Input 27-Ar.03-em_resp_mo.inp

Commits > Commit 9c86d3f9e0672ab6f34186f0e6ca5b729d8f047e > Run eb_foss-2022a_mpi_debug

Matches

Name Value Reference Precision Difference Status
Susceptibility XX -1.130983340000000e+02 -1.130983380000000e+02 6.050000000000000e-06 4.000000018322680e-06 PASS
Susceptibility YY -1.130983340000000e+02 -1.130983380000000e+02 6.050000000000000e-06 4.000000018322680e-06 PASS
Susceptibility ZZ -1.130983340000000e+02 -1.130983380000000e+02 6.050000000000000e-06 4.000000018322680e-06 PASS
Re epsilon XX (LRC) 1.246991000000000e+00 1.246991000000000e+00 6.230000000000000e-06 0.000000000000000e+00 PASS
Re epsilon YY (LRC) 1.246991000000000e+00 1.246991000000000e+00 6.230000000000000e-06 0.000000000000000e+00 PASS
Re epsilon ZZ (LRC) 1.246991000000000e+00 1.246991000000000e+00 6.230000000000000e-06 0.000000000000000e+00 PASS
Im epsilon XX (LRC) 1.501700000000000e-02 1.501700000000000e-02 7.510000000000000e-06 0.000000000000000e+00 PASS
Im epsilon YY (LRC) 1.501700000000000e-02 1.501700000000000e-02 7.510000000000000e-06 0.000000000000000e+00 PASS
Im epsilon ZZ (LRC) 1.501700000000000e-02 1.501700000000000e-02 7.510000000000000e-06 0.000000000000000e+00 PASS
Im epsilon av (LRC) 1.501700000000000e-02 1.501700000000000e-02 7.510000000000000e-06 0.000000000000000e+00 PASS
Re eps XX (LRC, w/o G=0) 1.246027000000000e+00 1.246027000000000e+00 6.230000000000000e-06 0.000000000000000e+00 PASS
Re eps YY (LRC, w/o G=0) 1.246027000000000e+00 1.246027000000000e+00 6.230000000000000e-06 0.000000000000000e+00 PASS
Re eps ZZ (LRC, w/o G=0) 1.246027000000000e+00 1.246027000000000e+00 6.230000000000000e-06 0.000000000000000e+00 PASS
Im eps XX (LRC, w/o G=0) 1.490000000000000e-02 1.489900000000000e-02 7.450000000000000e-06 9.999999999975306e-07 PASS
Im eps YY (LRC, w/o G=0) 1.490000000000000e-02 1.489900000000000e-02 7.450000000000000e-06 9.999999999975306e-07 PASS
Im eps ZZ (LRC, w/o G=0) 1.490000000000000e-02 1.489900000000000e-02 7.450000000000000e-06 9.999999999975306e-07 PASS
Im eps av (LRC, w/o G=0) 1.490000000000000e-02 1.489900000000000e-02 7.450000000000000e-06 9.999999999975306e-07 PASS
Re epsilon at k-point 1.682395300000000e-01 1.682394300000000e-01 1.870000000000000e-07 1.000000000028756e-07 PASS
Re epsilon at k-point 3.214342800000000e-01 3.214342000000000e-01 1.610000000000000e-06 8.000000001340268e-08 PASS
Re epsilon at k-point 6.347433200000000e-08 -2.226067900000000e-08 9.430000000000000e-08 8.573501100000001e-08 PASS
Im epsilon at k-point 2.613517000000000e-03 2.613383900000000e-03 3.460000000000000e-07 1.331000000002851e-07 PASS
Im epsilon at k-point 2.613390500000000e-03 2.613410000000000e-03 4.330000000000000e-07 -1.950000000014440e-08 PASS
Im epsilon at k-point -3.530452500000000e-08 1.557159700000000e-08 6.110000000000000e-08 -5.087612200000000e-08 PASS
Mag.-opt. Re alpha -1.348501400000000e-01 -1.348502300000000e-01 5.500000000000000e-07 8.999999998038355e-08 PASS
Mag.-opt. Re alpha -1.348501400000000e-01 -1.348502300000000e-01 5.500000000000000e-07 8.999999998038355e-08 PASS
Mag.-opt. Re alpha -1.348501400000000e-01 -1.348502300000000e-01 5.500000000000000e-07 8.999999998038355e-08 PASS
Mag.-opt. Re alpha -1.348501400000000e-01 -1.348502300000000e-01 5.500000000000000e-07 8.999999998038355e-08 PASS
MO Im alpha (w/o G=0) 2.655299300000000e-01 2.655300000000000e-01 2.700000000000000e-07 -6.999999996315509e-08 PASS
MO Im alpha (w/o G=0) 2.655299300000000e-01 2.655300000000000e-01 2.700000000000000e-07 -6.999999996315509e-08 PASS
MO Im alpha (w/o G=0) 2.655299300000000e-01 2.655300000000000e-01 2.700000000000000e-07 -6.999999996315509e-08 PASS
MO Im alpha (w/o G=0) 2.655299300000000e-01 2.655300000000000e-01 2.700000000000000e-07 -6.999999996315509e-08 PASS
Mag.-opt. Im epsilon 2.766565800000000e-03 2.766566600000000e-03 2.810000000000000e-09 -7.999999998391238e-10 PASS
Mag.-opt. Im epsilon 2.766565800000000e-03 2.766566600000000e-03 2.810000000000000e-09 -7.999999998391238e-10 PASS
Mag.-opt. Im epsilon 2.766565800000000e-03 2.766566600000000e-03 2.810000000000000e-09 -7.999999998391238e-10 PASS
Mag.-opt. Im epsilon 2.766565800000000e-03 2.766566600000000e-03 2.810000000000000e-09 -7.999999998391238e-10 PASS
MO Re eps (w/o G=0) -1.393538800000000e-03 -1.393539750000000e-03 5.660000000000000e-09 9.499999998902747e-10 PASS
MO Re eps (w/o G=0) -1.393538800000000e-03 -1.393539750000000e-03 5.660000000000000e-09 9.499999998902747e-10 PASS
MO Re eps (w/o G=0) -1.393538800000000e-03 -1.393539750000000e-03 5.660000000000000e-09 9.499999998902747e-10 PASS
MO Re eps (w/o G=0) -1.393538800000000e-03 -1.393539750000000e-03 5.660000000000000e-09 9.499999998902747e-10 PASS
Mag.-opt. Re eps at kpt -1.202049500000000e-03 -1.202049500000000e-03 6.930000000000000e-09 2.168404344971009e-19 PASS
Mag.-opt. Im eps at kpt 2.645924200000000e-03 2.645921800000000e-03 5.940000000000000e-09 2.399999999951052e-09 PASS
Mag.-opt. Im eps at kpt 4.802627500000000e-03 4.802627400000000e-03 3.300000000000000e-09 9.999999960041972e-11 PASS
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