.353781615 4.707563230 0.000000000
px 1 -0.008741820 -0.008741820 -0.017483639 0.000000000
py 1 -0.008737472 -0.008737472 -0.017474944 0.000000000
pz 1 -0.006459855 -0.006459855 -0.012919711 0.000000000
sum over m -0.023939147 -0.023939147 -0.047878295 0.000000000
sum over m+mul 2.329842468 2.329842468 4.659684936 0.000000000
d3z^2-r^2 0 -0.006390642 -0.006390642 -0.012781283 0.000000000
dx^2-y^2 0 -0.005055774 -0.005055774 -0.010111549 0.000000000
dxy 0 -0.005436133 -0.005436133 -0.010872267 0.000000000
dxz 0 -0.006925393 -0.006925393 -0.013850787 0.000000000
dyz 0 -0.006930509 -0.006930509 -0.013861018 0.000000000
sum over m -0.030738452 -0.030738452 -0.061476904 0.000000000
sum over m+mul -0.030738452 -0.030738452 -0.061476904 0.000000000
1006 O Up spin Down spin Sum Diff
multiple
s 0 0.893852153 0.893852153 1.787704305 0.000000000
sum over m 0.893852153 0.893852153 1.787704305 0.000000000
s 1 -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m -0.003042215 -0.003042215 -0.006084430 0.000000000
sum over m+mul 0.890809938 0.890809938 1.781619875 0.000000000
px 0 0.786865166 0.786865166 1.573730332 0.000000000
py 0 0.786926851 0.786926851 1.573853701 0.000000000
pz 0 0.779871065 0.779871065 1.559742131 0.000000000
sum over m 2.353663082 2.353663082 4.707326164 0.000000000
px 1 -0.008735735 -0.008735735 -0.017471470 0.000000000
py 1 -0.008731742 -0.008731742 -0.017463485 0.000000000
pz 1 -0.006466435 -0.006466435 -0.012932870 0.000000000
sum over m -0.023933912 -0.023933912 -0.047867824 0.000000000
sum over m+mul 2.329729170 2.329729170 4.659458340 0.000000000
d3z^2-r^2 0 -0.006389061 -0.006389061 -0.012778123 0.000000000
dx^2-y^2 0 -0.005061139 -0.005061139 -0.010122278 0.000000000
dxy 0 -0.005432262 -0.005432262 -0.010864524 0.000000000
dxz 0 -0.006934207 -0.006934207 -0.013868414 0.000000000
dyz 0 -0.006934030 -0.006934030 -0.013868061 0.000000000
sum over m -0.030750700 -0.030750700 -0.061501399 0.000000000
sum over m+mul -0.030750700 -0.030750700 -0.061501399 0.000000000
1007 O Up spin Down spin Sum Diff
multiple
s 0 0.893907478 0.893907478 1.787814956 0.000000000
sum over m 0.893907478 0.893907478 1.787814956 0.000000000
s 1 -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m -0.003042175 -0.003042175 -0.006084349 0.000000000
sum over m+mul 0.890865303 0.890865303 1.781730606 0.000000000
px 0 0.787102517 0.787102517 1.574205035 0.000000000
py 0 0.786958584 0.786958584 1.573917167 0.000000000
pz 0 0.779724467 0.779724467 1.559448934 0.000000000
sum over m 2.353785568 2.353785568 4.707571135 0.000000000
px 1 -0.008740799 -0.008740799 -0.017481598 0.000000000
py 1 -0.008733424 -0.008733424 -0.017466849 0.000000000
pz 1 -0.006457641 -0.006457641 -0.012915282 0.000000000
sum over m -0.023931864 -0.023931864 -0.047863729 0.000000000
sum over m+mul 2.329853703 2.329853703 4.659707407 0.000000000
d3z^2-r^2 0 -0.006390204 -0.006390204 -0.012780408 0.000000000
dx^2-y^2 0 -0.005055858 -0.005055858 -0.010111717 0.000000000
dxy 0 -0.005435946 -0.005435946 -0.010871892 0.000000000
dxz 0 -0.006924124 -0.006924124 -0.013848248 0.000000000
dyz 0 -0.006929974 -0.006929974 -0.013859947 0.000000000
sum over m -0.030736106 -0.030736106 -0.061472212 0.000000000
sum over m+mul -0.030736106 -0.030736106 -0.061472212 0.000000000
1008 O Up spin Down spin Sum Diff
multiple
s 0 0.893893680 0.893893680 1.787787361 0.000000000
sum over m 0.893893680 0.893893680 1.787787361 0.000000000
s 1 -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m -0.003042331 -0.003042331 -0.006084661 0.000000000
sum over m+mul 0.890851350 0.890851350 1.781702699 0.000000000
px 0 0.786824065 0.786824065 1.573648131 0.000000000
py 0 0.787088608 0.787088608 1.574177217 0.000000000
pz 0 0.779803270 0.779803270 1.559606540 0.000000000
sum over m 2.353715944 2.353715944 4.707431888 0.000000000
px 1 -0.008736146 -0.008736146 -0.017472292 0.000000000
py 1 -0.008743572 -0.008743572 -0.017487144 0.000000000
pz 1 -0.006463076 -0.006463076 -0.012926152 0.000000000
sum over m -0.023942794 -0.023942794 -0.047885589 0.000000000
sum over m+mul 2.329773150 2.329773150 4.659546299 0.000000000
d3z^2-r^2 0 -0.006390493 -0.006390493 -0.012780986 0.000000000
dx^2-y^2 0 -0.005059161 -0.005059161 -0.010118322 0.000000000
dxy 0 -0.005434201 -0.005434201 -0.010868403 0.000000000
dxz 0 -0.006933940 -0.006933940 -0.013867881 0.000000000
dyz 0 -0.006929332 -0.006929332 -0.013858665 0.000000000
sum over m -0.030747128 -0.030747128 -0.061494256 0.000000000
sum over m+mul -0.030747128 -0.030747128 -0.061494256 0.000000000
1009 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000749053 1.000749053 2.001498106 0.000000000
sum over m 1.000749053 1.000749053 2.001498106 0.000000000
s 1 0.207411714 0.207411714 0.414823428 0.000000000
sum over m 0.207411714 0.207411714 0.414823428 0.000000000
s 2 0.014727165 0.014727165 0.029454329 0.000000000
sum over m 0.014727165 0.014727165 0.029454329 0.000000000
sum over m+mul 1.222887932 1.222887932 2.445775864 0.000000000
px 0 1.006375727 1.006375727 2.012751453 0.000000000
py 0 1.006375727 1.006375727 2.012751453 0.000000000
pz 0 1.006205238 1.006205238 2.012410476 0.000000000
sum over m 3.018956691 3.018956691 6.037913382 0.000000000
px 1 0.065436910 0.065436910 0.130873820 0.000000000
py 1 0.065436910 0.065436910 0.130873820 0.000000000
pz 1 0.040387885 0.040387885 0.080775771 0.000000000
sum over m 0.171261705 0.171261705 0.342523410 0.000000000
sum over m+mul 3.190218396 3.190218396 6.380436792 0.000000000
d3z^2-r^2 0 0.196313375 0.196313375 0.392626749 0.000000000
dx^2-y^2 0 0.201526534 0.201526534 0.403053069 0.000000000
dxy 0 0.250917796 0.250917796 0.501835592 0.000000000
dxz 0 0.268510426 0.268510426 0.537020853 0.000000000
dyz 0 0.268510426 0.268510426 0.537020853 0.000000000
sum over m 1.185778558 1.185778558 2.371557116 0.000000000
d3z^2-r^2 1 0.003481847 0.003481847 0.006963695 0.000000000
dx^2-y^2 1 -0.004471008 -0.004471008 -0.008942017 0.000000000
dxy 1 0.015341368 0.015341368 0.030682735 0.000000000
dxz 1 0.003497787 0.003497787 0.006995575 0.000000000
dyz 1 0.003497787 0.003497787 0.006995575 0.000000000
sum over m 0.021347782 0.021347782 0.042695563 0.000000000
sum over m+mul 1.207126339 1.207126339 2.414252679 0.000000000
1010 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000765816 1.000765816 2.001531632 0.000000000
sum over m 1.000765816 1.000765816 2.001531632 0.000000000
s 1 0.207397067 0.207397067 0.414794135 0.000000000
sum over m 0.207397067 0.207397067 0.414794135 0.000000000
s 2 0.014721938 0.014721938 0.029443876 0.000000000
sum over m 0.014721938 0.014721938 0.029443876 0.000000000
sum over m+mul 1.222884821 1.222884821 2.445769643 0.000000000
px 0 1.006392943 1.006392943 2.012785886 0.000000000
py 0 1.006392943 1.006392943 2.012785886 0.000000000
pz 0 1.006196065 1.006196065 2.012392130 0.000000000
sum over m 3.018981951 3.018981951 6.037963903 0.000000000
px 1 0.065418035 0.065418035 0.130836070 0.000000000
py 1 0.065418035 0.065418035 0.130836070 0.000000000
pz 1 0.040370672 0.040370672 0.080741344 0.000000000
sum over m 0.171206742 0.171206742 0.342413485 0.000000000
sum over m+mul 3.190188694 3.190188694 6.380377388 0.000000000
d3z^2-r^2 0 0.196290408 0.196290408 0.392580816 0.000000000
dx^2-y^2 0 0.201530687 0.201530687 0.403061374 0.000000000
dxy 0 0.250918139 0.250918139 0.501836278 0.000000000
dxz 0 0.268508312 0.268508312 0.537016623 0.000000000
dyz 0 0.268508312 0.268508312 0.537016624 0.000000000
sum over m 1.185755857 1.185755857 2.371511715 0.000000000
d3z^2-r^2 1 0.003471451 0.003471451 0.006942902 0.000000000
dx^2-y^2 1 -0.004478841 -0.004478841 -0.008957681 0.000000000
dxy 1 0.015342155 0.015342155 0.030684310 0.000000000
dxz 1 0.003484230 0.003484230 0.006968460 0.000000000
dyz 1 0.003484230 0.003484230 0.006968460 0.000000000
sum over m 0.021303225 0.021303225 0.042606450 0.000000000
sum over m+mul 1.207059082 1.207059082 2.414118165 0.000000000
1011 O Up spin Down spin Sum Diff
multiple
s 0 0.893910559 0.893910559 1.787821117 0.000000000
sum over m 0.893910559 0.893910559 1.787821117 0.000000000
s 1 -0.003042509 -0.003042509 -0.006085018 0.000000000
sum over m -0.003042509 -0.003042509 -0.006085018 0.000000000
sum over m+mul 0.890868050 0.890868050 1.781736099 0.000000000
px 0 0.787054532 0.787054532 1.574109063 0.000000000
py 0 0.787054532 0.787054532 1.574109063 0.000000000
pz 0 0.779680845 0.779680845 1.559361690 0.000000000
sum over m 2.353789908 2.353789908 4.707579817 0.000000000
px 1 -0.008732323 -0.008732323 -0.017464647 0.000000000
py 1 -0.008732323 -0.008732323 -0.017464647 0.000000000
pz 1 -0.006453591 -0.006453591 -0.012907182 0.000000000
sum over m -0.023918238 -0.023918238 -0.047836476 0.000000000
sum over m+mul 2.329871671 2.329871671 4.659743341 0.000000000
d3z^2-r^2 0 -0.006390173 -0.006390173 -0.012780345 0.000000000
dx^2-y^2 0 -0.005052379 -0.005052379 -0.010104759 0.000000000
dxy 0 -0.005435960 -0.005435960 -0.010871920 0.000000000
dxz 0 -0.006924392 -0.006924392 -0.013848784 0.000000000
dyz 0 -0.006924392 -0.006924392 -0.013848784 0.000000000
sum over m -0.030727296 -0.030727296 -0.061454592 0.000000000
sum over m+mul -0.030727296 -0.030727296 -0.061454592 0.000000000
1012 O Up spin Down spin Sum Diff
multiple
s 0 0.893853795 0.893853795 1.787707590 0.000000000
sum over m 0.893853795 0.893853795 1.787707590 0.000000000
s 1 -0.003041461 -0.003041461 -0.006082922 0.000000000
sum over m -0.003041461 -0.003041461 -0.006082922 0.000000000
sum over m+mul 0.890812334 0.890812334 1.781624668 0.000000000
px 0 0.786889313 0.786889313 1.573778625 0.000000000
py 0 0.786889313 0.786889313 1.573778625 0.000000000
pz 0 0.779892284 0.779892284 1.559784569 0.000000000
sum over m 2.353670910 2.353670910 4.707341819 0.000000000
px 1 -0.008728829 -0.008728829 -0.017457658 0.000000000
py 1 -0.008728829 -0.008728829 -0.017457658 0.000000000
pz 1 -0.006469050 -0.006469050 -0.012938100 0.000000000
sum over m -0.023926707 -0.023926707 -0.047853415 0.000000000
sum over m+mul 2.329744202 2.329744202 4.659488404 0.000000000
d3z^2-r^2 0 -0.006390369 -0.006390369 -0.012780738 0.000000000
dx^2-y^2 0 -0.005061187 -0.005061187 -0.010122375 0.000000000
dxy 0 -0.005433166 -0.005433166 -0.010866331 0.000000000
dxz 0 -0.006934307 -0.006934307 -0.013868613 0.000000000
dyz 0 -0.006934307 -0.006934307 -0.013868613 0.000000000
sum over m -0.030753335 -0.030753335 -0.061506671 0.000000000
sum over m+mul -0.030753335 -0.030753335 -0.061506671 0.000000000
1013 O Up spin Down spin Sum Diff
multiple
s 0 0.893906500 0.893906500 1.787813000 0.000000000
sum over m 0.893906500 0.893906500 1.787813000 0.000000000
s 1 -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m+mul 0.890864606 0.890864606 1.781729211 0.000000000
px 0 0.787154605 0.787154605 1.574309210 0.000000000
py 0 0.786831962 0.786831962 1.573663925 0.000000000
pz 0 0.779778688 0.779778688 1.559557377 0.000000000
sum over m 2.353765256 2.353765256 4.707530511 0.000000000
px 1 -0.008748713 -0.008748713 -0.017497425 0.000000000
py 1 -0.008735308 -0.008735308 -0.017470616 0.000000000
pz 1 -0.006462259 -0.006462259 -0.012924519 0.000000000
sum over m -0.023946280 -0.023946280 -0.047892560 0.000000000
sum over m+mul 2.329818976 2.329818976 4.659637951 0.000000000
d3z^2-r^2 0 -0.006391385 -0.006391385 -0.012782771 0.000000000
dx^2-y^2 0 -0.005058286 -0.005058286 -0.010116573 0.000000000
dxy 0 -0.005434881 -0.005434881 -0.010869762 0.000000000
dxz 0 -0.006926170 -0.006926170 -0.013852340 0.000000000
dyz 0 -0.006933211 -0.006933211 -0.013866422 0.000000000
sum over m -0.030743934 -0.030743934 -0.061487868 0.000000000
sum over m+mul -0.030743934 -0.030743934 -0.061487868 0.000000000
1014 O Up spin Down spin Sum Diff
multiple
s 0 0.893906500 0.893906500 1.787813000 0.000000000
sum over m 0.893906500 0.893906500 1.787813000 0.000000000
s 1 -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m+mul 0.890864606 0.890864606 1.781729211 0.000000000
px 0 0.786831962 0.786831962 1.573663925 0.000000000
py 0 0.787154605 0.787154605 1.574309210 0.000000000
pz 0 0.779778688 0.779778688 1.559557376 0.000000000
sum over m 2.353765255 2.353765255 4.707530511 0.000000000
px 1 -0.008735308 -0.008735308 -0.017470616 0.000000000
py 1 -0.008748713 -0.008748713 -0.017497425 0.000000000
pz 1 -0.006462260 -0.006462260 -0.012924519 0.000000000
sum over m -0.023946281 -0.023946281 -0.047892561 0.000000000
sum over m+mul 2.329818975 2.329818975 4.659637949 0.000000000
d3z^2-r^2 0 -0.006391385 -0.006391385 -0.012782771 0.000000000
dx^2-y^2 0 -0.005058286 -0.005058286 -0.010116573 0.000000000
dxy 0 -0.005434881 -0.005434881 -0.010869762 0.000000000
dxz 0 -0.006933211 -0.006933211 -0.013866422 0.000000000
dyz 0 -0.006926170 -0.006926170 -0.013852340 0.000000000
sum over m -0.030743934 -0.030743934 -0.061487868 0.000000000
sum over m+mul -0.030743934 -0.030743934 -0.061487868 0.000000000
1015 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000749053 1.000749053 2.001498106 0.000000000
sum over m 1.000749053 1.000749053 2.001498106 0.000000000
s 1 0.207411714 0.207411714 0.414823428 0.000000000
sum over m 0.207411714 0.207411714 0.414823428 0.000000000
s 2 0.014727165 0.014727165 0.029454329 0.000000000
sum over m 0.014727165 0.014727165 0.029454329 0.000000000
sum over m+mul 1.222887932 1.222887932 2.445775864 0.000000000
px 0 1.006375727 1.006375727 2.012751453 0.000000000
py 0 1.006375727 1.006375727 2.012751453 0.000000000
pz 0 1.006205238 1.006205238 2.012410475 0.000000000
sum over m 3.018956691 3.018956691 6.037913382 0.000000000
px 1 0.065436910 0.065436910 0.130873820 0.000000000
py 1 0.065436910 0.065436910 0.130873820 0.000000000
pz 1 0.040387885 0.040387885 0.080775771 0.000000000
sum over m 0.171261705 0.171261705 0.342523410 0.000000000
sum over m+mul 3.190218396 3.190218396 6.380436792 0.000000000
d3z^2-r^2 0 0.196313375 0.196313375 0.392626749 0.000000000
dx^2-y^2 0 0.201526534 0.201526534 0.403053069 0.000000000
dxy 0 0.250917796 0.250917796 0.501835592 0.000000000
dxz 0 0.268510427 0.268510427 0.537020853 0.000000000
dyz 0 0.268510427 0.268510427 0.537020853 0.000000000
sum over m 1.185778558 1.185778558 2.371557116 0.000000000
d3z^2-r^2 1 0.003481847 0.003481847 0.006963695 0.000000000
dx^2-y^2 1 -0.004471008 -0.004471008 -0.008942017 0.000000000
dxy 1 0.015341368 0.015341368 0.030682735 0.000000000
dxz 1 0.003497787 0.003497787 0.006995575 0.000000000
dyz 1 0.003497787 0.003497787 0.006995575 0.000000000
sum over m 0.021347781 0.021347781 0.042695563 0.000000000
sum over m+mul 1.207126339 1.207126339 2.414252679 0.000000000
1016 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000765816 1.000765816 2.001531633 0.000000000
sum over m 1.000765816 1.000765816 2.001531633 0.000000000
s 1 0.207397067 0.207397067 0.414794135 0.000000000
sum over m 0.207397067 0.207397067 0.414794135 0.000000000
s 2 0.014721938 0.014721938 0.029443876 0.000000000
sum over m 0.014721938 0.014721938 0.029443876 0.000000000
sum over m+mul 1.222884822 1.222884822 2.445769643 0.000000000
px 0 1.006392943 1.006392943 2.012785886 0.000000000
py 0 1.006392943 1.006392943 2.012785886 0.000000000
pz 0 1.006196065 1.006196065 2.012392130 0.000000000
sum over m 3.018981951 3.018981951 6.037963902 0.000000000
px 1 0.065418035 0.065418035 0.130836070 0.000000000
py 1 0.065418036 0.065418036 0.130836071 0.000000000
pz 1 0.040370673 0.040370673 0.080741345 0.000000000
sum over m 0.171206743 0.171206743 0.342413486 0.000000000
sum over m+mul 3.190188694 3.190188694 6.380377389 0.000000000
d3z^2-r^2 0 0.196290408 0.196290408 0.392580816 0.000000000
dx^2-y^2 0 0.201530687 0.201530687 0.403061374 0.000000000
dxy 0 0.250918139 0.250918139 0.501836278 0.000000000
dxz 0 0.268508312 0.268508312 0.537016624 0.000000000
dyz 0 0.268508312 0.268508312 0.537016623 0.000000000
sum over m 1.185755857 1.185755857 2.371511715 0.000000000
d3z^2-r^2 1 0.003471451 0.003471451 0.006942902 0.000000000
dx^2-y^2 1 -0.004478841 -0.004478841 -0.008957682 0.000000000
dxy 1 0.015342155 0.015342155 0.030684310 0.000000000
dxz 1 0.003484230 0.003484230 0.006968460 0.000000000
dyz 1 0.003484230 0.003484230 0.006968460 0.000000000
sum over m 0.021303225 0.021303225 0.042606450 0.000000000
sum over m+mul 1.207059082 1.207059082 2.414118165 0.000000000
1017 O Up spin Down spin Sum Diff
multiple
s 0 0.893910559 0.893910559 1.787821117 0.000000000
sum over m 0.893910559 0.893910559 1.787821117 0.000000000
s 1 -0.003042509 -0.003042509 -0.006085018 0.000000000
sum over m -0.003042509 -0.003042509 -0.006085018 0.000000000
sum over m+mul 0.890868050 0.890868050 1.781736099 0.000000000
px 0 0.787054532 0.787054532 1.574109064 0.000000000
py 0 0.787054532 0.787054532 1.574109063 0.000000000
pz 0 0.779680845 0.779680845 1.559361690 0.000000000
sum over m 2.353789909 2.353789909 4.707579817 0.000000000
px 1 -0.008732323 -0.008732323 -0.017464647 0.000000000
py 1 -0.008732323 -0.008732323 -0.017464647 0.000000000
pz 1 -0.006453591 -0.006453591 -0.012907182 0.000000000
sum over m -0.023918238 -0.023918238 -0.047836476 0.000000000
sum over m+mul 2.329871671 2.329871671 4.659743341 0.000000000
d3z^2-r^2 0 -0.006390173 -0.006390173 -0.012780345 0.000000000
dx^2-y^2 0 -0.005052379 -0.005052379 -0.010104759 0.000000000
dxy 0 -0.005435960 -0.005435960 -0.010871920 0.000000000
dxz 0 -0.006924392 -0.006924392 -0.013848784 0.000000000
dyz 0 -0.006924392 -0.006924392 -0.013848784 0.000000000
sum over m -0.030727296 -0.030727296 -0.061454592 0.000000000
sum over m+mul -0.030727296 -0.030727296 -0.061454592 0.000000000
1018 O Up spin Down spin Sum Diff
multiple
s 0 0.893853795 0.893853795 1.787707590 0.000000000
sum over m 0.893853795 0.893853795 1.787707590 0.000000000
s 1 -0.003041461 -0.003041461 -0.006082922 0.000000000
sum over m -0.003041461 -0.003041461 -0.006082922 0.000000000
sum over m+mul 0.890812334 0.890812334 1.781624668 0.000000000
px 0 0.786889313 0.786889313 1.573778626 0.000000000
