Input 27-Ar.03-em_resp_mo.inp

Commits > Commit b08cdf9f90eeeab45fcb6d927fb00af611869fe1 > Run foss-parallel: [foss2023a-mpi]

Matches

Name Value Reference Precision Difference Status
Susceptibility XX -1.130983320000000e+02 -1.130983370000000e+02 9.900000000000000e-06 4.999999987376214e-06 PASS
Susceptibility YY -1.130983320000000e+02 -1.130983370000000e+02 9.900000000000000e-06 4.999999987376214e-06 PASS
Susceptibility ZZ -1.130983320000000e+02 -1.130983370000000e+02 9.900000000000000e-06 4.999999987376214e-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 1.682394800000000e-01 1.682394300000000e-01 2.500000000000000e-07 5.000000000143778e-08 PASS
Re epsilon at k-point 3.214342700000000e-01 3.214342000000000e-01 1.610000000000000e-06 7.000000001866624e-08 PASS
Re epsilon at k-point 3.420059600000000e-09 0.000000000000000e+00 1.690000000000000e-07 3.420059600000000e-09 PASS
Im epsilon at k-point 2.613455900000000e-03 2.613339000000000e-03 4.740000000000000e-07 1.168999999999649e-07 PASS
Im epsilon at k-point 2.613322400000000e-03 2.613410000000000e-03 4.330000000000000e-07 -8.759999999994814e-08 PASS
Im epsilon at k-point 1.939489900000000e-08 1.557159700000000e-08 1.100000000000000e-07 3.823302000000001e-09 PASS
Mag.-opt. Re alpha -1.348503700000000e-01 -1.348507300000000e-01 4.950000000000000e-07 3.600000000048009e-07 PASS
Mag.-opt. Re alpha -1.348503700000000e-01 -1.348507300000000e-01 4.950000000000000e-07 3.600000000048009e-07 PASS
Mag.-opt. Re alpha -1.348503700000000e-01 -1.348507300000000e-01 4.950000000000000e-07 3.600000000048009e-07 PASS
Mag.-opt. Re alpha -1.348503700000000e-01 -1.348507300000000e-01 4.950000000000000e-07 3.600000000048009e-07 PASS
MO Im alpha (w/o G=0) 2.655299900000000e-01 2.655300000000000e-01 1.330000000000000e-04 -9.999999994736442e-09 PASS
MO Im alpha (w/o G=0) 2.655299900000000e-01 2.655300000000000e-01 1.330000000000000e-04 -9.999999994736442e-09 PASS
MO Im alpha (w/o G=0) 2.655299900000000e-01 2.655300000000000e-01 1.330000000000000e-04 -9.999999994736442e-09 PASS
MO Im alpha (w/o G=0) 2.655299900000000e-01 2.655300000000000e-01 1.330000000000000e-04 -9.999999994736442e-09 PASS
Mag.-opt. Im epsilon 2.766566500000000e-03 2.766565100000000e-03 1.540000000000000e-09 1.399999999610047e-09 PASS
Mag.-opt. Im epsilon 2.766566500000000e-03 2.766565100000000e-03 1.540000000000000e-09 1.399999999610047e-09 PASS
Mag.-opt. Im epsilon 2.766566500000000e-03 2.766565100000000e-03 1.540000000000000e-09 1.399999999610047e-09 PASS
Mag.-opt. Im epsilon 2.766566500000000e-03 2.766565100000000e-03 1.540000000000000e-09 1.399999999610047e-09 PASS
MO Re eps (w/o G=0) -1.393541200000000e-03 -1.393544900000000e-03 5.060000000000000e-09 3.699999999960679e-09 PASS
MO Re eps (w/o G=0) -1.393541200000000e-03 -1.393544900000000e-03 5.060000000000000e-09 3.699999999960679e-09 PASS
MO Re eps (w/o G=0) -1.393541200000000e-03 -1.393544900000000e-03 5.060000000000000e-09 3.699999999960679e-09 PASS
MO Re eps (w/o G=0) -1.393541200000000e-03 -1.393544900000000e-03 5.060000000000000e-09 3.699999999960679e-09 PASS
Mag.-opt. Re eps at kpt -1.202050800000000e-03 -1.202057300000000e-03 1.000000000000000e-08 6.500000000048134e-09 PASS
Mag.-opt. Im eps at kpt 2.645932600000000e-03 2.645925950000000e-03 1.000000000000000e-08 6.649999999882444e-09 PASS
Mag.-opt. Im eps at kpt 4.802625100000000e-03 4.802625300000000e-03 1.000000000000000e-08 -2.000000000682012e-10 PASS
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