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 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100
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=-------------------------------------------------------------------=
Hubbard U parameters:
site n. type label spin new_type new_label Hubbard U (eV)
1 1 Co 1 1 Co 7.8305
=-------------------------------------------------------------------=
chi0 matrix :
-0.493424 0.000778 0.000778 0.076698 0.000778 0.076698 0.076698 -0.000006
0.000778 -0.493424 0.076698 0.000778 0.076698 0.000778 -0.000006 0.076698
0.000778 0.076698 -0.493424 0.000778 0.076698 -0.000006 0.000778 0.076698
0.076698 0.000778 0.000778 -0.493424 -0.000006 0.076698 0.076698 0.000778
0.000778 0.076698 0.076698 -0.000006 -0.493424 0.000778 0.000778 0.076698
0.076698 0.000778 -0.000006 0.076698 0.000778 -0.493424 0.076698 0.000778
0.076698 -0.000006 0.000778 0.076698 0.000778 0.076698 -0.493424 0.000778
-0.000006 0.076698 0.076698 0.000778 0.076698 0.000778 0.000778 -0.493424
chi matrix :
-0.099713 0.000053 0.000053 0.004466 0.000053 0.004466 0.004466 0.000005
0.000053 -0.099713 0.004466 0.000053 0.004466 0.000053 0.000005 0.004466
0.000053 0.004466 -0.099713 0.000053 0.004466 0.000005 0.000053 0.004466
0.004466 0.000053 0.000053 -0.099713 0.000005 0.004466 0.004466 0.000053
0.000053 0.004466 0.004466 0.000005 -0.099713 0.000053 0.000053 0.004466
0.004466 0.000053 0.000005 0.004466 0.000053 -0.099713 0.004466 0.000053
0.004466 0.000005 0.000053 0.004466 0.000053 0.004466 -0.099713 0.000053
0.000005 0.004466 0.004466 0.000053 0.004466 0.000053 0.000053 -0.099713
chi0^{-1} matrix :
-2.264966 -0.008999 -0.008999 -0.510952 -0.008999 -0.510952 -0.510952 -0.006588
-0.008999 -2.264966 -0.510952 -0.008999 -0.510952 -0.008999 -0.006588 -0.510952
-0.008999 -0.510952 -2.264966 -0.008999 -0.510952 -0.006588 -0.008999 -0.510952
-0.510952 -0.008999 -0.008999 -2.264966 -0.006588 -0.510952 -0.510952 -0.008999
-0.008999 -0.510952 -0.510952 -0.006588 -2.264966 -0.008999 -0.008999 -0.510952
-0.510952 -0.008999 -0.006588 -0.510952 -0.008999 -2.264966 -0.510952 -0.008999
-0.510952 -0.006588 -0.008999 -0.510952 -0.008999 -0.510952 -2.264966 -0.008999
-0.006588 -0.510952 -0.510952 -0.008999 -0.510952 -0.008999 -0.008999 -2.264966
chi^{-1} matrix :
-10.095485 -0.006599 -0.006599 -0.496606 -0.006599 -0.496606 -0.496606 -0.002159
-0.006599 -10.095485 -0.496606 -0.006599 -0.496606 -0.006599 -0.002159 -0.496606
-0.006599 -0.496606 -10.095485 -0.006599 -0.496606 -0.002159 -0.006599 -0.496606
-0.496606 -0.006599 -0.006599 -10.095485 -0.002159 -0.496606 -0.496606 -0.006599
-0.006599 -0.496606 -0.496606 -0.002159 -10.095485 -0.006599 -0.006599 -0.496606
-0.496606 -0.006599 -0.002159 -0.496606 -0.006599 -10.095485 -0.496606 -0.006599
-0.496606 -0.002159 -0.006599 -0.496606 -0.006599 -0.496606 -10.095485 -0.006599
-0.002159 -0.496606 -0.496606 -0.006599 -0.496606 -0.006599 -0.006599 -10.095485
Hubbard matrix :
7.830519 -0.002400 -0.002400 -0.014346 -0.002400 -0.014346 -0.014346 -0.004429
-0.002400 7.830519 -0.014346 -0.002400 -0.014346 -0.002400 -0.004429 -0.014346
-0.002400 -0.014346 7.830519 -0.002400 -0.014346 -0.004429 -0.002400 -0.014346
-0.014346 -0.002400 -0.002400 7.830519 -0.004429 -0.014346 -0.014346 -0.002400
-0.002400 -0.014346 -0.014346 -0.004429 7.830519 -0.002400 -0.002400 -0.014346
-0.014346 -0.002400 -0.004429 -0.014346 -0.002400 7.830519 -0.014346 -0.002400
-0.014346 -0.004429 -0.002400 -0.014346 -0.002400 -0.014346 7.830519 -0.002400
-0.004429 -0.014346 -0.014346 -0.002400 -0.014346 -0.002400 -0.002400 7.830519
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