py 0 0.786889313 0.786889313 1.573778626 0.000000000
pz 0 0.779892284 0.779892284 1.559784569 0.000000000
sum over m 2.353670910 2.353670910 4.707341820 0.000000000
px 1 -0.008728829 -0.008728829 -0.017457658 0.000000000
py 1 -0.008728829 -0.008728829 -0.017457658 0.000000000
pz 1 -0.006469050 -0.006469050 -0.012938100 0.000000000
sum over m -0.023926707 -0.023926707 -0.047853415 0.000000000
sum over m+mul 2.329744203 2.329744203 4.659488405 0.000000000
d3z^2-r^2 0 -0.006390369 -0.006390369 -0.012780738 0.000000000
dx^2-y^2 0 -0.005061187 -0.005061187 -0.010122375 0.000000000
dxy 0 -0.005433166 -0.005433166 -0.010866331 0.000000000
dxz 0 -0.006934307 -0.006934307 -0.013868614 0.000000000
dyz 0 -0.006934307 -0.006934307 -0.013868613 0.000000000
sum over m -0.030753335 -0.030753335 -0.061506671 0.000000000
sum over m+mul -0.030753335 -0.030753335 -0.061506671 0.000000000
1019 O Up spin Down spin Sum Diff
multiple
s 0 0.893906500 0.893906500 1.787813000 0.000000000
sum over m 0.893906500 0.893906500 1.787813000 0.000000000
s 1 -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m+mul 0.890864606 0.890864606 1.781729211 0.000000000
px 0 0.787154605 0.787154605 1.574309210 0.000000000
py 0 0.786831962 0.786831962 1.573663925 0.000000000
pz 0 0.779778688 0.779778688 1.559557376 0.000000000
sum over m 2.353765256 2.353765256 4.707530511 0.000000000
px 1 -0.008748713 -0.008748713 -0.017497425 0.000000000
py 1 -0.008735308 -0.008735308 -0.017470616 0.000000000
pz 1 -0.006462259 -0.006462259 -0.012924519 0.000000000
sum over m -0.023946280 -0.023946280 -0.047892560 0.000000000
sum over m+mul 2.329818975 2.329818975 4.659637951 0.000000000
d3z^2-r^2 0 -0.006391385 -0.006391385 -0.012782771 0.000000000
dx^2-y^2 0 -0.005058286 -0.005058286 -0.010116573 0.000000000
dxy 0 -0.005434881 -0.005434881 -0.010869762 0.000000000
dxz 0 -0.006926170 -0.006926170 -0.013852340 0.000000000
dyz 0 -0.006933211 -0.006933211 -0.013866422 0.000000000
sum over m -0.030743934 -0.030743934 -0.061487867 0.000000000
sum over m+mul -0.030743934 -0.030743934 -0.061487867 0.000000000
1020 O Up spin Down spin Sum Diff
multiple
s 0 0.893906500 0.893906500 1.787813000 0.000000000
sum over m 0.893906500 0.893906500 1.787813000 0.000000000
s 1 -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m+mul 0.890864606 0.890864606 1.781729211 0.000000000
px 0 0.786831962 0.786831962 1.573663924 0.000000000
py 0 0.787154605 0.787154605 1.574309210 0.000000000
pz 0 0.779778688 0.779778688 1.559557376 0.000000000
sum over m 2.353765255 2.353765255 4.707530510 0.000000000
px 1 -0.008735308 -0.008735308 -0.017470616 0.000000000
py 1 -0.008748713 -0.008748713 -0.017497425 0.000000000
pz 1 -0.006462260 -0.006462260 -0.012924519 0.000000000
sum over m -0.023946280 -0.023946280 -0.047892561 0.000000000
sum over m+mul 2.329818975 2.329818975 4.659637949 0.000000000
d3z^2-r^2 0 -0.006391385 -0.006391385 -0.012782771 0.000000000
dx^2-y^2 0 -0.005058286 -0.005058286 -0.010116573 0.000000000
dxy 0 -0.005434881 -0.005434881 -0.010869762 0.000000000
dxz 0 -0.006933211 -0.006933211 -0.013866422 0.000000000
dyz 0 -0.006926170 -0.006926170 -0.013852340 0.000000000
sum over m -0.030743934 -0.030743934 -0.061487868 0.000000000
sum over m+mul -0.030743934 -0.030743934 -0.061487868 0.000000000
1021 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000749053 1.000749053 2.001498106 0.000000000
sum over m 1.000749053 1.000749053 2.001498106 0.000000000
s 1 0.207411714 0.207411714 0.414823428 0.000000000
sum over m 0.207411714 0.207411714 0.414823428 0.000000000
s 2 0.014727165 0.014727165 0.029454329 0.000000000
sum over m 0.014727165 0.014727165 0.029454329 0.000000000
sum over m+mul 1.222887932 1.222887932 2.445775863 0.000000000
px 0 1.006375727 1.006375727 2.012751453 0.000000000
py 0 1.006375727 1.006375727 2.012751454 0.000000000
pz 0 1.006205238 1.006205238 2.012410476 0.000000000
sum over m 3.018956691 3.018956691 6.037913382 0.000000000
px 1 0.065436910 0.065436910 0.130873820 0.000000000
py 1 0.065436910 0.065436910 0.130873820 0.000000000
pz 1 0.040387885 0.040387885 0.080775770 0.000000000
sum over m 0.171261705 0.171261705 0.342523410 0.000000000
sum over m+mul 3.190218396 3.190218396 6.380436792 0.000000000
d3z^2-r^2 0 0.196313375 0.196313375 0.392626749 0.000000000
dx^2-y^2 0 0.201526534 0.201526534 0.403053068 0.000000000
dxy 0 0.250917796 0.250917796 0.501835592 0.000000000
dxz 0 0.268510427 0.268510427 0.537020853 0.000000000
dyz 0 0.268510426 0.268510426 0.537020853 0.000000000
sum over m 1.185778558 1.185778558 2.371557116 0.000000000
d3z^2-r^2 1 0.003481847 0.003481847 0.006963695 0.000000000
dx^2-y^2 1 -0.004471008 -0.004471008 -0.008942017 0.000000000
dxy 1 0.015341368 0.015341368 0.030682735 0.000000000
dxz 1 0.003497787 0.003497787 0.006995575 0.000000000
dyz 1 0.003497787 0.003497787 0.006995575 0.000000000
sum over m 0.021347782 0.021347782 0.042695563 0.000000000
sum over m+mul 1.207126339 1.207126339 2.414252679 0.000000000
1022 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000765816 1.000765816 2.001531632 0.000000000
sum over m 1.000765816 1.000765816 2.001531632 0.000000000
s 1 0.207397067 0.207397067 0.414794135 0.000000000
sum over m 0.207397067 0.207397067 0.414794135 0.000000000
s 2 0.014721938 0.014721938 0.029443876 0.000000000
sum over m 0.014721938 0.014721938 0.029443876 0.000000000
sum over m+mul 1.222884822 1.222884822 2.445769643 0.000000000
px 0 1.006392943 1.006392943 2.012785886 0.000000000
py 0 1.006392943 1.006392943 2.012785886 0.000000000
pz 0 1.006196065 1.006196065 2.012392130 0.000000000
sum over m 3.018981951 3.018981951 6.037963902 0.000000000
px 1 0.065418035 0.065418035 0.130836070 0.000000000
py 1 0.065418035 0.065418035 0.130836070 0.000000000
pz 1 0.040370672 0.040370672 0.080741344 0.000000000
sum over m 0.171206743 0.171206743 0.342413485 0.000000000
sum over m+mul 3.190188694 3.190188694 6.380377387 0.000000000
d3z^2-r^2 0 0.196290408 0.196290408 0.392580816 0.000000000
dx^2-y^2 0 0.201530687 0.201530687 0.403061374 0.000000000
dxy 0 0.250918139 0.250918139 0.501836277 0.000000000
dxz 0 0.268508312 0.268508312 0.537016624 0.000000000
dyz 0 0.268508312 0.268508312 0.537016624 0.000000000
sum over m 1.185755858 1.185755858 2.371511716 0.000000000
d3z^2-r^2 1 0.003471451 0.003471451 0.006942902 0.000000000
dx^2-y^2 1 -0.004478841 -0.004478841 -0.008957681 0.000000000
dxy 1 0.015342155 0.015342155 0.030684310 0.000000000
dxz 1 0.003484230 0.003484230 0.006968460 0.000000000
dyz 1 0.003484230 0.003484230 0.006968460 0.000000000
sum over m 0.021303225 0.021303225 0.042606450 0.000000000
sum over m+mul 1.207059083 1.207059083 2.414118166 0.000000000
1023 O Up spin Down spin Sum Diff
multiple
s 0 0.893910559 0.893910559 1.787821117 0.000000000
sum over m 0.893910559 0.893910559 1.787821117 0.000000000
s 1 -0.003042509 -0.003042509 -0.006085018 0.000000000
sum over m -0.003042509 -0.003042509 -0.006085018 0.000000000
sum over m+mul 0.890868050 0.890868050 1.781736099 0.000000000
px 0 0.787054532 0.787054532 1.574109063 0.000000000
py 0 0.787054532 0.787054532 1.574109063 0.000000000
pz 0 0.779680845 0.779680845 1.559361690 0.000000000
sum over m 2.353789908 2.353789908 4.707579817 0.000000000
px 1 -0.008732323 -0.008732323 -0.017464647 0.000000000
py 1 -0.008732323 -0.008732323 -0.017464647 0.000000000
pz 1 -0.006453591 -0.006453591 -0.012907182 0.000000000
sum over m -0.023918238 -0.023918238 -0.047836476 0.000000000
sum over m+mul 2.329871670 2.329871670 4.659743341 0.000000000
d3z^2-r^2 0 -0.006390173 -0.006390173 -0.012780345 0.000000000
dx^2-y^2 0 -0.005052379 -0.005052379 -0.010104759 0.000000000
dxy 0 -0.005435960 -0.005435960 -0.010871920 0.000000000
dxz 0 -0.006924392 -0.006924392 -0.013848784 0.000000000
dyz 0 -0.006924392 -0.006924392 -0.013848784 0.000000000
sum over m -0.030727296 -0.030727296 -0.061454592 0.000000000
sum over m+mul -0.030727296 -0.030727296 -0.061454592 0.000000000
1024 O Up spin Down spin Sum Diff
multiple
s 0 0.893853795 0.893853795 1.787707590 0.000000000
sum over m 0.893853795 0.893853795 1.787707590 0.000000000
s 1 -0.003041461 -0.003041461 -0.006082922 0.000000000
sum over m -0.003041461 -0.003041461 -0.006082922 0.000000000
sum over m+mul 0.890812334 0.890812334 1.781624668 0.000000000
px 0 0.786889313 0.786889313 1.573778625 0.000000000
py 0 0.786889313 0.786889313 1.573778625 0.000000000
pz 0 0.779892284 0.779892284 1.559784569 0.000000000
sum over m 2.353670910 2.353670910 4.707341819 0.000000000
px 1 -0.008728829 -0.008728829 -0.017457658 0.000000000
py 1 -0.008728829 -0.008728829 -0.017457658 0.000000000
pz 1 -0.006469050 -0.006469050 -0.012938100 0.000000000
sum over m -0.023926707 -0.023926707 -0.047853415 0.000000000
sum over m+mul 2.329744202 2.329744202 4.659488404 0.000000000
d3z^2-r^2 0 -0.006390369 -0.006390369 -0.012780738 0.000000000
dx^2-y^2 0 -0.005061187 -0.005061187 -0.010122375 0.000000000
dxy 0 -0.005433166 -0.005433166 -0.010866331 0.000000000
dxz 0 -0.006934307 -0.006934307 -0.013868614 0.000000000
dyz 0 -0.006934307 -0.006934307 -0.013868613 0.000000000
sum over m -0.030753335 -0.030753335 -0.061506671 0.000000000
sum over m+mul -0.030753335 -0.030753335 -0.061506671 0.000000000
1025 O Up spin Down spin Sum Diff
multiple
s 0 0.893906500 0.893906500 1.787813000 0.000000000
sum over m 0.893906500 0.893906500 1.787813000 0.000000000
s 1 -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m+mul 0.890864606 0.890864606 1.781729211 0.000000000
px 0 0.787154605 0.787154605 1.574309210 0.000000000
py 0 0.786831962 0.786831962 1.573663924 0.000000000
pz 0 0.779778688 0.779778688 1.559557376 0.000000000
sum over m 2.353765255 2.353765255 4.707530510 0.000000000
px 1 -0.008748713 -0.008748713 -0.017497425 0.000000000
py 1 -0.008735308 -0.008735308 -0.017470616 0.000000000
pz 1 -0.006462259 -0.006462259 -0.012924519 0.000000000
sum over m -0.023946280 -0.023946280 -0.047892560 0.000000000
sum over m+mul 2.329818975 2.329818975 4.659637950 0.000000000
d3z^2-r^2 0 -0.006391385 -0.006391385 -0.012782771 0.000000000
dx^2-y^2 0 -0.005058286 -0.005058286 -0.010116573 0.000000000
dxy 0 -0.005434881 -0.005434881 -0.010869762 0.000000000
dxz 0 -0.006926170 -0.006926170 -0.013852340 0.000000000
dyz 0 -0.006933211 -0.006933211 -0.013866422 0.000000000
sum over m -0.030743934 -0.030743934 -0.061487867 0.000000000
sum over m+mul -0.030743934 -0.030743934 -0.061487867 0.000000000
1026 O Up spin Down spin Sum Diff
multiple
s 0 0.893906500 0.893906500 1.787813000 0.000000000
sum over m 0.893906500 0.893906500 1.787813000 0.000000000
s 1 -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m+mul 0.890864606 0.890864606 1.781729211 0.000000000
px 0 0.786831962 0.786831962 1.573663925 0.000000000
py 0 0.787154605 0.787154605 1.574309210 0.000000000
pz 0 0.779778688 0.779778688 1.559557376 0.000000000
sum over m 2.353765256 2.353765256 4.707530511 0.000000000
px 1 -0.008735308 -0.008735308 -0.017470616 0.000000000
py 1 -0.008748713 -0.008748713 -0.017497425 0.000000000
pz 1 -0.006462260 -0.006462260 -0.012924519 0.000000000
sum over m -0.023946280 -0.023946280 -0.047892561 0.000000000
sum over m+mul 2.329818975 2.329818975 4.659637950 0.000000000
d3z^2-r^2 0 -0.006391385 -0.006391385 -0.012782771 0.000000000
dx^2-y^2 0 -0.005058286 -0.005058286 -0.010116573 0.000000000
dxy 0 -0.005434881 -0.005434881 -0.010869762 0.000000000
dxz 0 -0.006933211 -0.006933211 -0.013866422 0.000000000
dyz 0 -0.006926170 -0.006926170 -0.013852340 0.000000000
sum over m -0.030743934 -0.030743934 -0.061487868 0.000000000
sum over m+mul -0.030743934 -0.030743934 -0.061487868 0.000000000
1027 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000749053 1.000749053 2.001498106 0.000000000
sum over m 1.000749053 1.000749053 2.001498106 0.000000000
s 1 0.207411714 0.207411714 0.414823428 0.000000000
sum over m 0.207411714 0.207411714 0.414823428 0.000000000
s 2 0.014727165 0.014727165 0.029454329 0.000000000
sum over m 0.014727165 0.014727165 0.029454329 0.000000000
sum over m+mul 1.222887932 1.222887932 2.445775864 0.000000000
px 0 1.006375727 1.006375727 2.012751453 0.000000000
py 0 1.006375727 1.006375727 2.012751453 0.000000000
pz 0 1.006205238 1.006205238 2.012410475 0.000000000
sum over m 3.018956691 3.018956691 6.037913382 0.000000000
px 1 0.065436910 0.065436910 0.130873820 0.000000000
py 1 0.065436910 0.065436910 0.130873820 0.000000000
pz 1 0.040387885 0.040387885 0.080775771 0.000000000
sum over m 0.171261705 0.171261705 0.342523410 0.000000000
sum over m+mul 3.190218396 3.190218396 6.380436792 0.000000000
d3z^2-r^2 0 0.196313375 0.196313375 0.392626749 0.000000000
dx^2-y^2 0 0.201526534 0.201526534 0.403053068 0.000000000
dxy 0 0.250917796 0.250917796 0.501835592 0.000000000
dxz 0 0.268510427 0.268510427 0.537020853 0.000000000
dyz 0 0.268510427 0.268510427 0.537020853 0.000000000
sum over m 1.185778558 1.185778558 2.371557115 0.000000000
d3z^2-r^2 1 0.003481847 0.003481847 0.006963695 0.000000000
dx^2-y^2 1 -0.004471008 -0.004471008 -0.008942017 0.000000000
dxy 1 0.015341368 0.015341368 0.030682735 0.000000000
dxz 1 0.003497787 0.003497787 0.006995575 0.000000000
dyz 1 0.003497787 0.003497787 0.006995575 0.000000000
sum over m 0.021347782 0.021347782 0.042695563 0.000000000
sum over m+mul 1.207126339 1.207126339 2.414252679 0.000000000
1028 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000765816 1.000765816 2.001531633 0.000000000
sum over m 1.000765816 1.000765816 2.001531633 0.000000000
s 1 0.207397067 0.207397067 0.414794135 0.000000000
sum over m 0.207397067 0.207397067 0.414794135 0.000000000
s 2 0.014721938 0.014721938 0.029443876 0.000000000
sum over m 0.014721938 0.014721938 0.029443876 0.000000000
sum over m+mul 1.222884822 1.222884822 2.445769644 0.000000000
px 0 1.006392943 1.006392943 2.012785886 0.000000000
py 0 1.006392943 1.006392943 2.012785886 0.000000000
pz 0 1.006196065 1.006196065 2.012392130 0.000000000
sum over m 3.018981951 3.018981951 6.037963902 0.000000000
px 1 0.065418035 0.065418035 0.130836070 0.000000000
py 1 0.065418035 0.065418035 0.130836070 0.000000000
pz 1 0.040370673 0.040370673 0.080741346 0.000000000
sum over m 0.171206743 0.171206743 0.342413486 0.000000000
sum over m+mul 3.190188694 3.190188694 6.380377388 0.000000000
d3z^2-r^2 0 0.196290408 0.196290408 0.392580816 0.000000000
dx^2-y^2 0 0.201530687 0.201530687 0.403061374 0.000000000
dxy 0 0.250918139 0.250918139 0.501836278 0.000000000
dxz 0 0.268508312 0.268508312 0.537016624 0.000000000
dyz 0 0.268508312 0.268508312 0.537016624 0.000000000
sum over m 1.185755858 1.185755858 2.371511716 0.000000000
d3z^2-r^2 1 0.003471451 0.003471451 0.006942902 0.000000000
dx^2-y^2 1 -0.004478841 -0.004478841 -0.008957682 0.000000000
dxy 1 0.015342155 0.015342155 0.030684310 0.000000000
dxz 1 0.003484230 0.003484230 0.006968460 0.000000000
dyz 1 0.003484230 0.003484230 0.006968460 0.000000000
sum over m 0.021303225 0.021303225 0.042606450 0.000000000
sum over m+mul 1.207059083 1.207059083 2.414118166 0.000000000
1029 O Up spin Down spin Sum Diff
multiple
s 0 0.893910559 0.893910559 1.787821117 0.000000000
sum over m 0.893910559 0.893910559 1.787821117 0.000000000
s 1 -0.003042509 -0.003042509 -0.006085018 0.000000000
sum over m -0.003042509 -0.003042509 -0.006085018 0.000000000
sum over m+mul 0.890868050 0.890868050 1.781736099 0.000000000
px 0 0.787054531 0.787054531 1.574109063 0.000000000
py 0 0.787054531 0.787054531 1.574109063 0.000000000
pz 0 0.779680845 0.779680845 1.559361690 0.000000000
sum over m 2.353789908 2.353789908 4.707579816 0.000000000
px 1 -0.008732323 -0.008732323 -0.017464647 0.000000000
py 1 -0.008732323 -0.008732323 -0.017464647 0.000000000
pz 1 -0.006453591 -0.006453591 -0.012907182 0.000000000
sum over m -0.023918238 -0.023918238 -0.047836476 0.000000000
sum over m+mul 2.329871670 2.329871670 4.659743340 0.000000000
d3z^2-r^2 0 -0.006390173 -0.006390173 -0.012780345 0.000000000
dx^2-y^2 0 -0.005052379 -0.005052379 -0.010104759 0.000000000
dxy 0 -0.005435960 -0.005435960 -0.010871920 0.000000000
dxz 0 -0.006924392 -0.006924392 -0.013848784 0.000000000
dyz 0 -0.006924392 -0.006924392 -0.013848784 0.000000000
sum over m -0.030727296 -0.030727296 -0.061454592 0.000000000
sum over m+mul -0.030727296 -0.030727296 -0.061454592 0.000000000
1030 O Up spin Down spin Sum Diff
multiple
s 0 0.893853795 0.893853795 1.787707590 0.000000000
sum over m 0.893853795 0.893853795 1.787707590 0.000000000
s 1 -0.003041461 -0.003041461 -0.006082922 0.000000000
sum over m -0.003041461 -0.003041461 -0.006082922 0.000000000
sum over m+mul 0.890812334 0.890812334 1.781624668 0.000000000
px 0 0.786889313 0.786889313 1.573778626 0.000000000
py 0 0.786889313 0.786889313 1.573778626 0.000000000
pz 0 0.779892284 0.779892284 1.559784569 0.000000000
sum over m 2.353670910 2.353670910 4.707341821 0.000000000
px 1 -0.008728829 -0.008728829 -0.017457658 0.000000000
py 1 -0.008728829 -0.008728829 -0.017457657 0.000000000
pz 1 -0.006469050 -0.006469050 -0.012938100 0.000000000
sum over m -0.023926707 -0.023926707 -0.047853415 0.000000000
sum over m+mul 2.329744203 2.329744203 4.659488406 0.000000000
d3z^2-r^2 0 -0.006390369 -0.006390369 -0.012780738 0.000000000
dx^2-y^2 0 -0.005061187 -0.005061187 -0.010122375 0.000000000
dxy 0 -0.005433166 -0.005433166 -0.010866331 0.000000000
dxz 0 -0.006934307 -0.006934307 -0.013868614 0.000000000
dyz 0 -0.006934307 -0.006934307 -0.013868613 0.000000000
sum over m -0.030753335 -0.030753335 -0.061506671 0.000000000
sum over m+mul -0.030753335 -0.030753335 -0.061506671 0.000000000
1031 O Up spin Down spin Sum Diff
multiple
s 0 0.893906500 0.893906500 1.787813000 0.000000000
sum over m 0.893906500 0.893906500 1.787813000 0.000000000
s 1 -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m+mul 0.890864606 0.890864606 1.781729211 0.000000000
px 0 0.787154605 0.787154605 1.574309210 0.000000000
