1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84
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# GeH_4 r=1.00 /AA Feff 8.20x8
# POT SCF 30 3.0000 1, NO core-hole, AFOLP (folp(0)= 1.150)
# Abs Z=32 Rmt= 1.356 Rnm= 1.715 K shell
# RPHASES
# Pot 1 Z= 1 Rmt= 0.863 Rnm= 1.091
# Gam_ch=2.284E+00 H-L exch
# Mu=-6.502E+00 kf=1.545E+00 Vint=-9.267E+00 Rs_int= 2.348
# FMS rfms= 3.0000
# PATH Rmax= 1.000, Keep_limit= 0.00, Heap_limit 0.00 Pwcrit= 2.50%
# S02=1.000 Global_sig2= 0.00000
# Curved wave amplitude ratio filter 4.000%
# file sig2 tot cw amp ratio deg nlegs reff inp sig2
# 0/ 0 paths used
# xsedge+ 50, used to normalize mu 2.0390E-04
# -----------------------------------------------------------------------
# e, e(wrt edge), k, mu=(1+chi)*mu0, mu0, chi @#
11066.683 -50.545 -3.400 8.15365E-03 8.79865E-03 -6.45002E-04
11075.051 -42.177 -3.060 1.03623E-02 1.13731E-02 -1.01079E-03
11082.538 -34.690 -2.720 1.34977E-02 1.51664E-02 -1.66870E-03
11089.145 -28.083 -2.380 1.81255E-02 2.10602E-02 -2.93467E-03
11094.870 -22.358 -2.040 2.52834E-02 3.08605E-02 -5.57705E-03
11099.715 -17.513 -1.700 3.69959E-02 4.86619E-02 -1.16660E-02
11103.679 -13.549 -1.360 5.75078E-02 8.50159E-02 -2.75081E-02
11106.762 -10.466 -1.020 9.65131E-02 1.71704E-01 -7.51909E-02
11108.964 -8.264 -0.680 1.77403E-01 4.15482E-01 -2.38079E-01
11110.285 -6.942 -0.340 3.24212E-01 9.79848E-01 -6.55636E-01
11110.726 -6.502 0.000 4.99695E-01 1.30462E+00 -8.04924E-01
11111.297 -5.931 0.387 7.42983E-01 1.67734E+00 -9.34355E-01
11111.717 -5.511 0.510 7.96980E-01 1.83242E+00 -1.03544E+00
11112.488 -4.740 0.680 8.94608E-01 1.89382E+00 -9.99210E-01
11113.479 -3.749 0.850 1.11631E+00 1.78715E+00 -6.70842E-01
11114.690 -2.538 1.020 1.43681E+00 1.60836E+00 -1.71549E-01
11116.121 -1.107 1.190 1.63085E+00 1.42983E+00 2.01020E-01
11117.773 0.545 1.360 1.59280E+00 1.28027E+00 3.12530E-01
11119.645 2.417 1.530 1.44602E+00 1.16415E+00 2.81869E-01
11121.737 4.509 1.700 1.29440E+00 1.07740E+00 2.17002E-01
11124.049 6.821 1.870 1.16176E+00 1.01455E+00 1.47219E-01
11126.582 9.354 2.040 1.04429E+00 9.70626E-01 7.36670E-02
11129.334 12.106 2.210 9.63534E-01 9.41807E-01 2.17273E-02
11132.307 15.079 2.380 9.08966E-01 9.25200E-01 -1.62342E-02
11135.500 18.272 2.550 8.79995E-01 9.18454E-01 -3.84596E-02
11138.914 21.686 2.720 8.74442E-01 9.19652E-01 -4.52101E-02
11142.547 25.319 2.890 8.85749E-01 9.27135E-01 -4.13863E-02
11146.401 29.173 3.060 9.07374E-01 9.39274E-01 -3.19000E-02
11150.475 33.247 3.230 9.34291E-01 9.54526E-01 -2.02351E-02
11154.769 37.541 3.400 9.62522E-01 9.71141E-01 -8.61857E-03
11159.284 42.056 3.570 9.89263E-01 9.87513E-01 1.75062E-03
11164.018 46.791 3.740 1.01247E+00 1.00208E+00 1.03876E-02
11168.973 51.745 3.910 1.03063E+00 1.01353E+00 1.70980E-02
11174.148 56.921 4.080 1.04265E+00 1.02098E+00 2.16779E-02
11179.544 62.316 4.250 1.04778E+00 1.02398E+00 2.37968E-02
11185.159 67.931 4.420 1.04578E+00 1.02276E+00 2.30252E-02
11190.995 73.767 4.590 1.03689E+00 1.01788E+00 1.90129E-02
11197.051 79.823 4.760 1.02226E+00 1.01043E+00 1.18291E-02
11203.327 86.099 4.930 1.00386E+00 1.00150E+00 2.36114E-03
11209.824 92.596 5.100 9.84700E-01 9.92260E-01 -7.56049E-03
11216.540 99.312 5.270 9.68007E-01 9.83644E-01 -1.56372E-02
11223.477 106.249 5.440 9.56484E-01 9.76536E-01 -2.00518E-02
11230.634 113.406 5.610 9.51205E-01 9.71378E-01 -2.01737E-02
11238.011 120.783 5.780 9.51834E-01 9.68368E-01 -1.65333E-02
11245.609 128.381 5.950 9.57281E-01 9.67603E-01 -1.03218E-02
11253.427 136.199 6.120 9.65727E-01 9.68644E-01 -2.91686E-03
11261.465 144.237 6.290 9.75478E-01 9.71147E-01 4.33093E-03
11269.723 152.495 6.460 9.84598E-01 9.74427E-01 1.01704E-02
11278.201 160.973 6.630 9.91336E-01 9.77798E-01 1.35385E-02
11286.900 169.672 6.800 9.94387E-01 9.80622E-01 1.37654E-02
11295.818 178.590 6.970 9.93123E-01 9.82262E-01 1.08611E-02
11304.957 187.729 7.140 9.88091E-01 9.82425E-01 5.66589E-03
11314.317 197.089 7.310 9.80566E-01 9.80914E-01 -3.48337E-04
11323.896 206.668 7.480 9.72177E-01 9.77780E-01 -5.60303E-03
11333.696 216.468 7.650 9.64078E-01 9.73021E-01 -8.94313E-03
11343.716 226.488 7.820 9.57875E-01 9.67767E-01 -9.89234E-03
11353.956 236.728 7.990 9.53600E-01 9.62166E-01 -8.56583E-03
11364.416 247.188 8.160 9.51019E-01 9.56511E-01 -5.49155E-03
11375.097 257.869 8.330 9.50397E-01 9.51832E-01 -1.43517E-03
11385.997 268.769 8.500 9.50348E-01 9.47640E-01 2.70748E-03
11397.118 279.890 8.670 9.50985E-01 9.44965E-01 6.02055E-03
11408.459 291.231 8.840 9.51097E-01 9.43365E-01 7.73223E-03
11420.021 302.793 9.010 9.49638E-01 9.42203E-01 7.43503E-03
11431.802 314.574 9.180 9.47393E-01 9.42117E-01 5.27621E-03
11443.804 326.576 9.350 9.43702E-01 9.41783E-01 1.91892E-03
11456.026 338.798 9.520 9.40025E-01 9.41691E-01 -1.66533E-03
11468.469 351.241 9.690 9.36618E-01 9.41155E-01 -4.53679E-03
11481.131 363.903 9.860 9.33994E-01 9.40028E-01 -6.03416E-03
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