py 0 0.786831962 0.786831962 1.573663925 0.000000000
pz 0 0.779778688 0.779778688 1.559557376 0.000000000
sum over m 2.353765255 2.353765255 4.707530511 0.000000000
px 1 -0.008748713 -0.008748713 -0.017497425 0.000000000
py 1 -0.008735308 -0.008735308 -0.017470616 0.000000000
pz 1 -0.006462259 -0.006462259 -0.012924519 0.000000000
sum over m -0.023946280 -0.023946280 -0.047892560 0.000000000
sum over m+mul 2.329818975 2.329818975 4.659637950 0.000000000
d3z^2-r^2 0 -0.006391385 -0.006391385 -0.012782771 0.000000000
dx^2-y^2 0 -0.005058286 -0.005058286 -0.010116573 0.000000000
dxy 0 -0.005434881 -0.005434881 -0.010869762 0.000000000
dxz 0 -0.006926170 -0.006926170 -0.013852340 0.000000000
dyz 0 -0.006933211 -0.006933211 -0.013866422 0.000000000
sum over m -0.030743934 -0.030743934 -0.061487867 0.000000000
sum over m+mul -0.030743934 -0.030743934 -0.061487867 0.000000000
1032 O Up spin Down spin Sum Diff
multiple
s 0 0.893906500 0.893906500 1.787813000 0.000000000
sum over m 0.893906500 0.893906500 1.787813000 0.000000000
s 1 -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m+mul 0.890864606 0.890864606 1.781729211 0.000000000
px 0 0.786831962 0.786831962 1.573663924 0.000000000
py 0 0.787154605 0.787154605 1.574309210 0.000000000
pz 0 0.779778688 0.779778688 1.559557376 0.000000000
sum over m 2.353765255 2.353765255 4.707530510 0.000000000
px 1 -0.008735308 -0.008735308 -0.017470616 0.000000000
py 1 -0.008748713 -0.008748713 -0.017497425 0.000000000
pz 1 -0.006462260 -0.006462260 -0.012924519 0.000000000
sum over m -0.023946280 -0.023946280 -0.047892561 0.000000000
sum over m+mul 2.329818975 2.329818975 4.659637949 0.000000000
d3z^2-r^2 0 -0.006391385 -0.006391385 -0.012782771 0.000000000
dx^2-y^2 0 -0.005058286 -0.005058286 -0.010116573 0.000000000
dxy 0 -0.005434881 -0.005434881 -0.010869762 0.000000000
dxz 0 -0.006933211 -0.006933211 -0.013866422 0.000000000
dyz 0 -0.006926170 -0.006926170 -0.013852340 0.000000000
sum over m -0.030743934 -0.030743934 -0.061487868 0.000000000
sum over m+mul -0.030743934 -0.030743934 -0.061487868 0.000000000
1033 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000749053 1.000749053 2.001498106 0.000000000
sum over m 1.000749053 1.000749053 2.001498106 0.000000000
s 1 0.207411714 0.207411714 0.414823428 0.000000000
sum over m 0.207411714 0.207411714 0.414823428 0.000000000
s 2 0.014727165 0.014727165 0.029454329 0.000000000
sum over m 0.014727165 0.014727165 0.029454329 0.000000000
sum over m+mul 1.222887932 1.222887932 2.445775863 0.000000000
px 0 1.006375727 1.006375727 2.012751453 0.000000000
py 0 1.006375727 1.006375727 2.012751453 0.000000000
pz 0 1.006205238 1.006205238 2.012410475 0.000000000
sum over m 3.018956691 3.018956691 6.037913382 0.000000000
px 1 0.065436910 0.065436910 0.130873820 0.000000000
py 1 0.065436910 0.065436910 0.130873820 0.000000000
pz 1 0.040387885 0.040387885 0.080775770 0.000000000
sum over m 0.171261705 0.171261705 0.342523410 0.000000000
sum over m+mul 3.190218396 3.190218396 6.380436791 0.000000000
d3z^2-r^2 0 0.196313375 0.196313375 0.392626749 0.000000000
dx^2-y^2 0 0.201526534 0.201526534 0.403053068 0.000000000
dxy 0 0.250917796 0.250917796 0.501835591 0.000000000
dxz 0 0.268510427 0.268510427 0.537020853 0.000000000
dyz 0 0.268510426 0.268510426 0.537020853 0.000000000
sum over m 1.185778558 1.185778558 2.371557115 0.000000000
d3z^2-r^2 1 0.003481847 0.003481847 0.006963695 0.000000000
dx^2-y^2 1 -0.004471008 -0.004471008 -0.008942017 0.000000000
dxy 1 0.015341368 0.015341368 0.030682735 0.000000000
dxz 1 0.003497788 0.003497788 0.006995575 0.000000000
dyz 1 0.003497787 0.003497787 0.006995575 0.000000000
sum over m 0.021347782 0.021347782 0.042695563 0.000000000
sum over m+mul 1.207126339 1.207126339 2.414252678 0.000000000
1034 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000765816 1.000765816 2.001531632 0.000000000
sum over m 1.000765816 1.000765816 2.001531632 0.000000000
s 1 0.207397067 0.207397067 0.414794135 0.000000000
sum over m 0.207397067 0.207397067 0.414794135 0.000000000
s 2 0.014721938 0.014721938 0.029443876 0.000000000
sum over m 0.014721938 0.014721938 0.029443876 0.000000000
sum over m+mul 1.222884821 1.222884821 2.445769643 0.000000000
px 0 1.006392943 1.006392943 2.012785886 0.000000000
py 0 1.006392943 1.006392943 2.012785886 0.000000000
pz 0 1.006196065 1.006196065 2.012392130 0.000000000
sum over m 3.018981951 3.018981951 6.037963902 0.000000000
px 1 0.065418035 0.065418035 0.130836070 0.000000000
py 1 0.065418035 0.065418035 0.130836070 0.000000000
pz 1 0.040370672 0.040370672 0.080741344 0.000000000
sum over m 0.171206742 0.171206742 0.342413485 0.000000000
sum over m+mul 3.190188694 3.190188694 6.380377387 0.000000000
d3z^2-r^2 0 0.196290408 0.196290408 0.392580816 0.000000000
dx^2-y^2 0 0.201530687 0.201530687 0.403061374 0.000000000
dxy 0 0.250918139 0.250918139 0.501836278 0.000000000
dxz 0 0.268508312 0.268508312 0.537016624 0.000000000
dyz 0 0.268508312 0.268508312 0.537016624 0.000000000
sum over m 1.185755858 1.185755858 2.371511717 0.000000000
d3z^2-r^2 1 0.003471451 0.003471451 0.006942902 0.000000000
dx^2-y^2 1 -0.004478841 -0.004478841 -0.008957681 0.000000000
dxy 1 0.015342155 0.015342155 0.030684310 0.000000000
dxz 1 0.003484230 0.003484230 0.006968460 0.000000000
dyz 1 0.003484230 0.003484230 0.006968460 0.000000000
sum over m 0.021303225 0.021303225 0.042606450 0.000000000
sum over m+mul 1.207059083 1.207059083 2.414118167 0.000000000
1035 O Up spin Down spin Sum Diff
multiple
s 0 0.893910559 0.893910559 1.787821117 0.000000000
sum over m 0.893910559 0.893910559 1.787821117 0.000000000
s 1 -0.003042509 -0.003042509 -0.006085018 0.000000000
sum over m -0.003042509 -0.003042509 -0.006085018 0.000000000
sum over m+mul 0.890868050 0.890868050 1.781736099 0.000000000
px 0 0.787054532 0.787054532 1.574109063 0.000000000
py 0 0.787054531 0.787054531 1.574109063 0.000000000
pz 0 0.779680845 0.779680845 1.559361690 0.000000000
sum over m 2.353789908 2.353789908 4.707579816 0.000000000
px 1 -0.008732323 -0.008732323 -0.017464647 0.000000000
py 1 -0.008732323 -0.008732323 -0.017464647 0.000000000
pz 1 -0.006453591 -0.006453591 -0.012907182 0.000000000
sum over m -0.023918238 -0.023918238 -0.047836476 0.000000000
sum over m+mul 2.329871670 2.329871670 4.659743340 0.000000000
d3z^2-r^2 0 -0.006390173 -0.006390173 -0.012780345 0.000000000
dx^2-y^2 0 -0.005052379 -0.005052379 -0.010104759 0.000000000
dxy 0 -0.005435960 -0.005435960 -0.010871920 0.000000000
dxz 0 -0.006924392 -0.006924392 -0.013848784 0.000000000
dyz 0 -0.006924392 -0.006924392 -0.013848784 0.000000000
sum over m -0.030727296 -0.030727296 -0.061454592 0.000000000
sum over m+mul -0.030727296 -0.030727296 -0.061454592 0.000000000
1036 O Up spin Down spin Sum Diff
multiple
s 0 0.893853795 0.893853795 1.787707590 0.000000000
sum over m 0.893853795 0.893853795 1.787707590 0.000000000
s 1 -0.003041461 -0.003041461 -0.006082923 0.000000000
sum over m -0.003041461 -0.003041461 -0.006082923 0.000000000
sum over m+mul 0.890812334 0.890812334 1.781624668 0.000000000
px 0 0.786889313 0.786889313 1.573778625 0.000000000
py 0 0.786889313 0.786889313 1.573778625 0.000000000
pz 0 0.779892285 0.779892285 1.559784569 0.000000000
sum over m 2.353670910 2.353670910 4.707341819 0.000000000
px 1 -0.008728829 -0.008728829 -0.017457658 0.000000000
py 1 -0.008728829 -0.008728829 -0.017457657 0.000000000
pz 1 -0.006469050 -0.006469050 -0.012938100 0.000000000
sum over m -0.023926707 -0.023926707 -0.047853415 0.000000000
sum over m+mul 2.329744202 2.329744202 4.659488404 0.000000000
d3z^2-r^2 0 -0.006390369 -0.006390369 -0.012780738 0.000000000
dx^2-y^2 0 -0.005061187 -0.005061187 -0.010122375 0.000000000
dxy 0 -0.005433166 -0.005433166 -0.010866331 0.000000000
dxz 0 -0.006934307 -0.006934307 -0.013868614 0.000000000
dyz 0 -0.006934307 -0.006934307 -0.013868613 0.000000000
sum over m -0.030753335 -0.030753335 -0.061506671 0.000000000
sum over m+mul -0.030753335 -0.030753335 -0.061506671 0.000000000
1037 O Up spin Down spin Sum Diff
multiple
s 0 0.893906500 0.893906500 1.787813000 0.000000000
sum over m 0.893906500 0.893906500 1.787813000 0.000000000
s 1 -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m+mul 0.890864606 0.890864606 1.781729211 0.000000000
px 0 0.787154605 0.787154605 1.574309210 0.000000000
py 0 0.786831962 0.786831962 1.573663925 0.000000000
pz 0 0.779778688 0.779778688 1.559557376 0.000000000
sum over m 2.353765255 2.353765255 4.707530511 0.000000000
px 1 -0.008748713 -0.008748713 -0.017497425 0.000000000
py 1 -0.008735308 -0.008735308 -0.017470616 0.000000000
pz 1 -0.006462259 -0.006462259 -0.012924519 0.000000000
sum over m -0.023946280 -0.023946280 -0.047892560 0.000000000
sum over m+mul 2.329818975 2.329818975 4.659637951 0.000000000
d3z^2-r^2 0 -0.006391385 -0.006391385 -0.012782771 0.000000000
dx^2-y^2 0 -0.005058286 -0.005058286 -0.010116573 0.000000000
dxy 0 -0.005434881 -0.005434881 -0.010869762 0.000000000
dxz 0 -0.006926170 -0.006926170 -0.013852340 0.000000000
dyz 0 -0.006933211 -0.006933211 -0.013866422 0.000000000
sum over m -0.030743934 -0.030743934 -0.061487867 0.000000000
sum over m+mul -0.030743934 -0.030743934 -0.061487867 0.000000000
1038 O Up spin Down spin Sum Diff
multiple
s 0 0.893906500 0.893906500 1.787813000 0.000000000
sum over m 0.893906500 0.893906500 1.787813000 0.000000000
s 1 -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m+mul 0.890864606 0.890864606 1.781729211 0.000000000
px 0 0.786831962 0.786831962 1.573663924 0.000000000
py 0 0.787154605 0.787154605 1.574309210 0.000000000
pz 0 0.779778688 0.779778688 1.559557376 0.000000000
sum over m 2.353765255 2.353765255 4.707530510 0.000000000
px 1 -0.008735308 -0.008735308 -0.017470616 0.000000000
py 1 -0.008748713 -0.008748713 -0.017497425 0.000000000
pz 1 -0.006462260 -0.006462260 -0.012924519 0.000000000
sum over m -0.023946280 -0.023946280 -0.047892561 0.000000000
sum over m+mul 2.329818975 2.329818975 4.659637950 0.000000000
d3z^2-r^2 0 -0.006391385 -0.006391385 -0.012782771 0.000000000
dx^2-y^2 0 -0.005058286 -0.005058286 -0.010116573 0.000000000
dxy 0 -0.005434881 -0.005434881 -0.010869762 0.000000000
dxz 0 -0.006933211 -0.006933211 -0.013866422 0.000000000
dyz 0 -0.006926170 -0.006926170 -0.013852340 0.000000000
sum over m -0.030743934 -0.030743934 -0.061487868 0.000000000
sum over m+mul -0.030743934 -0.030743934 -0.061487868 0.000000000
1039 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000749053 1.000749053 2.001498106 0.000000000
sum over m 1.000749053 1.000749053 2.001498106 0.000000000
s 1 0.207411714 0.207411714 0.414823428 0.000000000
sum over m 0.207411714 0.207411714 0.414823428 0.000000000
s 2 0.014727165 0.014727165 0.029454329 0.000000000
sum over m 0.014727165 0.014727165 0.029454329 0.000000000
sum over m+mul 1.222887932 1.222887932 2.445775863 0.000000000
px 0 1.006375727 1.006375727 2.012751454 0.000000000
py 0 1.006375727 1.006375727 2.012751453 0.000000000
pz 0 1.006205238 1.006205238 2.012410475 0.000000000
sum over m 3.018956691 3.018956691 6.037913382 0.000000000
px 1 0.065436910 0.065436910 0.130873819 0.000000000
py 1 0.065436910 0.065436910 0.130873820 0.000000000
pz 1 0.040387885 0.040387885 0.080775771 0.000000000
sum over m 0.171261705 0.171261705 0.342523410 0.000000000
sum over m+mul 3.190218396 3.190218396 6.380436792 0.000000000
d3z^2-r^2 0 0.196313375 0.196313375 0.392626749 0.000000000
dx^2-y^2 0 0.201526534 0.201526534 0.403053068 0.000000000
dxy 0 0.250917796 0.250917796 0.501835591 0.000000000
dxz 0 0.268510427 0.268510427 0.537020853 0.000000000
dyz 0 0.268510427 0.268510427 0.537020854 0.000000000
sum over m 1.185778558 1.185778558 2.371557116 0.000000000
d3z^2-r^2 1 0.003481847 0.003481847 0.006963695 0.000000000
dx^2-y^2 1 -0.004471008 -0.004471008 -0.008942017 0.000000000
dxy 1 0.015341368 0.015341368 0.030682735 0.000000000
dxz 1 0.003497787 0.003497787 0.006995575 0.000000000
dyz 1 0.003497787 0.003497787 0.006995575 0.000000000
sum over m 0.021347782 0.021347782 0.042695563 0.000000000
sum over m+mul 1.207126340 1.207126340 2.414252679 0.000000000
1040 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000765816 1.000765816 2.001531632 0.000000000
sum over m 1.000765816 1.000765816 2.001531632 0.000000000
s 1 0.207397067 0.207397067 0.414794135 0.000000000
sum over m 0.207397067 0.207397067 0.414794135 0.000000000
s 2 0.014721938 0.014721938 0.029443876 0.000000000
sum over m 0.014721938 0.014721938 0.029443876 0.000000000
sum over m+mul 1.222884821 1.222884821 2.445769643 0.000000000
px 0 1.006392943 1.006392943 2.012785886 0.000000000
py 0 1.006392943 1.006392943 2.012785886 0.000000000
pz 0 1.006196065 1.006196065 2.012392130 0.000000000
sum over m 3.018981951 3.018981951 6.037963902 0.000000000
px 1 0.065418035 0.065418035 0.130836070 0.000000000
py 1 0.065418035 0.065418035 0.130836070 0.000000000
pz 1 0.040370672 0.040370672 0.080741344 0.000000000
sum over m 0.171206743 0.171206743 0.342413485 0.000000000
sum over m+mul 3.190188694 3.190188694 6.380377387 0.000000000
d3z^2-r^2 0 0.196290408 0.196290408 0.392580816 0.000000000
dx^2-y^2 0 0.201530687 0.201530687 0.403061374 0.000000000
dxy 0 0.250918139 0.250918139 0.501836278 0.000000000
dxz 0 0.268508312 0.268508312 0.537016624 0.000000000
dyz 0 0.268508312 0.268508312 0.537016624 0.000000000
sum over m 1.185755858 1.185755858 2.371511716 0.000000000
d3z^2-r^2 1 0.003471451 0.003471451 0.006942902 0.000000000
dx^2-y^2 1 -0.004478841 -0.004478841 -0.008957681 0.000000000
dxy 1 0.015342155 0.015342155 0.030684310 0.000000000
dxz 1 0.003484230 0.003484230 0.006968460 0.000000000
dyz 1 0.003484230 0.003484230 0.006968460 0.000000000
sum over m 0.021303225 0.021303225 0.042606450 0.000000000
sum over m+mul 1.207059083 1.207059083 2.414118166 0.000000000
1041 O Up spin Down spin Sum Diff
multiple
s 0 0.893910559 0.893910559 1.787821117 0.000000000
sum over m 0.893910559 0.893910559 1.787821117 0.000000000
s 1 -0.003042509 -0.003042509 -0.006085018 0.000000000
sum over m -0.003042509 -0.003042509 -0.006085018 0.000000000
sum over m+mul 0.890868050 0.890868050 1.781736099 0.000000000
px 0 0.787054532 0.787054532 1.574109063 0.000000000
py 0 0.787054532 0.787054532 1.574109063 0.000000000
pz 0 0.779680845 0.779680845 1.559361690 0.000000000
sum over m 2.353789908 2.353789908 4.707579817 0.000000000
px 1 -0.008732323 -0.008732323 -0.017464647 0.000000000
py 1 -0.008732323 -0.008732323 -0.017464647 0.000000000
pz 1 -0.006453591 -0.006453591 -0.012907182 0.000000000
sum over m -0.023918238 -0.023918238 -0.047836476 0.000000000
sum over m+mul 2.329871670 2.329871670 4.659743341 0.000000000
d3z^2-r^2 0 -0.006390173 -0.006390173 -0.012780345 0.000000000
dx^2-y^2 0 -0.005052379 -0.005052379 -0.010104759 0.000000000
dxy 0 -0.005435960 -0.005435960 -0.010871920 0.000000000
dxz 0 -0.006924392 -0.006924392 -0.013848784 0.000000000
dyz 0 -0.006924392 -0.006924392 -0.013848784 0.000000000
sum over m -0.030727296 -0.030727296 -0.061454592 0.000000000
sum over m+mul -0.030727296 -0.030727296 -0.061454592 0.000000000
1042 O Up spin Down spin Sum Diff
multiple
s 0 0.893853795 0.893853795 1.787707590 0.000000000
sum over m 0.893853795 0.893853795 1.787707590 0.000000000
s 1 -0.003041461 -0.003041461 -0.006082923 0.000000000
sum over m -0.003041461 -0.003041461 -0.006082923 0.000000000
sum over m+mul 0.890812334 0.890812334 1.781624668 0.000000000
px 0 0.786889313 0.786889313 1.573778625 0.000000000
py 0 0.786889313 0.786889313 1.573778625 0.000000000
pz 0 0.779892284 0.779892284 1.559784569 0.000000000
sum over m 2.353670910 2.353670910 4.707341820 0.000000000
px 1 -0.008728829 -0.008728829 -0.017457658 0.000000000
py 1 -0.008728829 -0.008728829 -0.017457657 0.000000000
pz 1 -0.006469050 -0.006469050 -0.012938100 0.000000000
sum over m -0.023926707 -0.023926707 -0.047853415 0.000000000
sum over m+mul 2.329744202 2.329744202 4.659488405 0.000000000
d3z^2-r^2 0 -0.006390369 -0.006390369 -0.012780738 0.000000000
dx^2-y^2 0 -0.005061187 -0.005061187 -0.010122375 0.000000000
dxy 0 -0.005433166 -0.005433166 -0.010866331 0.000000000
dxz 0 -0.006934307 -0.006934307 -0.013868614 0.000000000
dyz 0 -0.006934307 -0.006934307 -0.013868613 0.000000000
sum over m -0.030753335 -0.030753335 -0.061506671 0.000000000
sum over m+mul -0.030753335 -0.030753335 -0.061506671 0.000000000
1043 O Up spin Down spin Sum Diff
multiple
s 0 0.893906500 0.893906500 1.787813000 0.000000000
sum over m 0.893906500 0.893906500 1.787813000 0.000000000
s 1 -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m+mul 0.890864606 0.890864606 1.781729211 0.000000000
px 0 0.787154605 0.787154605 1.574309210 0.000000000
py 0 0.786831962 0.786831962 1.573663925 0.000000000
pz 0 0.779778688 0.779778688 1.559557376 0.000000000
sum over m 2.353765255 2.353765255 4.707530511 0.000000000
px 1 -0.008748713 -0.008748713 -0.017497425 0.000000000
py 1 -0.008735308 -0.008735308 -0.017470616 0.000000000
pz 1 -0.006462259 -0.006462259 -0.012924519 0.000000000
sum over m -0.023946280 -0.023946280 -0.047892560 0.000000000
sum over m+mul 2.329818975 2.329818975 4.659637951 0.000000000
d3z^2-r^2 0 -0.006391385 -0.006391385 -0.012782771 0.000000000
dx^2-y^2 0 -0.005058286 -0.005058286 -0.010116573 0.000000000
dxy 0 -0.005434881 -0.005434881 -0.010869762 0.000000000
dxz 0 -0.006926170 -0.006926170 -0.013852340 0.000000000
dyz 0 -0.006933211 -0.006933211 -0.013866422 0.000000000
sum over m -0.030743934 -0.030743934 -0.061487867 0.000000000
sum over m+mul -0.030743934 -0.030743934 -0.061487867 0.000000000
1044 O Up spin Down spin Sum Diff
multiple
s 0 0.893906500 0.893906500 1.787813000 0.000000000
sum over m 0.893906500 0.893906500 1.787813000 0.000000000
s 1 -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m+mul 0.890864606 0.890864606 1.781729211 0.000000000
px 0 0.786831963 0.786831963 1.573663925 0.000000000
py 0 0.787154605 0.787154605 1.574309210 0.000000000
pz 0 0.779778688 0.779778688 1.559557376 0.000000000
sum over m 2.353765255 2.353765255 4.707530511 0.000000000
px 1 -0.008735308 -0.008735308 -0.017470616 0.000000000
py 1 -0.008748713 -0.008748713 -0.017497425 0.000000000
pz 1 -0.006462260 -0.006462260 -0.012924519 0.000000000
sum over m -0.023946280 -0.023946280 -0.047892561 0.000000000
sum over m+mul 2.329818975 2.329818975 4.659637950 0.000000000
d3z^2-r^2 0 -0.006391385 -0.006391385 -0.012782771 0.000000000
dx^2-y^2 0 -0.005058286 -0.005058286 -0.010116573 0.000000000
dxy 0 -0.005434881 -0.005434881 -0.010869762 0.000000000
dxz 0 -0.006933211 -0.006933211 -0.013866422 0.000000000
dyz 0 -0.006926170 -0.006926170 -0.013852340 0.000000000
sum over m -0.030743934 -0.030743934 -0.061487868 0.000000000
sum over m+mul -0.030743934 -0.030743934 -0.061487868 0.000000000
1045 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000749053 1.000749053 2.001498107 0.000000000
sum over m 1.000749053 1.000749053 2.001498107 0.000000000
s 1 0.207411714 0.207411714 0.414823428 0.000000000
sum over m 0.207411714 0.207411714 0.414823428 0.000000000
s 2 0.014727165 0.014727165 0.029454329 0.000000000
sum over m 0.014727165 0.014727165 0.029454329 0.000000000
sum over m+mul 1.222887932 1.222887932 2.445775864 0.000000000
px 0 1.006375727 1.006375727 2.012751453 0.000000000
py 0 1.006375727 1.006375727 2.012751453 0.000000000
pz 0 1.006205238 1.006205238 2.012410476 0.000000000
sum over m 3.018956691 3.018956691 6.037913382 0.000000000
px 1 0.065436910 0.065436910 0.130873820 0.000000000
py 1 0.065436910 0.065436910 0.130873820 0.000000000
pz 1 0.040387885 0.040387885 0.080775770 0.000000000
sum over m 0.171261705 0.171261705 0.342523409 0.000000000
sum over m+mul 3.190218396 3.190218396 6.380436792 0.000000000
d3z^2-r^2 0 0.196313375 0.196313375 0.392626749 0.000000000
dx^2-y^2 0 0.201526534 0.201526534 0.403053069 0.000000000
dxy 0 0.250917796 0.250917796 0.501835592 0.000000000
dxz 0 0.268510426 0.268510426 0.537020853 0.000000000
dyz 0 0.268510427 0.268510427 0.537020853 0.000000000
sum over m 1.185778558 1.185778558 2.371557116 0.000000000
d3z^2-r^2 1 0.003481847 0.003481847 0.006963695 0.000000000
dx^2-y^2 1 -0.004471008 -0.004471008 -0.008942017 0.000000000
dxy 1 0.015341368 0.015341368 0.030682735 0.000000000
dxz 1 0.003497787 0.003497787 0.006995575 0.000000000
dyz 1 0.003497787 0.003497787 0.006995575 0.000000000
sum over m 0.021347782 0.021347782 0.042695563 0.000000000
sum over m+mul 1.207126340 1.207126340 2.414252679 0.000000000
1046 Ti Up spin Down spin Sum Diff
multiple
s 0 1.000765816 1.000765816 2.001531632 0.000000000
sum over m 1.000765816 1.000765816 2.001531632 0.000000000
s 1 0.207397067 0.207397067 0.414794134 0.000000000
sum over m 0.207397067 0.207397067 0.414794134 0.000000000
s 2 0.014721938 0.014721938 0.029443876 0.000000000
sum over m 0.014721938 0.014721938 0.029443876 0.000000000
sum over m+mul 1.222884821 1.222884821 2.445769643 0.000000000
px 0 1.006392943 1.006392943 2.012785886 0.000000000
py 0 1.006392943 1.006392943 2.012785886 0.000000000
pz 0 1.006196065 1.006196065 2.012392130 0.000000000
sum over m 3.018981951 3.018981951 6.037963903 0.000000000
px 1 0.065418035 0.065418035 0.130836070 0.000000000
py 1 0.065418035 0.065418035 0.130836070 0.000000000
pz 1 0.040370672 0.040370672 0.080741345 0.000000000
sum over m 0.171206743 0.171206743 0.342413485 0.000000000
sum over m+mul 3.190188694 3.190188694 6.380377388 0.000000000
d3z^2-r^2 0 0.196290408 0.196290408 0.392580816 0.000000000
dx^2-y^2 0 0.201530687 0.201530687 0.403061374 0.000000000
dxy 0 0.250918139 0.250918139 0.501836278 0.000000000
dxz 0 0.268508312 0.268508312 0.537016624 0.000000000
dyz 0 0.268508312 0.268508312 0.537016624 0.000000000
sum over m 1.185755858 1.185755858 2.371511715 0.000000000
d3z^2-r^2 1 0.003471451 0.003471451 0.006942902 0.000000000
dx^2-y^2 1 -0.004478841 -0.004478841 -0.008957682 0.000000000
dxy 1 0.015342155 0.015342155 0.030684310 0.000000000
dxz 1 0.003484230 0.003484230 0.006968460 0.000000000
dyz 1 0.003484230 0.003484230 0.006968460 0.000000000
sum over m 0.021303225 0.021303225 0.042606450 0.000000000
sum over m+mul 1.207059083 1.207059083 2.414118166 0.000000000
1047 O Up spin Down spin Sum Diff
multiple
s 0 0.893910559 0.893910559 1.787821118 0.000000000
sum over m 0.893910559 0.893910559 1.787821118 0.000000000
s 1 -0.003042509 -0.003042509 -0.006085018 0.000000000
sum over m -0.003042509 -0.003042509 -0.006085018 0.000000000
sum over m+mul 0.890868050 0.890868050 1.781736099 0.000000000
px 0 0.787054531 0.787054531 1.574109063 0.000000000
py 0 0.787054532 0.787054532 1.574109063 0.000000000
pz 0 0.779680845 0.779680845 1.559361690 0.000000000
sum over m 2.353789908 2.353789908 4.707579816 0.000000000
px 1 -0.008732323 -0.008732323 -0.017464647 0.000000000
py 1 -0.008732323 -0.008732323 -0.017464647 0.000000000
pz 1 -0.006453591 -0.006453591 -0.012907182 0.000000000
sum over m -0.023918238 -0.023918238 -0.047836476 0.000000000
sum over m+mul 2.329871670 2.329871670 4.659743340 0.000000000
d3z^2-r^2 0 -0.006390173 -0.006390173 -0.012780345 0.000000000
dx^2-y^2 0 -0.005052379 -0.005052379 -0.010104759 0.000000000
dxy 0 -0.005435960 -0.005435960 -0.010871920 0.000000000
dxz 0 -0.006924392 -0.006924392 -0.013848784 0.000000000
dyz 0 -0.006924392 -0.006924392 -0.013848784 0.000000000
sum over m -0.030727296 -0.030727296 -0.061454592 0.000000000
sum over m+mul -0.030727296 -0.030727296 -0.061454592 0.000000000
1048 O Up spin Down spin Sum Diff
multiple
s 0 0.893853795 0.893853795 1.787707590 0.000000000
sum over m 0.893853795 0.893853795 1.787707590 0.000000000
s 1 -0.003041461 -0.003041461 -0.006082922 0.000000000
sum over m -0.003041461 -0.003041461 -0.006082922 0.000000000
sum over m+mul 0.890812334 0.890812334 1.781624668 0.000000000
px 0 0.786889313 0.786889313 1.573778626 0.000000000
py 0 0.786889313 0.786889313 1.573778625 0.000000000
pz 0 0.779892284 0.779892284 1.559784569 0.000000000
sum over m 2.353670910 2.353670910 4.707341820 0.000000000
px 1 -0.008728829 -0.008728829 -0.017457658 0.000000000
py 1 -0.008728829 -0.008728829 -0.017457657 0.000000000
pz 1 -0.006469050 -0.006469050 -0.012938100 0.000000000
sum over m -0.023926707 -0.023926707 -0.047853415 0.000000000
sum over m+mul 2.329744202 2.329744202 4.659488405 0.000000000
d3z^2-r^2 0 -0.006390369 -0.006390369 -0.012780738 0.000000000
dx^2-y^2 0 -0.005061187 -0.005061187 -0.010122375 0.000000000
dxy 0 -0.005433166 -0.005433166 -0.010866331 0.000000000
dxz 0 -0.006934307 -0.006934307 -0.013868614 0.000000000
dyz 0 -0.006934307 -0.006934307 -0.013868613 0.000000000
sum over m -0.030753335 -0.030753335 -0.061506671 0.000000000
sum over m+mul -0.030753335 -0.030753335 -0.061506671 0.000000000
1049 O Up spin Down spin Sum Diff
multiple
s 0 0.893906500 0.893906500 1.787813000 0.000000000
sum over m 0.893906500 0.893906500 1.787813000 0.000000000
s 1 -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m+mul 0.890864606 0.890864606 1.781729211 0.000000000
px 0 0.787154605 0.787154605 1.574309210 0.000000000
py 0 0.786831962 0.786831962 1.573663924 0.000000000
pz 0 0.779778688 0.779778688 1.559557376 0.000000000
sum over m 2.353765256 2.353765256 4.707530511 0.000000000
px 1 -0.008748713 -0.008748713 -0.017497425 0.000000000
py 1 -0.008735308 -0.008735308 -0.017470616 0.000000000
pz 1 -0.006462259 -0.006462259 -0.012924519 0.000000000
sum over m -0.023946280 -0.023946280 -0.047892560 0.000000000
sum over m+mul 2.329818975 2.329818975 4.659637951 0.000000000
d3z^2-r^2 0 -0.006391385 -0.006391385 -0.012782771 0.000000000
dx^2-y^2 0 -0.005058286 -0.005058286 -0.010116573 0.000000000
dxy 0 -0.005434881 -0.005434881 -0.010869762 0.000000000
dxz 0 -0.006926170 -0.006926170 -0.013852340 0.000000000
dyz 0 -0.006933211 -0.006933211 -0.013866422 0.000000000
sum over m -0.030743934 -0.030743934 -0.061487867 0.000000000
sum over m+mul -0.030743934 -0.030743934 -0.061487867 0.000000000
1050 O Up spin Down spin Sum Diff
multiple
s 0 0.893906500 0.893906500 1.787813000 0.000000000
sum over m 0.893906500 0.893906500 1.787813000 0.000000000
s 1 -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m -0.003041894 -0.003041894 -0.006083788 0.000000000
sum over m+mul 0.890864606 0.890864606 1.781729211 0.000000000
px 0 0.786831962 0.786831962 1.573663925 0.000000000
py 0 0.787154605 0.787154605 1.574309210 0.000000000
pz 0 0.779778688 0.779778688 1.559557376 0.000000000
sum over m 2.353765255 2.353765255 4.707530511 0.000000000
px 1 -0.008735308 -0.008735308 -0.017470616 0.000000000
py 1 -0.008748713 -0.008748713 -0.017497425 0.000000000
pz 1 -0.006462260 -0.006462260 -0.012924519 0.000000000
sum over m -0.023946280 -0.023946280 -0.047892561 0.000000000
sum over m+mul 2.329818975 2.329818975 4.659637950 0.000000000
d3z^2-r^2 0 -0.006391385 -0.006391385 -0.012782771 0.000000000
dx^2-y^2 0 -0.005058286 -0.005058286 -0.010116573 0.000000000
dxy 0 -0.005434881 -0.005434881 -0.010869762 0.000000000
dxz 0 -0.006933211 -0.006933211 -0.013866422 0.000000000
dyz 0 -0.006926170 -0.006926170 -0.013852340 0.000000000
sum over m -0.030743934 -0.030743934 -0.061487868 0.000000000
sum over m+mul -0.030743934 -0.030743934 -0.061487868 0.000000000
***********************************************************
***********************************************************
Dipole moment (Debye)
***********************************************************
***********************************************************
Absolute D 9144.57663257
Dx Dy Dz
Total -6466.19214531 -6466.19214537 -0.26100019
Core 440224.92644069 440224.92644069 387993.29467176
Electron -446691.11858600 -446691.11858605 -387993.55567195
Back ground -0.00000000 -0.00000000 -0.00000000
***********************************************************
***********************************************************
xyz-coordinates (Ang) and forces (Hartree/Bohr)
***********************************************************
***********************************************************
<coordinates.forces
1050
1 Ti 0.00000 0.00000 0.00000 -0.000040099908 -0.000040099599 -0.000000000063
2 Ti 2.29705 2.29705 1.47945 -0.000059715755 -0.000059715293 0.000000000041
3 O 1.42417 1.42417 0.00000 -0.013945078101 -0.013945078292 -0.000000000032
4 O 3.16993 3.16993 0.00000 0.013683084273 0.013683084208 -0.000000000041
5 O 3.72122 0.87288 1.47945 -0.013782353353 0.013770085172 0.000000000024
6 O 0.87288 3.72122 1.47945 0.013770085420 -0.013782353633 0.000000000109
7 Ti 0.00000 0.00000 2.95890 -0.000040100007 -0.000040099751 -0.000000000001
8 Ti 2.29705 2.29705 4.43835 -0.000059715794 -0.000059715433 -0.000000000093
9 O 1.42417 1.42417 2.95890 -0.013945078153 -0.013945078257 0.000000000041
10 O 3.16993 3.16993 2.95890 0.013683084318 0.013683084147 -0.000000000048
11 O 3.72122 0.87288 4.43835 -0.013782353285 0.013770085142 0.000000000002
12 O 0.87288 3.72122 4.43835 0.013770085377 -0.013782353505 -0.000000000073
13 Ti 0.00000 0.00000 5.91780 -0.000040099895 -0.000040099674 0.000000000207
14 Ti 2.29705 2.29705 7.39725 -0.000059715555 -0.000059715531 -0.000000000049
15 O 1.42417 1.42417 5.91780 -0.013945078157 -0.013945078247 -0.000000000082
16 O 3.16993 3.16993 5.91780 0.013683084216 0.013683084125 -0.000000000080
17 O 3.72122 0.87288 7.39725 -0.013782353345 0.013770085358 -0.000000000083
18 O 0.87288 3.72122 7.39725 0.013770085264 -0.013782353379 -0.000000000006
19 Ti 0.00000 0.00000 8.87670 -0.000040099910 -0.000040099755 -0.000000000015
20 Ti 2.29705 2.29705 10.35615 -0.000059715712 -0.000059715233 -0.000000000009
21 O 1.42417 1.42417 8.87670 -0.013945078180 -0.013945078179 -0.000000000021
22 O 3.16993 3.16993 8.87670 0.013683084273 0.013683084239 0.000000000090
23 O 3.72122 0.87288 10.35615 -0.013782353292 0.013770085164 0.000000000008
24 O 0.87288 3.72122 10.35615 0.013770085459 -0.013782353637 0.000000000022
25 Ti 0.00000 0.00000 11.83560 -0.000040099948 -0.000040099638 -0.000000000011
26 Ti 2.29705 2.29705 13.31505 -0.000059715755 -0.000059715546 0.000000000150
27 O 1.42417 1.42417 11.83560 -0.013945078155 -0.013945078236 -0.000000000005
28 O 3.16993 3.16993 11.83560 0.013683084246 0.013683084160 -0.000000000046
29 O 3.72122 0.87288 13.31505 -0.013782353423 0.013770085314 0.000000000094
30 O 0.87288 3.72122 13.31505 0.013770085497 -0.013782353531 -0.000000000028
31 Ti 0.00000 0.00000 14.79450 -0.000040099862 -0.000040099631 0.000000000017
32 Ti 2.29705 2.29705 16.27395 -0.000059715675 -0.000059715322 0.000000000040
33 O 1.42417 1.42417 14.79450 -0.013945078259 -0.013945078353 0.000000000017
34 O 3.16993 3.16993 14.79450 0.013683084236 0.013683084208 -0.000000000001
35 O 3.72122 0.87288 16.27395 -0.013782353370 0.013770085178 -0.000000000014
36 O 0.87288 3.72122 16.27395 0.013770085463 -0.013782353668 0.000000000090
37 Ti 0.00000 0.00000 17.75340 -0.000040099901 -0.000040099791 0.000000000048
38 Ti 2.29705 2.29705 19.23285 -0.000059715736 -0.000059715381 0.000000000041
39 O 1.42417 1.42417 17.75340 -0.013945078190 -0.013945078177 -0.000000000120
40 O 3.16993 3.16993 17.75340 0.013683084260 0.013683084179 0.000000000046
41 O 3.72122 0.87288 19.23285 -0.013782353369 0.013770085177 0.000000000052
42 O 0.87288 3.72122 19.23285 0.013770085357 -0.013782353550 -0.000000000057
43 Ti 0.00000 4.59410 0.00000 -0.000062985891 0.000043100528 -0.000000000042
44 Ti 2.29705 6.89115 1.47945 0.000111793007 0.000029210495 0.000000000098
45 O 1.42417 6.01827 0.00000 -0.014095263029 -0.013695498747 -0.000000000027
46 O 3.16993 7.76403 0.00000 0.013530034909 0.014554135710 -0.000000000068
47 O 3.72122 5.46698 1.47945 -0.013597141915 0.014047907338 0.000000000040
48 O 0.87288 8.31532 1.47945 0.013924833934 -0.014244782180 -0.000000000134
49 Ti 0.00000 4.59410 2.95890 -0.000062985867 0.000043100545 0.000000000016
50 Ti 2.29705 6.89115 4.43835 0.000111793094 0.000029210618 -0.000000000123
51 O 1.42417 6.01827 2.95890 -0.014095262831 -0.013695498619 -0.000000000082
52 O 3.16993 7.76403 2.95890 0.013530034961 0.014554135783 0.000000000026
53 O 3.72122 5.46698 4.43835 -0.013597141926 0.014047907358 0.000000000033
54 O 0.87288 8.31532 4.43835 0.013924833972 -0.014244782233 0.000000000100
55 Ti 0.00000 4.59410 5.91780 -0.000062985922 0.000043100433 0.000000000125
56 Ti 2.29705 6.89115 7.39725 0.000111792849 0.000029210566 -0.000000000112
57 O 1.42417 6.01827 5.91780 -0.014095262875 -0.013695498733 0.000000000051
58 O 3.16993 7.76403 5.91780 0.013530034746 0.014554135649 0.000000000097
59 O 3.72122 5.46698 7.39725 -0.013597141889 0.014047907319 0.000000000039
60 O 0.87288 8.31532 7.39725 0.013924833942 -0.014244782206 -0.000000000070
61 Ti 0.00000 4.59410 8.87670 -0.000062985981 0.000043100199 -0.000000000035
62 Ti 2.29705 6.89115 10.35615 0.000111793280 0.000029210668 0.000000000073
63 O 1.42417 6.01827 8.87670 -0.014095262800 -0.013695498600 0.000000000004
64 O 3.16993 7.76403 8.87670 0.013530034864 0.014554135616 -0.000000000001
65 O 3.72122 5.46698 10.35615 -0.013597141966 0.014047907354 0.000000000002
66 O 0.87288 8.31532 10.35615 0.013924833947 -0.014244782092 0.000000000122
67 Ti 0.00000 4.59410 11.83560 -0.000062986024 0.000043100480 -0.000000000131
68 Ti 2.29705 6.89115 13.31505 0.000111793031 0.000029210706 0.000000000081
69 O 1.42417 6.01827 11.83560 -0.014095262832 -0.013695498742 -0.000000000066
70 O 3.16993 7.76403 11.83560 0.013530034730 0.014554135627 -0.000000000052
71 O 3.72122 5.46698 13.31505 -0.013597141894 0.014047907294 -0.000000000026
72 O 0.87288 8.31532 13.31505 0.013924834047 -0.014244782282 -0.000000000047
73 Ti 0.00000 4.59410 14.79450 -0.000062986121 0.000043100505 -0.000000000174
74 Ti 2.29705 6.89115 16.27395 0.000111793046 0.000029210784 0.000000000060
75 O 1.42417 6.01827 14.79450 -0.014095262869 -0.013695498739 0.000000000032
76 O 3.16993 7.76403 14.79450 0.013530034827 0.014554135675 -0.000000000116
77 O 3.72122 5.46698 16.27395 -0.013597141879 0.014047907282 -0.000000000082
78 O 0.87288 8.31532 16.27395 0.013924834028 -0.014244782209 -0.000000000017
79 Ti 0.00000 4.59410 17.75340 -0.000062986022 0.000043100291 -0.000000000042
80 Ti 2.29705 6.89115 19.23285 0.000111793099 0.000029210512 0.000000000109
81 O 1.42417 6.01827 17.75340 -0.014095262875 -0.013695498610 0.000000000052
82 O 3.16993 7.76403 17.75340 0.013530034820 0.014554135772 -0.000000000046
83 O 3.72122 5.46698 19.23285 -0.013597141907 0.014047907396 0.000000000025
84 O 0.87288 8.31532 19.23285 0.013924833986 -0.014244782172 -0.000000000066
85 Ti 0.00000 9.18820 0.00000 -0.000110907675 0.000057733000 0.000000000194
86 Ti 2.29705 11.48525 1.47945 0.000022486051 0.000098816226 0.000000000018
87 O 1.42417 10.61237 0.00000 -0.014171173014 -0.015138117501 -0.000000000076
88 O 3.16993 12.35813 0.00000 0.013630670264 0.015729900251 -0.000000000019
89 O 3.72122 10.06108 1.47945 -0.013589419216 0.015215075075 0.000000000000
90 O 0.87288 12.90942 1.47945 0.013799546770 -0.015658686350 0.000000000018
91 Ti 0.00000 9.18820 2.95890 -0.000110907722 0.000057733099 -0.000000000050
92 Ti 2.29705 11.48525 4.43835 0.000022486042 0.000098816436 0.000000000022
93 O 1.42417 10.61237 2.95890 -0.014171173045 -0.015138117453 -0.000000000090
94 O 3.16993 12.35813 2.95890 0.013630670423 0.015729900323 0.000000000024
95 O 3.72122 10.06108 4.43835 -0.013589419301 0.015215075089 -0.000000000025
96 O 0.87288 12.90942 4.43835 0.013799546759 -0.015658686318 0.000000000008
97 Ti 0.00000 9.18820 5.91780 -0.000110907781 0.000057732944 0.000000000033
98 Ti 2.29705 11.48525 7.39725 0.000022485905 0.000098816330 -0.000000000024
99 O 1.42417 10.61237 5.91780 -0.014171173094 -0.015138117605 0.000000000092
100 O 3.16993 12.35813 5.91780 0.013630670386 0.015729900289 -0.000000000001
101 O 3.72122 10.06108 7.39725 -0.013589419331 0.015215075091 -0.000000000029
102 O 0.87288 12.90942 7.39725 0.013799546815 -0.015658686323 0.000000000040
103 Ti 0.00000 9.18820 8.87670 -0.000110907758 0.000057732816 0.000000000056
104 Ti 2.29705 11.48525 10.35615 0.000022486085 0.000098816335 0.000000000043
105 O 1.42417 10.61237 8.87670 -0.014171172988 -0.015138117537 -0.000000000112
106 O 3.16993 12.35813 8.87670 0.013630670291 0.015729900234 0.000000000062
107 O 3.72122 10.06108 10.35615 -0.013589419161 0.015215075014 -0.000000000053
108 O 0.87288 12.90942 10.35615 0.013799546747 -0.015658686294 0.000000000057
109 Ti 0.00000 9.18820 11.83560 -0.000110907834 0.000057732822 -0.000000000016
110 Ti 2.29705 11.48525 13.31505 0.000022486187 0.000098816324 -0.000000000140
111 O 1.42417 10.61237 11.83560 -0.014171173000 -0.015138117544 -0.000000000011
112 O 3.16993 12.35813 11.83560 0.013630670379 0.015729900303 0.000000000092
113 O 3.72122 10.06108 13.31505 -0.013589419275 0.015215075106 -0.000000000071
114 O 0.87288 12.90942 13.31505 0.013799546757 -0.015658686265 0.000000000123
115 Ti 0.00000 9.18820 14.79450 -0.000110907885 0.000057733073 0.000000000133
116 Ti 2.29705 11.48525 16.27395 0.000022486062 0.000098816327 0.000000000010
117 O 1.42417 10.61237 14.79450 -0.014171173147 -0.015138117529 0.000000000035
118 O 3.16993 12.35813 14.79450 0.013630670325 0.015729900239 0.000000000031
119 O 3.72122 10.06108 16.27395 -0.013589419293 0.015215075057 -0.000000000079
120 O 0.87288 12.90942 16.27395 0.013799546770 -0.015658686345 0.000000000005
121 Ti 0.00000 9.18820 17.75340 -0.000110907852 0.000057732821 0.000000000158
122 Ti 2.29705 11.48525 19.23285 0.000022486031 0.000098816540 -0.000000000020
123 O 1.42417 10.61237 17.75340 -0.014171173020 -0.015138117630 0.000000000049
124 O 3.16993 12.35813 17.75340 0.013630670299 0.015729900241 0.000000000029
125 O 3.72122 10.06108 19.23285 -0.013589419266 0.015215075080 0.000000000011
126 O 0.87288 12.90942 19.23285 0.013799546854 -0.015658686234 -0.000000000027
127 Ti 0.00000 13.78230 0.00000 0.000129962957 -0.000074630909 0.000000000008
128 Ti 2.29705 16.07935 1.47945 -0.000057656790 0.000272028633 -0.000000000015
129 O 1.42417 15.20647 0.00000 -0.013959410179 -0.016072227958 -0.000000000021
130 O 3.16993 16.95223 0.00000 0.013700021167 0.015667516424 0.000000000032
131 O 3.72122 14.65518 1.47945 -0.013633553684 0.015966847773 0.000000000054
132 O 0.87288 17.50352 1.47945 0.013591917300 -0.015764330820 -0.000000000036
133 Ti 0.00000 13.78230 2.95890 0.000129963273 -0.000074631311 0.000000000070
134 Ti 2.29705 16.07935 4.43835 -0.000057656768 0.000272028862 0.000000000080
135 O 1.42417 15.20647 2.95890 -0.013959410169 -0.016072228046 -0.000000000090
136 O 3.16993 16.95223 2.95890 0.013700021119 0.015667516574 -0.000000000095
137 O 3.72122 14.65518 4.43835 -0.013633553650 0.015966847649 0.000000000068
138 O 0.87288 17.50352 4.43835 0.013591917168 -0.015764330806 0.000000000096
139 Ti 0.00000 13.78230 5.91780 0.000129963189 -0.000074631301 -0.000000000027
140 Ti 2.29705 16.07935 7.39725 -0.000057656778 0.000272028751 -0.000000000074
141 O 1.42417 15.20647 5.91780 -0.013959410112 -0.016072227927 -0.000000000031
142 O 3.16993 16.95223 5.91780 0.013700021162 0.015667516446 0.000000000048
143 O 3.72122 14.65518 7.39725 -0.013633553708 0.015966847821 0.000000000022
144 O 0.87288 17.50352 7.39725 0.013591917343 -0.015764330749 0.000000000001
145 Ti 0.00000 13.78230 8.87670 0.000129963038 -0.000074631109 0.000000000047
146 Ti 2.29705 16.07935 10.35615 -0.000057656734 0.000272028905 -0.000000000063
147 O 1.42417 15.20647 8.87670 -0.013959410102 -0.016072227993 -0.000000000019
148 O 3.16993 16.95223 8.87670 0.013700021071 0.015667516446 0.000000000058
149 O 3.72122 14.65518 10.35615 -0.013633553630 0.015966847677 -0.000000000078
150 O 0.87288 17.50352 10.35615 0.013591917377 -0.015764330750 0.000000000082
151 Ti 0.00000 13.78230 11.83560 0.000129963142 -0.000074631182 -0.000000000005
152 Ti 2.29705 16.07935 13.31505 -0.000057656910 0.000272028776 -0.000000000057
153 O 1.42417 15.20647 11.83560 -0.013959410221 -0.016072228026 0.000000000125
154 O 3.16993 16.95223 11.83560 0.013700021051 0.015667516461 0.000000000006
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186 O 0.87288 22.09762 7.39725 0.013606404221 -0.014704003773 0.000000000026
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192 O 0.87288 22.09762 10.35615 0.013606404130 -0.014704003839 0.000000000035
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198 O 0.87288 22.09762 13.31505 0.013606404186 -0.014704003808 0.000000000065
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218 Ti 6.89115 2.29705 4.43835 0.000029210435 0.000111793206 -0.000000000131
219 O 6.01827 1.42417 2.95890 -0.013695498568 -0.014095262905 0.000000000047
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224 Ti 6.89115 2.29705 7.39725 0.000029210359 0.000111793427 -0.000000000031
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228 O 5.46698 3.72122 7.39725 0.014047907468 -0.013597142117 0.000000000045
229 Ti 4.59410 0.00000 8.87670 0.000043100249 -0.000062985636 0.000000000143
230 Ti 6.89115 2.29705 10.35615 0.000029210424 0.000111793181 -0.000000000046
231 O 6.01827 1.42417 8.87670 -0.013695498673 -0.014095262906 0.000000000025
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235 Ti 4.59410 0.00000 11.83560 0.000043100189 -0.000062985763 -0.000000000022
236 Ti 6.89115 2.29705 13.31505 0.000029210304 0.000111793506 0.000000000033
237 O 6.01827 1.42417 11.83560 -0.013695498616 -0.014095262978 -0.000000000028
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241 Ti 4.59410 0.00000 14.79450 0.000043100331 -0.000062985763 0.000000000012
242 Ti 6.89115 2.29705 16.27395 0.000029210406 0.000111793241 0.000000000053
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246 O 5.46698 3.72122 16.27395 0.014047907507 -0.013597141982 -0.000000000019
247 Ti 4.59410 0.00000 17.75340 0.000043100232 -0.000062985904 0.000000000040
248 Ti 6.89115 2.29705 19.23285 0.000029210440 0.000111793578 0.000000000057
249 O 6.01827 1.42417 17.75340 -0.013695498764 -0.014095262979 -0.000000000139
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253 Ti 4.59410 4.59410 0.00000 -0.000003129498 -0.000003129326 -0.000000000118
254 Ti 6.89115 6.89115 1.47945 0.000136320943 0.000136321115 0.000000000136
255 O 6.01827 6.01827 0.00000 -0.013804788161 -0.013804788239 -0.000000000063
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259 Ti 4.59410 4.59410 2.95890 -0.000003129515 -0.000003129335 0.000000000027
260 Ti 6.89115 6.89115 4.43835 0.000136320857 0.000136321096 -0.000000000042
261 O 6.01827 6.01827 2.95890 -0.013804788160 -0.013804788202 0.000000000099
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264 O 5.46698 8.31532 4.43835 0.014169615025 -0.014257994696 0.000000000006
265 Ti 4.59410 4.59410 5.91780 -0.000003129429 -0.000003129370 0.000000000130
266 Ti 6.89115 6.89115 7.39725 0.000136320861 0.000136321210 0.000000000184
267 O 6.01827 6.01827 5.91780 -0.013804788103 -0.013804788231 -0.000000000119
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270 O 5.46698 8.31532 7.39725 0.014169615026 -0.014257994741 0.000000000016
271 Ti 4.59410 4.59410 8.87670 -0.000003129582 -0.000003129246 -0.000000000065
272 Ti 6.89115 6.89115 10.35615 0.000136320983 0.000136321285 0.000000000081
273 O 6.01827 6.01827 8.87670 -0.013804788145 -0.013804788124 -0.000000000056
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276 O 5.46698 8.31532 10.35615 0.014169615039 -0.014257994772 -0.000000000037
277 Ti 4.59410 4.59410 11.83560 -0.000003129420 -0.000003129273 -0.000000000045
278 Ti 6.89115 6.89115 13.31505 0.000136321017 0.000136321232 0.000000000082
279 O 6.01827 6.01827 11.83560 -0.013804788101 -0.013804788222 0.000000000036
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283 Ti 4.59410 4.59410 14.79450 -0.000003129447 -0.000003129242 0.000000000158
284 Ti 6.89115 6.89115 16.27395 0.000136320971 0.000136321098 -0.000000000057
285 O 6.01827 6.01827 14.79450 -0.013804788152 -0.013804788190 0.000000000029
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288 O 5.46698 8.31532 16.27395 0.014169615013 -0.014257994757 0.000000000062
289 Ti 4.59410 4.59410 17.75340 -0.000003129371 -0.000003129426 -0.000000000034
290 Ti 6.89115 6.89115 19.23285 0.000136320882 0.000136321280 -0.000000000033
291 O 6.01827 6.01827 17.75340 -0.013804788112 -0.013804788306 0.000000000017
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294 O 5.46698 8.31532 19.23285 0.014169615021 -0.014257994838 0.000000000088
295 Ti 4.59410 9.18820 0.00000 -0.000067855875 -0.000164530412 -0.000000000025
296 Ti 6.89115 11.48525 1.47945 0.000118248605 -0.000194235635 -0.000000000088
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302 Ti 6.89115 11.48525 4.43835 0.000118248939 -0.000194235590 -0.000000000159
303 O 6.01827 10.61237 2.95890 -0.013896083201 -0.014930485985 -0.000000000044
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306 O 5.46698 12.90942 4.43835 0.014059755481 -0.015810029255 0.000000000115
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308 Ti 6.89115 11.48525 7.39725 0.000118248565 -0.000194235542 -0.000000000003
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313 Ti 4.59410 9.18820 8.87670 -0.000067855915 -0.000164530505 0.000000000151
314 Ti 6.89115 11.48525 10.35615 0.000118248876 -0.000194235589 -0.000000000088
315 O 6.01827 10.61237 8.87670 -0.013896083152 -0.014930485988 0.000000000050
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319 Ti 4.59410 9.18820 11.83560 -0.000067855908 -0.000164530366 0.000000000085
320 Ti 6.89115 11.48525 13.31505 0.000118248731 -0.000194235448 0.000000000001
321 O 6.01827 10.61237 11.83560 -0.013896083280 -0.014930485938 -0.000000000012
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324 O 5.46698 12.90942 13.31505 0.014059755608 -0.015810029433 0.000000000078
325 Ti 4.59410 9.18820 14.79450 -0.000067855892 -0.000164530424 0.000000000091
326 Ti 6.89115 11.48525 16.27395 0.000118248909 -0.000194235500 0.000000000019
327 O 6.01827 10.61237 14.79450 -0.013896083271 -0.014930486087 -0.000000000026
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330 O 5.46698 12.90942 16.27395 0.014059755532 -0.015810029323 -0.000000000024
331 Ti 4.59410 9.18820 17.75340 -0.000067855837 -0.000164530483 0.000000000021
332 Ti 6.89115 11.48525 19.23285 0.000118248807 -0.000194235404 -0.000000000012
333 O 6.01827 10.61237 17.75340 -0.013896083266 -0.014930486056 0.000000000036
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337 Ti 4.59410 13.78230 0.00000 0.000023931621 -0.000229636455 0.000000000038
338 Ti 6.89115 16.07935 1.47945 -0.000159501611 -0.000071677299 -0.000000000079
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343 Ti 4.59410 13.78230 2.95890 0.000023931581 -0.000229636452 -0.000000000027
344 Ti 6.89115 16.07935 4.43835 -0.000159501649 -0.000071677219 -0.000000000014
345 O 6.01827 15.20647 2.95890 -0.013667243119 -0.015868630322 -0.000000000048
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349 Ti 4.59410 13.78230 5.91780 0.000023931536 -0.000229636453 -0.000000000272
350 Ti 6.89115 16.07935 7.39725 -0.000159501330 -0.000071677188 0.000000000027
351 O 6.01827 15.20647 5.91780 -0.013667243119 -0.015868630240 -0.000000000041
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354 O 5.46698 17.50352 7.39725 0.013950261791 -0.015839730303 0.000000000036
355 Ti 4.59410 13.78230 8.87670 0.000023931711 -0.000229636395 0.000000000190
356 Ti 6.89115 16.07935 10.35615 -0.000159501661 -0.000071677175 -0.000000000116
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362 Ti 6.89115 16.07935 13.31505 -0.000159501408 -0.000071677133 0.000000000057
363 O 6.01827 15.20647 11.83560 -0.013667243140 -0.015868630333 -0.000000000004
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366 O 5.46698 17.50352 13.31505 0.013950261796 -0.015839730353 0.000000000060
367 Ti 4.59410 13.78230 14.79450 0.000023931426 -0.000229636524 -0.000000000121
368 Ti 6.89115 16.07935 16.27395 -0.000159501534 -0.000071676938 0.000000000145
369 O 6.01827 15.20647 14.79450 -0.013667243195 -0.015868630328 0.000000000077
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372 O 5.46698 17.50352 16.27395 0.013950261777 -0.015839730382 -0.000000000059
373 Ti 4.59410 13.78230 17.75340 0.000023931740 -0.000229636423 -0.000000000020
374 Ti 6.89115 16.07935 19.23285 -0.000159501514 -0.000071677029 0.000000000011
375 O 6.01827 15.20647 17.75340 -0.013667243212 -0.015868630340 -0.000000000108
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378 O 5.46698 17.50352 19.23285 0.013950261811 -0.015839730356 -0.000000000018
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380 Ti 6.89115 20.67345 1.47945 -0.000013186351 -0.000081544385 0.000000000044
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506 Ti 11.48525 11.48525 1.47945 -0.000001248522 -0.000001248133 0.000000000167
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513 O 10.61237 10.61237 2.95890 -0.014916563284 -0.014916563555 0.000000000008
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516 O 10.06108 12.90942 4.43835 0.015308110371 -0.015992334543 0.000000000100
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523 Ti 9.18820 9.18820 8.87670 -0.000096233980 -0.000096233827 0.000000000028
524 Ti 11.48525 11.48525 10.35615 -0.000001248325 -0.000001248354 -0.000000000024
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529 Ti 9.18820 9.18820 11.83560 -0.000096234048 -0.000096233802 0.000000000016
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531 O 10.61237 10.61237 11.83560 -0.014916563388 -0.014916563371 0.000000000043
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534 O 10.06108 12.90942 13.31505 0.015308110511 -0.015992334549 -0.000000000027
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536 Ti 11.48525 11.48525 16.27395 -0.000001248610 -0.000001248266 0.000000000022
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540 O 10.06108 12.90942 16.27395 0.015308110613 -0.015992334660 0.000000000057
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554 Ti 11.48525 16.07935 4.43835 -0.000030943850 -0.000148261263 -0.000000000152
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560 Ti 11.48525 16.07935 7.39725 -0.000030943988 -0.000148261631 -0.000000000131
561 O 10.61237 15.20647 5.91780 -0.015005609397 -0.015834706698 0.000000000027
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564 O 10.06108 17.50352 7.39725 0.015280471622 -0.015876854694 0.000000000014
565 Ti 9.18820 13.78230 8.87670 -0.000089024532 0.000044695342 0.000000000009
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567 O 10.61237 15.20647 8.87670 -0.015005609366 -0.015834706701 -0.000000000004
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571 Ti 9.18820 13.78230 11.83560 -0.000089024332 0.000044695150 -0.000000000063
572 Ti 11.48525 16.07935 13.31505 -0.000030943935 -0.000148261326 -0.000000000173
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577 Ti 9.18820 13.78230 14.79450 -0.000089024613 0.000044695453 -0.000000000059
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583 Ti 9.18820 13.78230 17.75340 -0.000089024471 0.000044695390 0.000000000102
584 Ti 11.48525 16.07935 19.23285 -0.000030944191 -0.000148261339 0.000000000066
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589 Ti 9.18820 18.37640 0.00000 -0.000225081670 0.000017046149 -0.000000000073
590 Ti 11.48525 20.67345 1.47945 0.000116799084 0.000212135328 0.000000000139
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596 Ti 11.48525 20.67345 4.43835 0.000116799334 0.000212135179 -0.000000000085
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831 O 15.20647 19.80057 14.79450 -0.016111067451 -0.015272715879 -0.000000000054
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860 Ti 20.67345 2.29705 10.35615 0.000164527592 -0.000131887205 0.000000000035
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890 Ti 20.67345 6.89115 4.43835 -0.000081544678 -0.000013186069 -0.000000000024
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894 O 19.24928 8.31532 4.43835 0.014882380922 -0.014368080743 -0.000000000009
895 Ti 18.37640 4.59410 5.91780 -0.000035480348 0.000117801362 0.000000000044
896 Ti 20.67345 6.89115 7.39725 -0.000081544782 -0.000013185917 -0.000000000026
897 O 19.80057 6.01827 5.91780 -0.015263980048 -0.013621424992 0.000000000013
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900 O 19.24928 8.31532 7.39725 0.014882380908 -0.014368080762 0.000000000027
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902 Ti 20.67345 6.89115 10.35615 -0.000081544650 -0.000013186006 0.000000000021
903 O 19.80057 6.01827 8.87670 -0.015263980093 -0.013621425051 -0.000000000002
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905 O 22.09762 5.46698 10.35615 -0.014599952525 0.013902383619 0.000000000073
906 O 19.24928 8.31532 10.35615 0.014882380969 -0.014368080840 0.000000000072
907 Ti 18.37640 4.59410 11.83560 -0.000035480457 0.000117801507 0.000000000175
908 Ti 20.67345 6.89115 13.31505 -0.000081544665 -0.000013186041 0.000000000127
909 O 19.80057 6.01827 11.83560 -0.015263980098 -0.013621425047 -0.000000000060
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912 O 19.24928 8.31532 13.31505 0.014882380851 -0.014368080793 0.000000000006
913 Ti 18.37640 4.59410 14.79450 -0.000035480469 0.000117801282 0.000000000012
914 Ti 20.67345 6.89115 16.27395 -0.000081544886 -0.000013185880 -0.000000000063
915 O 19.80057 6.01827 14.79450 -0.015263980092 -0.013621425072 -0.000000000081
916 O 21.54633 7.76403 14.79450 0.014209518013 0.014621571031 -0.000000000111
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918 O 19.24928 8.31532 16.27395 0.014882381103 -0.014368080813 0.000000000081
919 Ti 18.37640 4.59410 17.75340 -0.000035480469 0.000117801438 0.000000000016
920 Ti 20.67345 6.89115 19.23285 -0.000081544751 -0.000013186120 -0.000000000050
921 O 19.80057 6.01827 17.75340 -0.015263980018 -0.013621425007 -0.000000000040
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924 O 19.24928 8.31532 19.23285 0.014882381028 -0.014368080749 -0.000000000064
925 Ti 18.37640 9.18820 0.00000 0.000017046045 -0.000225081755 0.000000000014
926 Ti 20.67345 11.48525 1.47945 0.000212134922 0.000116799478 -0.000000000100
927 O 19.80057 10.61237 0.00000 -0.015212609348 -0.015105937737 0.000000000023
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930 O 19.24928 12.90942 1.47945 0.015007773739 -0.015560000723 -0.000000000009
931 Ti 18.37640 9.18820 2.95890 0.000017045987 -0.000225081557 -0.000000000090
932 Ti 20.67345 11.48525 4.43835 0.000212134617 0.000116799447 -0.000000000029
933 O 19.80057 10.61237 2.95890 -0.015212609353 -0.015105937810 -0.000000000008
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936 O 19.24928 12.90942 4.43835 0.015007773861 -0.015560000751 -0.000000000050
937 Ti 18.37640 9.18820 5.91780 0.000017045949 -0.000225081524 0.000000000021
938 Ti 20.67345 11.48525 7.39725 0.000212134773 0.000116799478 -0.000000000140
939 O 19.80057 10.61237 5.91780 -0.015212609264 -0.015105937707 0.000000000079
940 O 21.54633 12.35813 5.91780 0.014132109087 0.015755512653 -0.000000000036
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942 O 19.24928 12.90942 7.39725 0.015007773821 -0.015560000637 -0.000000000026
943 Ti 18.37640 9.18820 8.87670 0.000017046072 -0.000225081701 -0.000000000065
944 Ti 20.67345 11.48525 10.35615 0.000212134639 0.000116799572 -0.000000000073
945 O 19.80057 10.61237 8.87670 -0.015212609280 -0.015105937745 0.000000000019
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948 O 19.24928 12.90942 10.35615 0.015007773948 -0.015560000800 0.000000000057
949 Ti 18.37640 9.18820 11.83560 0.000017046041 -0.000225081549 0.000000000085
950 Ti 20.67345 11.48525 13.31505 0.000212134780 0.000116799550 0.000000000050
951 O 19.80057 10.61237 11.83560 -0.015212609304 -0.015105937842 0.000000000027
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954 O 19.24928 12.90942 13.31505 0.015007773751 -0.015560000719 -0.000000000034
955 Ti 18.37640 9.18820 14.79450 0.000017046015 -0.000225081496 0.000000000018
956 Ti 20.67345 11.48525 16.27395 0.000212134994 0.000116799492 0.000000000194
957 O 19.80057 10.61237 14.79450 -0.015212609415 -0.015105937821 -0.000000000023
958 O 21.54633 12.35813 14.79450 0.014132109001 0.015755512585 -0.000000000071
959 O 22.09762 10.06108 16.27395 -0.014538723231 0.015274882177 -0.000000000089
960 O 19.24928 12.90942 16.27395 0.015007773716 -0.015560000612 -0.000000000014
961 Ti 18.37640 9.18820 17.75340 0.000017046031 -0.000225081619 0.000000000012
962 Ti 20.67345 11.48525 19.23285 0.000212134675 0.000116799689 0.000000000131
963 O 19.80057 10.61237 17.75340 -0.015212609420 -0.015105937846 0.000000000001
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966 O 19.24928 12.90942 19.23285 0.015007773855 -0.015560000696 0.000000000099
967 Ti 18.37640 13.78230 0.00000 0.000070509151 0.000019025124 -0.000000000044
968 Ti 20.67345 16.07935 1.47945 0.000102018973 0.000129678938 -0.000000000086
969 O 19.80057 15.20647 0.00000 -0.015272715846 -0.016111067566 -0.000000000025
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972 O 19.24928 17.50352 1.47945 0.015118901146 -0.015655463993 0.000000000029
973 Ti 18.37640 13.78230 2.95890 0.000070509270 0.000019025228 0.000000000103
974 Ti 20.67345 16.07935 4.43835 0.000102018850 0.000129678794 0.000000000012
975 O 19.80057 15.20647 2.95890 -0.015272715843 -0.016111067595 -0.000000000016
976 O 21.54633 16.95223 2.95890 0.014310736011 0.015576935220 0.000000000020
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978 O 19.24928 17.50352 4.43835 0.015118901175 -0.015655464041 -0.000000000078
979 Ti 18.37640 13.78230 5.91780 0.000070509436 0.000019025266 0.000000000015
980 Ti 20.67345 16.07935 7.39725 0.000102018849 0.000129678837 -0.000000000094
981 O 19.80057 15.20647 5.91780 -0.015272715925 -0.016111067616 0.000000000075
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984 O 19.24928 17.50352 7.39725 0.015118901158 -0.015655464000 -0.000000000012
985 Ti 18.37640 13.78230 8.87670 0.000070509214 0.000019025119 0.000000000024
986 Ti 20.67345 16.07935 10.35615 0.000102018770 0.000129678850 -0.000000000053
987 O 19.80057 15.20647 8.87670 -0.015272715844 -0.016111067557 0.000000000047
988 O 21.54633 16.95223 8.87670 0.014310736024 0.015576935252 0.000000000008
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990 O 19.24928 17.50352 10.35615 0.015118901195 -0.015655464036 -0.000000000148
991 Ti 18.37640 13.78230 11.83560 0.000070509337 0.000019024935 0.000000000074
992 Ti 20.67345 16.07935 13.31505 0.000102018753 0.000129678908 -0.000000000007
993 O 19.80057 15.20647 11.83560 -0.015272715827 -0.016111067548 -0.000000000078
994 O 21.54633 16.95223 11.83560 0.014310736007 0.015576935239 0.000000000023
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996 O 19.24928 17.50352 13.31505 0.015118901200 -0.015655463995 -0.000000000057
997 Ti 18.37640 13.78230 14.79450 0.000070509210 0.000019025277 -0.000000000059
998 Ti 20.67345 16.07935 16.27395 0.000102018893 0.000129678842 -0.000000000049
999 O 19.80057 15.20647 14.79450 -0.015272715804 -0.016111067578 0.000000000087
1000 O 21.54633 16.95223 14.79450 0.014310736050 0.015576935195 -0.000000000034
1001 O 22.09762 14.65518 16.27395 -0.014632418984 0.016118885377 -0.000000000075
1002 O 19.24928 17.50352 16.27395 0.015118901125 -0.015655464075 0.000000000109
1003 Ti 18.37640 13.78230 17.75340 0.000070509348 0.000019024863 -0.000000000172
1004 Ti 20.67345 16.07935 19.23285 0.000102018618 0.000129678943 -0.000000000049
1005 O 19.80057 15.20647 17.75340 -0.015272715864 -0.016111067606 0.000000000043
1006 O 21.54633 16.95223 17.75340 0.014310735963 0.015576935192 0.000000000050
1007 O 22.09762 14.65518 19.23285 -0.014632418780 0.016118885318 0.000000000052
1008 O 19.24928 17.50352 19.23285 0.015118901031 -0.015655463965 0.000000000034
1009 Ti 18.37640 18.37640 0.00000 -0.000096135647 -0.000096135591 0.000000000125
1010 Ti 20.67345 20.67345 1.47945 0.000117782629 0.000117783060 0.000000000013
1011 O 19.80057 19.80057 0.00000 -0.015246831384 -0.015246831487 0.000000000040
1012 O 21.54633 21.54633 0.00000 0.014340405591 0.014340405653 0.000000000067
1013 O 22.09762 19.24928 1.47945 -0.014681808260 0.015151214726 -0.000000000095
1014 O 19.24928 22.09762 1.47945 0.015151214922 -0.014681808352 -0.000000000033
1015 Ti 18.37640 18.37640 2.95890 -0.000096135724 -0.000096135653 -0.000000000061
1016 Ti 20.67345 20.67345 4.43835 0.000117782842 0.000117782803 0.000000000017
1017 O 19.80057 19.80057 2.95890 -0.015246831391 -0.015246831407 -0.000000000040
1018 O 21.54633 21.54633 2.95890 0.014340405734 0.014340405671 -0.000000000029
1019 O 22.09762 19.24928 4.43835 -0.014681808267 0.015151214755 -0.000000000135
1020 O 19.24928 22.09762 4.43835 0.015151214905 -0.014681808397 0.000000000078
1021 Ti 18.37640 18.37640 5.91780 -0.000096135810 -0.000096135434 0.000000000156
1022 Ti 20.67345 20.67345 7.39725 0.000117782736 0.000117782861 -0.000000000235
1023 O 19.80057 19.80057 5.91780 -0.015246831394 -0.015246831333 0.000000000039
1024 O 21.54633 21.54633 5.91780 0.014340405673 0.014340405601 -0.000000000037
1025 O 22.09762 19.24928 7.39725 -0.014681808255 0.015151214812 -0.000000000017
1026 O 19.24928 22.09762 7.39725 0.015151214933 -0.014681808400 0.000000000058
1027 Ti 18.37640 18.37640 8.87670 -0.000096135801 -0.000096135377 -0.000000000060
1028 Ti 20.67345 20.67345 10.35615 0.000117782622 0.000117783054 -0.000000000046
1029 O 19.80057 19.80057 8.87670 -0.015246831362 -0.015246831373 -0.000000000004
1030 O 21.54633 21.54633 8.87670 0.014340405721 0.014340405763 0.000000000172
1031 O 22.09762 19.24928 10.35615 -0.014681808198 0.015151214797 -0.000000000028
1032 O 19.24928 22.09762 10.35615 0.015151214994 -0.014681808514 -0.000000000046
1033 Ti 18.37640 18.37640 11.83560 -0.000096135750 -0.000096135450 0.000000000125
1034 Ti 20.67345 20.67345 13.31505 0.000117782673 0.000117783152 -0.000000000046
1035 O 19.80057 19.80057 11.83560 -0.015246831397 -0.015246831476 -0.000000000009
1036 O 21.54633 21.54633 11.83560 0.014340405672 0.014340405704 -0.000000000027
1037 O 22.09762 19.24928 13.31505 -0.014681808242 0.015151214702 -0.000000000093
1038 O 19.24928 22.09762 13.31505 0.015151215019 -0.014681808572 0.000000000000
1039 Ti 18.37640 18.37640 14.79450 -0.000096135869 -0.000096135766 0.000000000027
1040 Ti 20.67345 20.67345 16.27395 0.000117782862 0.000117783138 -0.000000000112
1041 O 19.80057 19.80057 14.79450 -0.015246831483 -0.015246831434 -0.000000000019
1042 O 21.54633 21.54633 14.79450 0.014340405627 0.014340405518 0.000000000074
1043 O 22.09762 19.24928 16.27395 -0.014681808199 0.015151214703 -0.000000000006
1044 O 19.24928 22.09762 16.27395 0.015151214989 -0.014681808457 0.000000000103
1045 Ti 18.37640 18.37640 17.75340 -0.000096135657 -0.000096135590 0.000000000101
1046 Ti 20.67345 20.67345 19.23285 0.000117782855 0.000117782959 -0.000000000051
1047 O 19.80057 19.80057 17.75340 -0.015246831468 -0.015246831465 0.000000000014
1048 O 21.54633 21.54633 17.75340 0.014340405769 0.014340405628 -0.000000000014
1049 O 22.09762 19.24928 19.23285 -0.014681808240 0.015151214801 0.000000000014
1050 O 19.24928 22.09762 19.23285 0.015151214979 -0.014681808550 -0.000000000002
coordinates.forces>
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Fractional coordinates of the final structure
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1 Ti 0.00000000000000 0.00000000000000 0.00000000000000
2 Ti 0.10000000000000 0.10000000000000 0.07142857142857
3 O 0.06200000000000 0.06200000000000 0.00000000000000
4 O 0.13800000000000 0.13800000000000 0.00000000000000
5 O 0.16200000000000 0.03800000000000 0.07142857142857
6 O 0.03800000000000 0.16200000000000 0.07142857142857
7 Ti 0.00000000000000 0.00000000000000 0.14285714285714
8 Ti 0.10000000000000 0.10000000000000 0.21428571428571
9 O 0.06200000000000 0.06200000000000 0.14285714285714
10 O 0.13800000000000 0.13800000000000 0.14285714285714
11 O 0.16200000000000 0.03800000000000 0.21428571428571
12 O 0.03800000000000 0.16200000000000 0.21428571428571
13 Ti 0.00000000000000 0.00000000000000 0.28571428571429
14 Ti 0.10000000000000 0.10000000000000 0.35714285714286
15 O 0.06200000000000 0.06200000000000 0.28571428571429
16 O 0.13800000000000 0.13800000000000 0.28571428571429
17 O 0.16200000000000 0.03800000000000 0.35714285714286
18 O 0.03800000000000 0.16200000000000 0.35714285714286
19 Ti 0.00000000000000 0.00000000000000 0.42857142857143
20 Ti 0.10000000000000 0.10000000000000 0.50000000000000
21 O 0.06200000000000 0.06200000000000 0.42857142857143
22 O 0.13800000000000 0.13800000000000 0.42857142857143
23 O 0.16200000000000 0.03800000000000 0.50000000000000
24 O 0.03800000000000 0.16200000000000 0.50000000000000
25 Ti 0.00000000000000 0.00000000000000 0.57142857142857
26 Ti 0.10000000000000 0.10000000000000 0.64285714285714
27 O 0.06200000000000 0.06200000000000 0.57142857142857
28 O 0.13800000000000 0.13800000000000 0.57142857142857
29 O 0.16200000000000 0.03800000000000 0.64285714285714
30 O 0.03800000000000 0.16200000000000 0.64285714285714
31 Ti 0.00000000000000 0.00000000000000 0.71428571428571
32 Ti 0.10000000000000 0.10000000000000 0.78571428571429
33 O 0.06200000000000 0.06200000000000 0.71428571428571
34 O 0.13800000000000 0.13800000000000 0.71428571428571
35 O 0.16200000000000 0.03800000000000 0.78571428571429
36 O 0.03800000000000 0.16200000000000 0.78571428571429
37 Ti 0.00000000000000 0.00000000000000 0.85714285714286
38 Ti 0.10000000000000 0.10000000000000 0.92857142857143
39 O 0.06200000000000 0.06200000000000 0.85714285714286
40 O 0.13800000000000 0.13800000000000 0.85714285714286
41 O 0.16200000000000 0.03800000000000 0.92857142857143
42 O 0.03800000000000 0.16200000000000 0.92857142857143
43 Ti 0.00000000000000 0.20000000000000 0.00000000000000
44 Ti 0.10000000000000 0.30000000000000 0.07142857142857
45 O 0.06200000000000 0.26200000000000 0.00000000000000
46 O 0.13800000000000 0.33800000000000 0.00000000000000
47 O 0.16200000000000 0.23800000000000 0.07142857142857
48 O 0.03800000000000 0.36200000000000 0.07142857142857
49 Ti 0.00000000000000 0.20000000000000 0.14285714285714
50 Ti 0.10000000000000 0.30000000000000 0.21428571428571
51 O 0.06200000000000 0.26200000000000 0.14285714285714
52 O 0.13800000000000 0.33800000000000 0.14285714285714
53 O 0.16200000000000 0.23800000000000 0.21428571428571
54 O 0.03800000000000 0.36200000000000 0.21428571428571
55 Ti 0.00000000000000 0.20000000000000 0.28571428571429
56 Ti 0.10000000000000 0.30000000000000 0.35714285714286
57 O 0.06200000000000 0.26200000000000 0.28571428571429
58 O 0.13800000000000 0.33800000000000 0.28571428571429
59 O 0.16200000000000 0.23800000000000 0.35714285714286
60 O 0.03800000000000 0.36200000000000 0.35714285714286
61 Ti 0.00000000000000 0.20000000000000 0.42857142857143
62 Ti 0.10000000000000 0.30000000000000 0.50000000000000
63 O 0.06200000000000 0.26200000000000 0.42857142857143
64 O 0.13800000000000 0.33800000000000 0.42857142857143
65 O 0.16200000000000 0.23800000000000 0.50000000000000
66 O 0.03800000000000 0.36200000000000 0.50000000000000
67 Ti 0.00000000000000 0.20000000000000 0.57142857142857
68 Ti 0.10000000000000 0.30000000000000 0.64285714285714
69 O 0.06200000000000 0.26200000000000 0.57142857142857
70 O 0.13800000000000 0.33800000000000 0.57142857142857
71 O 0.16200000000000 0.23800000000000 0.64285714285714
72 O 0.03800000000000 0.36200000000000 0.64285714285714
73 Ti 0.00000000000000 0.20000000000000 0.71428571428571
74 Ti 0.10000000000000 0.30000000000000 0.78571428571429
75 O 0.06200000000000 0.26200000000000 0.71428571428571
76 O 0.13800000000000 0.33800000000000 0.71428571428571
77 O 0.16200000000000 0.23800000000000 0.78571428571429
78 O 0.03800000000000 0.36200000000000 0.78571428571429
79 Ti 0.00000000000000 0.20000000000000 0.85714285714286
80 Ti 0.10000000000000 0.30000000000000 0.92857142857143
81 O 0.06200000000000 0.26200000000000 0.85714285714286
82 O 0.13800000000000 0.33800000000000 0.85714285714286
83 O 0.16200000000000 0.23800000000000 0.92857142857143
84 O 0.03800000000000 0.36200000000000 0.92857142857143
85 Ti 0.00000000000000 0.40000000000000 0.00000000000000
86 Ti 0.10000000000000 0.50000000000000 0.07142857142857
87 O 0.06200000000000 0.46200000000000 0.00000000000000
88 O 0.13800000000000 0.53800000000000 0.00000000000000
89 O 0.16200000000000 0.43800000000000 0.07142857142857
90 O 0.03800000000000 0.56200000000000 0.07142857142857
91 Ti 0.00000000000000 0.40000000000000 0.14285714285714
92 Ti 0.10000000000000 0.50000000000000 0.21428571428571
93 O 0.06200000000000 0.46200000000000 0.14285714285714
94 O 0.13800000000000 0.53800000000000 0.14285714285714
95 O 0.16200000000000 0.43800000000000 0.21428571428571
96 O 0.03800000000000 0.56200000000000 0.21428571428571
97 Ti 0.00000000000000 0.40000000000000 0.28571428571429
98 Ti 0.10000000000000 0.50000000000000 0.35714285714286
99 O 0.06200000000000 0.46200000000000 0.28571428571429
100 O 0.13800000000000 0.53800000000000 0.28571428571429
101 O 0.16200000000000 0.43800000000000 0.35714285714286
102 O 0.03800000000000 0.56200000000000 0.35714285714286
103 Ti 0.00000000000000 0.40000000000000 0.42857142857143
104 Ti 0.10000000000000 0.50000000000000 0.50000000000000
105 O 0.06200000000000 0.46200000000000 0.42857142857143
106 O 0.13800000000000 0.53800000000000 0.42857142857143
107 O 0.16200000000000 0.43800000000000 0.50000000000000
108 O 0.03800000000000 0.56200000000000 0.50000000000000
109 Ti 0.00000000000000 0.40000000000000 0.57142857142857
110 Ti 0.10000000000000 0.50000000000000 0.64285714285714
111 O 0.06200000000000 0.46200000000000 0.57142857142857
112 O 0.13800000000000 0.53800000000000 0.57142857142857
113 O 0.16200000000000 0.43800000000000 0.64285714285714
114 O 0.03800000000000 0.56200000000000 0.64285714285714
115 Ti 0.00000000000000 0.40000000000000 0.71428571428571
116 Ti 0.10000000000000 0.50000000000000 0.78571428571429
117 O 0.06200000000000 0.46200000000000 0.71428571428571
118 O 0.13800000000000 0.53800000000000 0.71428571428571
119 O 0.16200000000000 0.43800000000000 0.78571428571429
120 O 0.03800000000000 0.56200000000000 0.78571428571429
121 Ti 0.00000000000000 0.40000000000000 0.85714285714286
122 Ti 0.10000000000000 0.50000000000000 0.92857142857143
123 O 0.06200000000000 0.46200000000000 0.85714285714286
124 O 0.13800000000000 0.53800000000000 0.85714285714286
125 O 0.16200000000000 0.43800000000000 0.92857142857143
126 O 0.03800000000000 0.56200000000000 0.92857142857143
127 Ti 0.00000000000000 0.60000000000000 0.00000000000000
128 Ti 0.10000000000000 0.70000000000000 0.07142857142857
129 O 0.06200000000000 0.66200000000000 0.00000000000000
130 O 0.13800000000000 0.73800000000000 0.00000000000000
131 O 0.16200000000000 0.63800000000000 0.07142857142857
132 O 0.03800000000000 0.76200000000000 0.07142857142857
133 Ti 0.00000000000000 0.60000000000000 0.14285714285714
134 Ti 0.10000000000000 0.70000000000000 0.21428571428571
135 O 0.06200000000000 0.66200000000000 0.14285714285714
136 O 0.13800000000000 0.73800000000000 0.14285714285714
137 O 0.16200000000000 0.63800000000000 0.21428571428571
138 O 0.03800000000000 0.76200000000000 0.21428571428571
139 Ti 0.00000000000000 0.60000000000000 0.28571428571429
140 Ti 0.10000000000000 0.70000000000000 0.35714285714286
141 O 0.06200000000000 0.66200000000000 0.28571428571429
142 O 0.13800000000000 0.73800000000000 0.28571428571429
143 O 0.16200000000000 0.63800000000000 0.35714285714286
144 O 0.03800000000000 0.76200000000000 0.35714285714286
145 Ti 0.00000000000000 0.60000000000000 0.42857142857143
146 Ti 0.10000000000000 0.70000000000000 0.50000000000000
147 O 0.06200000000000 0.66200000000000 0.42857142857143
148 O 0.13800000000000 0.73800000000000 0.42857142857143
149 O 0.16200000000000 0.63800000000000 0.50000000000000
150 O 0.03800000000000 0.76200000000000 0.50000000000000
151 Ti 0.00000000000000 0.60000000000000 0.57142857142857
152 Ti 0.10000000000000 0.70000000000000 0.64285714285714
153 O 0.06200000000000 0.66200000000000 0.57142857142857
154 O 0.13800000000000 0.73800000000000 0.57142857142857
155 O 0.16200000000000 0.63800000000000 0.64285714285714
156 O 0.03800000000000 0.76200000000000 0.64285714285714
157 Ti 0.00000000000000 0.60000000000000 0.71428571428571
158 Ti 0.10000000000000 0.70000000000000 0.78571428571429
159 O 0.06200000000000 0.66200000000000 0.71428571428571
160 O 0.13800000000000 0.73800000000000 0.71428571428571
161 O 0.16200000000000 0.63800000000000 0.78571428571429
162 O 0.03800000000000 0.76200000000000 0.78571428571429
163 Ti 0.00000000000000 0.60000000000000 0.85714285714286
164 Ti 0.10000000000000 0.70000000000000 0.92857142857143
165 O 0.06200000000000 0.66200000000000 0.85714285714286
166 O 0.13800000000000 0.73800000000000 0.85714285714286
167 O 0.16200000000000 0.63800000000000 0.92857142857143
168 O 0.03800000000000 0.76200000000000 0.92857142857143
169 Ti 0.00000000000000 0.80000000000000 0.00000000000000
170 Ti 0.10000000000000 0.90000000000000 0.07142857142857
171 O 0.06200000000000 0.86200000000000 0.00000000000000
172 O 0.13800000000000 0.93800000000000 0.00000000000000
173 O 0.16200000000000 0.83800000000000 0.07142857142857
174 O 0.03800000000000 0.96200000000000 0.07142857142857
175 Ti 0.00000000000000 0.80000000000000 0.14285714285714
176 Ti 0.10000000000000 0.90000000000000 0.21428571428571
177 O 0.06200000000000 0.86200000000000 0.14285714285714
178 O 0.13800000000000 0.93800000000000 0.14285714285714
179 O 0.16200000000000 0.83800000000000 0.21428571428571
180 O 0.03800000000000 0.96200000000000 0.21428571428571
181 Ti 0.00000000000000 0.80000000000000 0.28571428571429
182 Ti 0.10000000000000 0.90000000000000 0.35714285714286
183 O 0.06200000000000 0.86200000000000 0.28571428571429
184 O 0.13800000000000 0.93800000000000 0.28571428571429
185 O 0.16200000000000 0.83800000000000 0.35714285714286
186 O 0.03800000000000 0.96200000000000 0.35714285714286
187 Ti 0.00000000000000 0.80000000000000 0.42857142857143
188 Ti 0.10000000000000 0.90000000000000 0.50000000000000
189 O 0.06200000000000 0.86200000000000 0.42857142857143
190 O 0.13800000000000 0.93800000000000 0.42857142857143
191 O 0.16200000000000 0.83800000000000 0.50000000000000
192 O 0.03800000000000 0.96200000000000 0.50000000000000
193 Ti 0.00000000000000 0.80000000000000 0.57142857142857
194 Ti 0.10000000000000 0.90000000000000 0.64285714285714
195 O 0.06200000000000 0.86200000000000 0.57142857142857
196 O 0.13800000000000 0.93800000000000 0.57142857142857
197 O 0.16200000000000 0.83800000000000 0.64285714285714
198 O 0.03800000000000 0.96200000000000 0.64285714285714
199 Ti 0.00000000000000 0.80000000000000 0.71428571428571
200 Ti 0.10000000000000 0.90000000000000 0.78571428571429
201 O 0.06200000000000 0.86200000000000 0.71428571428571
202 O 0.13800000000000 0.93800000000000 0.71428571428571
203 O 0.16200000000000 0.83800000000000 0.78571428571429
204 O 0.03800000000000 0.96200000000000 0.78571428571429
205 Ti 0.00000000000000 0.80000000000000 0.85714285714286
206 Ti 0.10000000000000 0.90000000000000 0.92857142857143
207 O 0.06200000000000 0.86200000000000 0.85714285714286
208 O 0.13800000000000 0.93800000000000 0.85714285714286
209 O 0.16200000000000 0.83800000000000 0.92857142857143
210 O 0.03800000000000 0.96200000000000 0.92857142857143
211 Ti 0.20000000000000 0.00000000000000 0.00000000000000
212 Ti 0.30000000000000 0.10000000000000 0.07142857142857
213 O 0.26200000000000 0.06200000000000 0.00000000000000
214 O 0.33800000000000 0.13800000000000 0.00000000000000
215 O 0.36200000000000 0.03800000000000 0.07142857142857
216 O 0.23800000000000 0.16200000000000 0.07142857142857
217 Ti 0.20000000000000 0.00000000000000 0.14285714285714
218 Ti 0.30000000000000 0.10000000000000 0.21428571428571
219 O 0.26200000000000 0.06200000000000 0.14285714285714
220 O 0.33800000000000 0.13800000000000 0.14285714285714
221 O 0.36200000000000 0.03800000000000 0.21428571428571
222 O 0.23800000000000 0.16200000000000 0.21428571428571
223 Ti 0.20000000000000 0.00000000000000 0.28571428571429
224 Ti 0.30000000000000 0.10000000000000 0.35714285714286
225 O 0.26200000000000 0.06200000000000 0.28571428571429
226 O 0.33800000000000 0.13800000000000 0.28571428571429
227 O 0.36200000000000 0.03800000000000 0.35714285714286
228 O 0.23800000000000 0.16200000000000 0.35714285714286
229 Ti 0.20000000000000 0.00000000000000 0.42857142857143
230 Ti 0.30000000000000 0.10000000000000 0.50000000000000
231 O 0.26200000000000 0.06200000000000 0.42857142857143
232 O 0.33800000000000 0.13800000000000 0.42857142857143
233 O 0.36200000000000 0.03800000000000 0.50000000000000
234 O 0.23800000000000 0.16200000000000 0.50000000000000
235 Ti 0.20000000000000 0.00000000000000 0.57142857142857
236 Ti 0.30000000000000 0.10000000000000 0.64285714285714
237 O 0.26200000000000 0.06200000000000 0.57142857142857
238 O 0.33800000000000 0.13800000000000 0.57142857142857
239 O 0.36200000000000 0.03800000000000 0.64285714285714
240 O 0.23800000000000 0.16200000000000 0.64285714285714
241 Ti 0.20000000000000 0.00000000000000 0.71428571428571
242 Ti 0.30000000000000 0.10000000000000 0.78571428571429
243 O 0.26200000000000 0.06200000000000 0.71428571428571
244 O 0.33800000000000 0.13800000000000 0.71428571428571
245 O 0.36200000000000 0.03800000000000 0.78571428571429
246 O 0.23800000000000 0.16200000000000 0.78571428571429
247 Ti 0.20000000000000 0.00000000000000 0.85714285714286
248 Ti 0.30000000000000 0.10000000000000 0.92857142857143
249 O 0.26200000000000 0.06200000000000 0.85714285714286
250 O 0.33800000000000 0.13800000000000 0.85714285714286
251 O 0.36200000000000 0.03800000000000 0.92857142857143
252 O 0.23800000000000 0.16200000000000 0.92857142857143
253 Ti 0.20000000000000 0.20000000000000 0.00000000000000
254 Ti 0.30000000000000 0.30000000000000 0.07142857142857
255 O 0.26200000000000 0.26200000000000 0.00000000000000
256 O 0.33800000000000 0.33800000000000 0.00000000000000
257 O 0.36200000000000 0.23800000000000 0.07142857142857
258 O 0.23800000000000 0.36200000000000 0.07142857142857
259 Ti 0.20000000000000 0.20000000000000 0.14285714285714
260 Ti 0.30000000000000 0.30000000000000 0.21428571428571
261 O 0.26200000000000 0.26200000000000 0.14285714285714
262 O 0.33800000000000 0.33800000000000 0.14285714285714
263 O 0.36200000000000 0.23800000000000 0.21428571428571
264 O 0.23800000000000 0.36200000000000 0.21428571428571
265 Ti 0.20000000000000 0.20000000000000 0.28571428571429
266 Ti 0.30000000000000 0.30000000000000 0.35714285714286
267 O 0.26200000000000 0.26200000000000 0.28571428571429
268 O 0.33800000000000 0.33800000000000 0.28571428571429
269 O 0.36200000000000 0.23800000000000 0.35714285714286
270 O 0.23800000000000 0.36200000000000 0.35714285714286
271 Ti 0.20000000000000 0.20000000000000 0.42857142857143
272 Ti 0.30000000000000 0.30000000000000 0.50000000000000
273 O 0.26200000000000 0.26200000000000 0.42857142857143
274 O 0.33800000000000 0.33800000000000 0.42857142857143
275 O 0.36200000000000 0.23800000000000 0.50000000000000
276 O 0.23800000000000 0.36200000000000 0.50000000000000
277 Ti 0.20000000000000 0.20000000000000 0.57142857142857
278 Ti 0.30000000000000 0.30000000000000 0.64285714285714
279 O 0.26200000000000 0.26200000000000 0.57142857142857
280 O 0.33800000000000 0.33800000000000 0.57142857142857
281 O 0.36200000000000 0.23800000000000 0.64285714285714
282 O 0.23800000000000 0.36200000000000 0.64285714285714
283 Ti 0.20000000000000 0.20000000000000 0.71428571428571
284 Ti 0.30000000000000 0.30000000000000 0.78571428571429
285 O 0.26200000000000 0.26200000000000 0.71428571428571
286 O 0.33800000000000 0.33800000000000 0.71428571428571
287 O 0.36200000000000 0.23800000000000 0.78571428571429
288 O 0.23800000000000 0.36200000000000 0.78571428571429
289 Ti 0.20000000000000 0.20000000000000 0.85714285714286
290 Ti 0.30000000000000 0.30000000000000 0.92857142857143
291 O 0.26200000000000 0.26200000000000 0.85714285714286
292 O 0.33800000000000 0.33800000000000 0.85714285714286
293 O 0.36200000000000 0.23800000000000 0.92857142857143
294 O 0.23800000000000 0.36200000000000 0.92857142857143
295 Ti 0.20000000000000 0.40000000000000 0.00000000000000
296 Ti 0.30000000000000 0.50000000000000 0.07142857142857
297 O 0.26200000000000 0.46200000000000 0.00000000000000
298 O 0.33800000000000 0.53800000000000 0.00000000000000
299 O 0.36200000000000 0.43800000000000 0.07142857142857
300 O 0.23800000000000 0.56200000000000 0.07142857142857
301 Ti 0.20000000000000 0.40000000000000 0.14285714285714
302 Ti 0.30000000000000 0.50000000000000 0.21428571428571
303 O 0.26200000000000 0.46200000000000 0.14285714285714
304 O 0.33800000000000 0.53800000000000 0.14285714285714
305 O 0.36200000000000 0.43800000000000 0.21428571428571
306 O 0.23800000000000 0.56200000000000 0.21428571428571
307 Ti 0.20000000000000 0.40000000000000 0.28571428571429
308 Ti 0.30000000000000 0.50000000000000 0.35714285714286
309 O 0.26200000000000 0.46200000000000 0.28571428571429
310 O 0.33800000000000 0.53800000000000 0.28571428571429
311 O 0.36200000000000 0.43800000000000 0.35714285714286
312 O 0.23800000000000 0.56200000000000 0.35714285714286
313 Ti 0.20000000000000 0.40000000000000 0.42857142857143
314 Ti 0.30000000000000 0.50000000000000 0.50000000000000
315 O 0.26200000000000 0.46200000000000 0.42857142857143
316 O 0.33800000000000 0.53800000000000 0.42857142857143
317 O 0.36200000000000 0.43800000000000 0.50000000000000
318 O 0.23800000000000 0.56200000000000 0.50000000000000
319 Ti 0.20000000000000 0.40000000000000 0.57142857142857
320 Ti 0.30000000000000 0.50000000000000 0.64285714285714
321 O 0.26200000000000 0.46200000000000 0.57142857142857
322 O 0.33800000000000 0.53800000000000 0.57142857142857
323 O 0.36200000000000 0.43800000000000 0.64285714285714
324 O 0.23800000000000 0.56200000000000 0.64285714285714
325 Ti 0.20000000000000 0.40000000000000 0.71428571428571
326 Ti 0.30000000000000 0.50000000000000 0.78571428571429
327 O 0.26200000000000 0.46200000000000 0.71428571428571
328 O 0.33800000000000 0.53800000000000 0.71428571428571
329 O 0.36200000000000 0.43800000000000 0.78571428571429
330 O 0.23800000000000 0.56200000000000 0.78571428571429
331 Ti 0.20000000000000 0.40000000000000 0.85714285714286
332 Ti 0.30000000000000 0.50000000000000 0.92857142857143
333 O 0.26200000000000 0.46200000000000 0.85714285714286
334 O 0.33800000000000 0.53800000000000 0.85714285714286
335 O 0.36200000000000 0.43800000000000 0.92857142857143
336 O 0.23800000000000 0.56200000000000 0.92857142857143
337 Ti 0.20000000000000 0.60000000000000 0.00000000000000
338 Ti 0.30000000000000 0.70000000000000 0.07142857142857
339 O 0.26200000000000 0.66200000000000 0.00000000000000
340 O 0.33800000000000 0.73800000000000 0.00000000000000
341 O 0.36200000000000 0.63800000000000 0.07142857142857
342 O 0.23800000000000 0.76200000000000 0.07142857142857
343 Ti 0.20000000000000 0.60000000000000 0.14285714285714
344 Ti 0.30000000000000 0.70000000000000 0.21428571428571
345 O 0.26200000000000 0.66200000000000 0.14285714285714
346 O 0.33800000000000 0.73800000000000 0.14285714285714
347 O 0.36200000000000 0.63800000000000 0.21428571428571
348 O 0.23800000000000 0.76200000000000 0.21428571428571
349 Ti 0.20000000000000 0.60000000000000 0.28571428571429
350 Ti 0.30000000000000 0.70000000000000 0.35714285714286
351 O 0.26200000000000 0.66200000000000 0.28571428571429
352 O 0.33800000000000 0.73800000000000 0.28571428571429
353 O 0.36200000000000 0.63800000000000 0.35714285714286
354 O 0.23800000000000 0.76200000000000 0.35714285714286
355 Ti 0.20000000000000 0.60000000000000 0.42857142857143
356 Ti 0.30000000000000 0.70000000000000 0.50000000000000
357 O 0.26200000000000 0.66200000000000 0.42857142857143
358 O 0.33800000000000 0.73800000000000 0.42857142857143
359 O 0.36200000000000 0.63800000000000 0.50000000000000
360 O 0.23800000000000 0.76200000000000 0.50000000000000
361 Ti 0.20000000000000 0.60000000000000 0.57142857142857
362 Ti 0.30000000000000 0.70000000000000 0.64285714285714
363 O 0.26200000000000 0.66200000000000 0.57142857142857
364 O 0.33800000000000 0.73800000000000 0.57142857142857
365 O 0.36200000000000 0.63800000000000 0.64285714285714
366 O 0.23800000000000 0.76200000000000 0.64285714285714
367 Ti 0.20000000000000 0.60000000000000 0.71428571428571
368 Ti 0.30000000000000 0.70000000000000 0.78571428571429
369 O 0.26200000000000 0.66200000000000 0.71428571428571
370 O 0.33800000000000 0.73800000000000 0.71428571428571
371 O 0.36200000000000 0.63800000000000 0.78571428571429
372 O 0.23800000000000 0.76200000000000 0.78571428571429
373 Ti 0.20000000000000 0.60000000000000 0.85714285714286
374 Ti 0.30000000000000 0.70000000000000 0.92857142857143
375 O 0.26200000000000 0.66200000000000 0.85714285714286
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414 O 0.23800000000000 0.96200000000000 0.78571428571429
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432 O 0.43800000000000 0.16200000000000 0.21428571428571
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452 Ti 0.50000000000000 0.10000000000000 0.78571428571429
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456 O 0.43800000000000 0.16200000000000 0.78571428571429
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472 O 0.53800000000000 0.33800000000000 0.14285714285714
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474 O 0.43800000000000 0.36200000000000 0.21428571428571
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480 O 0.43800000000000 0.36200000000000 0.35714285714286
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484 O 0.53800000000000 0.33800000000000 0.42857142857143
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492 O 0.43800000000000 0.36200000000000 0.64285714285714
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496 O 0.53800000000000 0.33800000000000 0.71428571428571
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498 O 0.43800000000000 0.36200000000000 0.78571428571429
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512 Ti 0.50000000000000 0.50000000000000 0.21428571428571
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514 O 0.53800000000000 0.53800000000000 0.14285714285714
515 O 0.56200000000000 0.43800000000000 0.21428571428571
516 O 0.43800000000000 0.56200000000000 0.21428571428571
517 Ti 0.40000000000000 0.40000000000000 0.28571428571429
518 Ti 0.50000000000000 0.50000000000000 0.35714285714286
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520 O 0.53800000000000 0.53800000000000 0.28571428571429
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522 O 0.43800000000000 0.56200000000000 0.35714285714286
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524 Ti 0.50000000000000 0.50000000000000 0.50000000000000
525 O 0.46200000000000 0.46200000000000 0.42857142857143
526 O 0.53800000000000 0.53800000000000 0.42857142857143
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528 O 0.43800000000000 0.56200000000000 0.50000000000000
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531 O 0.46200000000000 0.46200000000000 0.57142857142857
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534 O 0.43800000000000 0.56200000000000 0.64285714285714
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536 Ti 0.50000000000000 0.50000000000000 0.78571428571429
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538 O 0.53800000000000 0.53800000000000 0.71428571428571
539 O 0.56200000000000 0.43800000000000 0.78571428571429
540 O 0.43800000000000 0.56200000000000 0.78571428571429
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546 O 0.43800000000000 0.56200000000000 0.92857142857143
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552 O 0.43800000000000 0.76200000000000 0.07142857142857
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554 Ti 0.50000000000000 0.70000000000000 0.21428571428571
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558 O 0.43800000000000 0.76200000000000 0.21428571428571
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576 O 0.43800000000000 0.76200000000000 0.64285714285714
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600 O 0.43800000000000 0.96200000000000 0.21428571428571
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621 O 0.46200000000000 0.86200000000000 0.71428571428571
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728 Ti 0.70000000000000 0.50000000000000 0.35714285714286
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734 Ti 0.70000000000000 0.50000000000000 0.50000000000000
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741 O 0.66200000000000 0.46200000000000 0.57142857142857
742 O 0.73800000000000 0.53800000000000 0.57142857142857
743 O 0.76200000000000 0.43800000000000 0.64285714285714
744 O 0.63800000000000 0.56200000000000 0.64285714285714
745 Ti 0.60000000000000 0.40000000000000 0.71428571428571
746 Ti 0.70000000000000 0.50000000000000 0.78571428571429
747 O 0.66200000000000 0.46200000000000 0.71428571428571
748 O 0.73800000000000 0.53800000000000 0.71428571428571
749 O 0.76200000000000 0.43800000000000 0.78571428571429
750 O 0.63800000000000 0.56200000000000 0.78571428571429
751 Ti 0.60000000000000 0.40000000000000 0.85714285714286
752 Ti 0.70000000000000 0.50000000000000 0.92857142857143
753 O 0.66200000000000 0.46200000000000 0.85714285714286
754 O 0.73800000000000 0.53800000000000 0.85714285714286
755 O 0.76200000000000 0.43800000000000 0.92857142857143
756 O 0.63800000000000 0.56200000000000 0.92857142857143
757 Ti 0.60000000000000 0.60000000000000 0.00000000000000
758 Ti 0.70000000000000 0.70000000000000 0.07142857142857
759 O 0.66200000000000 0.66200000000000 0.00000000000000
760 O 0.73800000000000 0.73800000000000 0.00000000000000
761 O 0.76200000000000 0.63800000000000 0.07142857142857
762 O 0.63800000000000 0.76200000000000 0.07142857142857
763 Ti 0.60000000000000 0.60000000000000 0.14285714285714
764 Ti 0.70000000000000 0.70000000000000 0.21428571428571
765 O 0.66200000000000 0.66200000000000 0.14285714285714
766 O 0.73800000000000 0.73800000000000 0.14285714285714
767 O 0.76200000000000 0.63800000000000 0.21428571428571
768 O 0.63800000000000 0.76200000000000 0.21428571428571
769 Ti 0.60000000000000 0.60000000000000 0.28571428571429
770 Ti 0.70000000000000 0.70000000000000 0.35714285714286
771 O 0.66200000000000 0.66200000000000 0.28571428571429
772 O 0.73800000000000 0.73800000000000 0.28571428571429
773 O 0.76200000000000 0.63800000000000 0.35714285714286
774 O 0.63800000000000 0.76200000000000 0.35714285714286
775 Ti 0.60000000000000 0.60000000000000 0.42857142857143
776 Ti 0.70000000000000 0.70000000000000 0.50000000000000
777 O 0.66200000000000 0.66200000000000 0.42857142857143
778 O 0.73800000000000 0.73800000000000 0.42857142857143
779 O 0.76200000000000 0.63800000000000 0.50000000000000
780 O 0.63800000000000 0.76200000000000 0.50000000000000
781 Ti 0.60000000000000 0.60000000000000 0.57142857142857
782 Ti 0.70000000000000 0.70000000000000 0.64285714285714
783 O 0.66200000000000 0.66200000000000 0.57142857142857
784 O 0.73800000000000 0.73800000000000 0.57142857142857
785 O 0.76200000000000 0.63800000000000 0.64285714285714
786 O 0.63800000000000 0.76200000000000 0.64285714285714
787 Ti 0.60000000000000 0.60000000000000 0.71428571428571
788 Ti 0.70000000000000 0.70000000000000 0.78571428571429
789 O 0.66200000000000 0.66200000000000 0.71428571428571
790 O 0.73800000000000 0.73800000000000 0.71428571428571
791 O 0.76200000000000 0.63800000000000 0.78571428571429
792 O 0.63800000000000 0.76200000000000 0.78571428571429
793 Ti 0.60000000000000 0.60000000000000 0.85714285714286
794 Ti 0.70000000000000 0.70000000000000 0.92857142857143
795 O 0.66200000000000 0.66200000000000 0.85714285714286
796 O 0.73800000000000 0.73800000000000 0.85714285714286
797 O 0.76200000000000 0.63800000000000 0.92857142857143
798 O 0.63800000000000 0.76200000000000 0.92857142857143
799 Ti 0.60000000000000 0.80000000000000 0.00000000000000
800 Ti 0.70000000000000 0.90000000000000 0.07142857142857
801 O 0.66200000000000 0.86200000000000 0.00000000000000
802 O 0.73800000000000 0.93800000000000 0.00000000000000
803 O 0.76200000000000 0.83800000000000 0.07142857142857
804 O 0.63800000000000 0.96200000000000 0.07142857142857
805 Ti 0.60000000000000 0.80000000000000 0.14285714285714
806 Ti 0.70000000000000 0.90000000000000 0.21428571428571
807 O 0.66200000000000 0.86200000000000 0.14285714285714
808 O 0.73800000000000 0.93800000000000 0.14285714285714
809 O 0.76200000000000 0.83800000000000 0.21428571428571
810 O 0.63800000000000 0.96200000000000 0.21428571428571
811 Ti 0.60000000000000 0.80000000000000 0.28571428571429
812 Ti 0.70000000000000 0.90000000000000 0.35714285714286
813 O 0.66200000000000 0.86200000000000 0.28571428571429
814 O 0.73800000000000 0.93800000000000 0.28571428571429
815 O 0.76200000000000 0.83800000000000 0.35714285714286
816 O 0.63800000000000 0.96200000000000 0.35714285714286
817 Ti 0.60000000000000 0.80000000000000 0.42857142857143
818 Ti 0.70000000000000 0.90000000000000 0.50000000000000
819 O 0.66200000000000 0.86200000000000 0.42857142857143
820 O 0.73800000000000 0.93800000000000 0.42857142857143
821 O 0.76200000000000 0.83800000000000 0.50000000000000
822 O 0.63800000000000 0.96200000000000 0.50000000000000
823 Ti 0.60000000000000 0.80000000000000 0.57142857142857
824 Ti 0.70000000000000 0.90000000000000 0.64285714285714
825 O 0.66200000000000 0.86200000000000 0.57142857142857
826 O 0.73800000000000 0.93800000000000 0.57142857142857
827 O 0.76200000000000 0.83800000000000 0.64285714285714
828 O 0.63800000000000 0.96200000000000 0.64285714285714
829 Ti 0.60000000000000 0.80000000000000 0.71428571428571
830 Ti 0.70000000000000 0.90000000000000 0.78571428571429
831 O 0.66200000000000 0.86200000000000 0.71428571428571
832 O 0.73800000000000 0.93800000000000 0.71428571428571
833 O 0.76200000000000 0.83800000000000 0.78571428571429
834 O 0.63800000000000 0.96200000000000 0.78571428571429
835 Ti 0.60000000000000 0.80000000000000 0.85714285714286
836 Ti 0.70000000000000 0.90000000000000 0.92857142857143
837 O 0.66200000000000 0.86200000000000 0.85714285714286
838 O 0.73800000000000 0.93800000000000 0.85714285714286
839 O 0.76200000000000 0.83800000000000 0.92857142857143
840 O 0.63800000000000 0.96200000000000 0.92857142857143
841 Ti 0.80000000000000 0.00000000000000 0.00000000000000
842 Ti 0.90000000000000 0.10000000000000 0.07142857142857
843 O 0.86200000000000 0.06200000000000 0.00000000000000
844 O 0.93800000000000 0.13800000000000 0.00000000000000
845 O 0.96200000000000 0.03800000000000 0.07142857142857
846 O 0.83800000000000 0.16200000000000 0.07142857142857
847 Ti 0.80000000000000 0.00000000000000 0.14285714285714
848 Ti 0.90000000000000 0.10000000000000 0.21428571428571
849 O 0.86200000000000 0.06200000000000 0.14285714285714
850 O 0.93800000000000 0.13800000000000 0.14285714285714
851 O 0.96200000000000 0.03800000000000 0.21428571428571
852 O 0.83800000000000 0.16200000000000 0.21428571428571
853 Ti 0.80000000000000 0.00000000000000 0.28571428571429
854 Ti 0.90000000000000 0.10000000000000 0.35714285714286
855 O 0.86200000000000 0.06200000000000 0.28571428571429
856 O 0.93800000000000 0.13800000000000 0.28571428571429
857 O 0.96200000000000 0.03800000000000 0.35714285714286
858 O 0.83800000000000 0.16200000000000 0.35714285714286
859 Ti 0.80000000000000 0.00000000000000 0.42857142857143
860 Ti 0.90000000000000 0.10000000000000 0.50000000000000
861 O 0.86200000000000 0.06200000000000 0.42857142857143
862 O 0.93800000000000 0.13800000000000 0.42857142857143
863 O 0.96200000000000 0.03800000000000 0.50000000000000
864 O 0.83800000000000 0.16200000000000 0.50000000000000
865 Ti 0.80000000000000 0.00000000000000 0.57142857142857
866 Ti 0.90000000000000 0.10000000000000 0.64285714285714
867 O 0.86200000000000 0.06200000000000 0.57142857142857
868 O 0.93800000000000 0.13800000000000 0.57142857142857
869 O 0.96200000000000 0.03800000000000 0.64285714285714
870 O 0.83800000000000 0.16200000000000 0.64285714285714
871 Ti 0.80000000000000 0.00000000000000 0.71428571428571
872 Ti 0.90000000000000 0.10000000000000 0.78571428571429
873 O 0.86200000000000 0.06200000000000 0.71428571428571
874 O 0.93800000000000 0.13800000000000 0.71428571428571
875 O 0.96200000000000 0.03800000000000 0.78571428571429
876 O 0.83800000000000 0.16200000000000 0.78571428571429
877 Ti 0.80000000000000 0.00000000000000 0.85714285714286
878 Ti 0.90000000000000 0.10000000000000 0.92857142857143
879 O 0.86200000000000 0.06200000000000 0.85714285714286
880 O 0.93800000000000 0.13800000000000 0.85714285714286
881 O 0.96200000000000 0.03800000000000 0.92857142857143
882 O 0.83800000000000 0.16200000000000 0.92857142857143
883 Ti 0.80000000000000 0.20000000000000 0.00000000000000
884 Ti 0.90000000000000 0.30000000000000 0.07142857142857
885 O 0.86200000000000 0.26200000000000 0.00000000000000
886 O 0.93800000000000 0.33800000000000 0.00000000000000
887 O 0.96200000000000 0.23800000000000 0.07142857142857
888 O 0.83800000000000 0.36200000000000 0.07142857142857
889 Ti 0.80000000000000 0.20000000000000 0.14285714285714
890 Ti 0.90000000000000 0.30000000000000 0.21428571428571
891 O 0.86200000000000 0.26200000000000 0.14285714285714
892 O 0.93800000000000 0.33800000000000 0.14285714285714
893 O 0.96200000000000 0.23800000000000 0.21428571428571
894 O 0.83800000000000 0.36200000000000 0.21428571428571
895 Ti 0.80000000000000 0.20000000000000 0.28571428571429
896 Ti 0.90000000000000 0.30000000000000 0.35714285714286
897 O 0.86200000000000 0.26200000000000 0.28571428571429
898 O 0.93800000000000 0.33800000000000 0.28571428571429
899 O 0.96200000000000 0.23800000000000 0.35714285714286
900 O 0.83800000000000 0.36200000000000 0.35714285714286
901 Ti 0.80000000000000 0.20000000000000 0.42857142857143
902 Ti 0.90000000000000 0.30000000000000 0.50000000000000
903 O 0.86200000000000 0.26200000000000 0.42857142857143
904 O 0.93800000000000 0.33800000000000 0.42857142857143
905 O 0.96200000000000 0.23800000000000 0.50000000000000
906 O 0.83800000000000 0.36200000000000 0.50000000000000
907 Ti 0.80000000000000 0.20000000000000 0.57142857142857
908 Ti 0.90000000000000 0.30000000000000 0.64285714285714
909 O 0.86200000000000 0.26200000000000 0.57142857142857
910 O 0.93800000000000 0.33800000000000 0.57142857142857
911 O 0.96200000000000 0.23800000000000 0.64285714285714
912 O 0.83800000000000 0.36200000000000 0.64285714285714
913 Ti 0.80000000000000 0.20000000000000 0.71428571428571
914 Ti 0.90000000000000 0.30000000000000 0.78571428571429
915 O 0.86200000000000 0.26200000000000 0.71428571428571
916 O 0.93800000000000 0.33800000000000 0.71428571428571
917 O 0.96200000000000 0.23800000000000 0.78571428571429
918 O 0.83800000000000 0.36200000000000 0.78571428571429
919 Ti 0.80000000000000 0.20000000000000 0.85714285714286
920 Ti 0.90000000000000 0.30000000000000 0.92857142857143
921 O 0.86200000000000 0.26200000000000 0.85714285714286
922 O 0.93800000000000 0.33800000000000 0.85714285714286
923 O 0.96200000000000 0.23800000000000 0.92857142857143
924 O 0.83800000000000 0.36200000000000 0.92857142857143
925 Ti 0.80000000000000 0.40000000000000 0.00000000000000
926 Ti 0.90000000000000 0.50000000000000 0.07142857142857
927 O 0.86200000000000 0.46200000000000 0.00000000000000
928 O 0.93800000000000 0.53800000000000 0.00000000000000
929 O 0.96200000000000 0.43800000000000 0.07142857142857
930 O 0.83800000000000 0.56200000000000 0.07142857142857
931 Ti 0.80000000000000 0.40000000000000 0.14285714285714
932 Ti 0.90000000000000 0.50000000000000 0.21428571428571
933 O 0.86200000000000 0.46200000000000 0.14285714285714
934 O 0.93800000000000 0.53800000000000 0.14285714285714
935 O 0.96200000000000 0.43800000000000 0.21428571428571
936 O 0.83800000000000 0.56200000000000 0.21428571428571
937 Ti 0.80000000000000 0.40000000000000 0.28571428571429
938 Ti 0.90000000000000 0.50000000000000 0.35714285714286
939 O 0.86200000000000 0.46200000000000 0.28571428571429
940 O 0.93800000000000 0.53800000000000 0.28571428571429
941 O 0.96200000000000 0.43800000000000 0.35714285714286
942 O 0.83800000000000 0.56200000000000 0.35714285714286
943 Ti 0.80000000000000 0.40000000000000 0.42857142857143
944 Ti 0.90000000000000 0.50000000000000 0.50000000000000
945 O 0.86200000000000 0.46200000000000 0.42857142857143
946 O 0.93800000000000 0.53800000000000 0.42857142857143
947 O 0.96200000000000 0.43800000000000 0.50000000000000
948 O 0.83800000000000 0.56200000000000 0.50000000000000
949 Ti 0.80000000000000 0.40000000000000 0.57142857142857
950 Ti 0.90000000000000 0.50000000000000 0.64285714285714
951 O 0.86200000000000 0.46200000000000 0.57142857142857
952 O 0.93800000000000 0.53800000000000 0.57142857142857
953 O 0.96200000000000 0.43800000000000 0.64285714285714
954 O 0.83800000000000 0.56200000000000 0.64285714285714
955 Ti 0.80000000000000 0.40000000000000 0.71428571428571
956 Ti 0.90000000000000 0.50000000000000 0.78571428571429
957 O 0.86200000000000 0.46200000000000 0.71428571428571
958 O 0.93800000000000 0.53800000000000 0.71428571428571
959 O 0.96200000000000 0.43800000000000 0.78571428571429
960 O 0.83800000000000 0.56200000000000 0.78571428571429
961 Ti 0.80000000000000 0.40000000000000 0.85714285714286
962 Ti 0.90000000000000 0.50000000000000 0.92857142857143
963 O 0.86200000000000 0.46200000000000 0.85714285714286
964 O 0.93800000000000 0.53800000000000 0.85714285714286
965 O 0.96200000000000 0.43800000000000 0.92857142857143
966 O 0.83800000000000 0.56200000000000 0.92857142857143
967 Ti 0.80000000000000 0.60000000000000 0.00000000000000
968 Ti 0.90000000000000 0.70000000000000 0.07142857142857
969 O 0.86200000000000 0.66200000000000 0.00000000000000
970 O 0.93800000000000 0.73800000000000 0.00000000000000
971 O 0.96200000000000 0.63800000000000 0.07142857142857
972 O 0.83800000000000 0.76200000000000 0.07142857142857
973 Ti 0.80000000000000 0.60000000000000 0.14285714285714
974 Ti 0.90000000000000 0.70000000000000 0.21428571428571
975 O 0.86200000000000 0.66200000000000 0.14285714285714
976 O 0.93800000000000 0.73800000000000 0.14285714285714
977 O 0.96200000000000 0.63800000000000 0.21428571428571
978 O 0.83800000000000 0.76200000000000 0.21428571428571
979 Ti 0.80000000000000 0.60000000000000 0.28571428571429
980 Ti 0.90000000000000 0.70000000000000 0.35714285714286
981 O 0.86200000000000 0.66200000000000 0.28571428571429
982 O 0.93800000000000 0.73800000000000 0.28571428571429
983 O 0.96200000000000 0.63800000000000 0.35714285714286
984 O 0.83800000000000 0.76200000000000 0.35714285714286
985 Ti 0.80000000000000 0.60000000000000 0.42857142857143
986 Ti 0.90000000000000 0.70000000000000 0.50000000000000
987 O 0.86200000000000 0.66200000000000 0.42857142857143
988 O 0.93800000000000 0.73800000000000 0.42857142857143
989 O 0.96200000000000 0.63800000000000 0.50000000000000
990 O 0.83800000000000 0.76200000000000 0.50000000000000
991 Ti 0.80000000000000 0.60000000000000 0.57142857142857
992 Ti 0.90000000000000 0.70000000000000 0.64285714285714
993 O 0.86200000000000 0.66200000000000 0.57142857142857
994 O 0.93800000000000 0.73800000000000 0.57142857142857
995 O 0.96200000000000 0.63800000000000 0.64285714285714
996 O 0.83800000000000 0.76200000000000 0.64285714285714
997 Ti 0.80000000000000 0.60000000000000 0.71428571428571
998 Ti 0.90000000000000 0.70000000000000 0.78571428571429
999 O 0.86200000000000 0.66200000000000 0.71428571428571
1000 O 0.93800000000000 0.73800000000000 0.71428571428571
1001 O 0.96200000000000 0.63800000000000 0.78571428571429
1002 O 0.83800000000000 0.76200000000000 0.78571428571429
1003 Ti 0.80000000000000 0.60000000000000 0.85714285714286
1004 Ti 0.90000000000000 0.70000000000000 0.92857142857143
1005 O 0.86200000000000 0.66200000000000 0.85714285714286
1006 O 0.93800000000000 0.73800000000000 0.85714285714286
1007 O 0.96200000000000 0.63800000000000 0.92857142857143
1008 O 0.83800000000000 0.76200000000000 0.92857142857143
1009 Ti 0.80000000000000 0.80000000000000 0.00000000000000
1010 Ti 0.90000000000000 0.90000000000000 0.07142857142857
1011 O 0.86200000000000 0.86200000000000 0.00000000000000
1012 O 0.93800000000000 0.93800000000000 0.00000000000000
1013 O 0.96200000000000 0.83800000000000 0.07142857142857
1014 O 0.83800000000000 0.96200000000000 0.07142857142857
1015 Ti 0.80000000000000 0.80000000000000 0.14285714285714
1016 Ti 0.90000000000000 0.90000000000000 0.21428571428571
1017 O 0.86200000000000 0.86200000000000 0.14285714285714
1018 O 0.93800000000000 0.93800000000000 0.14285714285714
1019 O 0.96200000000000 0.83800000000000 0.21428571428571
1020 O 0.83800000000000 0.96200000000000 0.21428571428571
1021 Ti 0.80000000000000 0.80000000000000 0.28571428571429
1022 Ti 0.90000000000000 0.90000000000000 0.35714285714286
1023 O 0.86200000000000 0.86200000000000 0.28571428571429
1024 O 0.93800000000000 0.93800000000000 0.28571428571429
1025 O 0.96200000000000 0.83800000000000 0.35714285714286
1026 O 0.83800000000000 0.96200000000000 0.35714285714286
1027 Ti 0.80000000000000 0.80000000000000 0.42857142857143
1028 Ti 0.90000000000000 0.90000000000000 0.50000000000000
1029 O 0.86200000000000 0.86200000000000 0.42857142857143
1030 O 0.93800000000000 0.93800000000000 0.42857142857143
1031 O 0.96200000000000 0.83800000000000 0.50000000000000
1032 O 0.83800000000000 0.96200000000000 0.50000000000000
1033 Ti 0.80000000000000 0.80000000000000 0.57142857142857
1034 Ti 0.90000000000000 0.90000000000000 0.64285714285714
1035 O 0.86200000000000 0.86200000000000 0.57142857142857
1036 O 0.93800000000000 0.93800000000000 0.57142857142857
1037 O 0.96200000000000 0.83800000000000 0.64285714285714
1038 O 0.83800000000000 0.96200000000000 0.64285714285714
1039 Ti 0.80000000000000 0.80000000000000 0.71428571428571
1040 Ti 0.90000000000000 0.90000000000000 0.78571428571429
1041 O 0.86200000000000 0.86200000000000 0.71428571428571
1042 O 0.93800000000000 0.93800000000000 0.71428571428571
1043 O 0.96200000000000 0.83800000000000 0.78571428571429
1044 O 0.83800000000000 0.96200000000000 0.78571428571429
1045 Ti 0.80000000000000 0.80000000000000 0.85714285714286
1046 Ti 0.90000000000000 0.90000000000000 0.92857142857143
1047 O 0.86200000000000 0.86200000000000 0.85714285714286
1048 O 0.93800000000000 0.93800000000000 0.85714285714286
1049 O 0.96200000000000 0.83800000000000 0.92857142857143
1050 O 0.83800000000000 0.96200000000000 0.92857142857143
***********************************************************
***********************************************************
Computational Time (second)
***********************************************************
***********************************************************
Elapsed.Time. 2155.750
Min_ID Min_Time Max_ID Max_Time
Total Computational Time = 258 2155.704 0 2155.750
readfile = 25 1.918 0 1.918
truncation = 0 0.000 0 0.000
MD_pac = 0 0.007 46 0.019
OutData = 197 0.000 0 0.043
DFT = 126 2151.094 66 2151.206
*** In DFT ***
Set_OLP_Kin = 132 1.611 99 3.879
Set_Nonlocal = 99 7.099 132 9.374
Set_ProExpn_VNA = 198 20.934 5 22.116
Set_Hamiltonian = 205 46.315 68 46.316
Poisson = 31 0.545 136 0.546
Diagonalization = 252 2005.472 148 2005.474
Mixing_DM = 98 1.870 212 1.871
Force = 254 34.001 152 34.001
Total_Energy = 212 3.949 0 3.951
Set_Aden_Grid = 5 0.078 198 1.259
Set_Orbitals_Grid = 66 0.217 9 0.638
Set_Density_Grid = 197 22.652 110 23.314
RestartFileDFT = 204 0.380 119 0.415
Mulliken_Charge = 133 0.322 0 0.328
FFT(2D)_Density = 200 0.566 157 0.566
Others = 9 0.671 198 1.679
|