Input 27-Ar.03-em_resp_mo.inp
Commits >
Commit 332f9cd714e196a805e42e2741bfb36d81a9f700 >
Run intel_mpi_autotools: [intel2023a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Susceptibility XX | -1.624432490000000e+02 | -1.624432480000000e+02 | 8.120000000000000e-06 | -9.999999974752427e-07 | PASS |
| Susceptibility YY | -1.624432490000000e+02 | -1.624432480000000e+02 | 8.120000000000000e-06 | -9.999999974752427e-07 | PASS |
| Susceptibility ZZ | -1.624432490000000e+02 | -1.624432480000000e+02 | 8.120000000000000e-06 | -9.999999974752427e-07 | PASS |
| Re epsilon XX (LRC) | 1.119100000000000e+00 | 1.119100000000000e+00 | 5.600000000000000e-09 | 0.000000000000000e+00 | PASS |
| Re epsilon YY (LRC) | 1.119100000000000e+00 | 1.119100000000000e+00 | 5.600000000000000e-09 | 0.000000000000000e+00 | PASS |
| Re epsilon ZZ (LRC) | 1.119100000000000e+00 | 1.119100000000000e+00 | 5.600000000000000e-09 | 0.000000000000000e+00 | PASS |
| Im epsilon XX (LRC) | 9.250000000000000e-04 | 9.250000000000000e-04 | 4.630000000000000e-05 | 0.000000000000000e+00 | PASS |
| Im epsilon YY (LRC) | 9.250000000000000e-04 | 9.250000000000000e-04 | 4.630000000000000e-05 | 0.000000000000000e+00 | PASS |
| Im epsilon ZZ (LRC) | 9.250000000000000e-04 | 9.250000000000000e-04 | 4.630000000000000e-05 | 0.000000000000000e+00 | PASS |
| Im epsilon av (LRC) | 9.250000000000000e-04 | 9.250000000000000e-04 | 4.630000000000000e-05 | 0.000000000000000e+00 | PASS |
| Re eps XX (LRC, w/o G=0) | 1.118874000000000e+00 | 1.118874000000000e+00 | 5.590000000000000e-06 | 0.000000000000000e+00 | PASS |
| Re eps YY (LRC, w/o G=0) | 1.118874000000000e+00 | 1.118874000000000e+00 | 5.590000000000000e-06 | 0.000000000000000e+00 | PASS |
| Re eps ZZ (LRC, w/o G=0) | 1.118874000000000e+00 | 1.118874000000000e+00 | 5.590000000000000e-06 | 0.000000000000000e+00 | PASS |
| Im eps XX (LRC, w/o G=0) | 9.210000000000001e-04 | 9.210000000000001e-04 | 4.610000000000000e-05 | 0.000000000000000e+00 | PASS |
| Im eps YY (LRC, w/o G=0) | 9.210000000000001e-04 | 9.210000000000001e-04 | 4.610000000000000e-05 | 0.000000000000000e+00 | PASS |
| Im eps ZZ (LRC, w/o G=0) | 9.210000000000001e-04 | 9.210000000000001e-04 | 4.610000000000000e-05 | 0.000000000000000e+00 | PASS |
| Im eps av (LRC, w/o G=0) | 9.210000000000001e-04 | 9.210000000000001e-04 | 4.610000000000000e-05 | 0.000000000000000e+00 | PASS |
| Re epsilon at k-point | 1.072508500000000e-01 | 1.072508500000000e-01 | 5.360000000000000e-08 | 0.000000000000000e+00 | PASS |
| Re epsilon at k-point | 1.287275400000000e-01 | 1.287275400000000e-01 | 6.439999999999999e-08 | 0.000000000000000e+00 | PASS |
| Re epsilon at k-point | 2.394266900000000e-09 | 0.000000000000000e+00 | 1.690000000000000e-07 | 2.394266900000000e-09 | PASS |
| Im epsilon at k-point | 6.599205900000000e-04 | 6.599205900000000e-04 | 6.600000000000000e-18 | 0.000000000000000e+00 | PASS |
| Im epsilon at k-point | 6.599468500000000e-04 | 6.599469100000001e-04 | 3.300000000000000e-10 | -6.000000008551248e-11 | PASS |
| Im epsilon at k-point | 6.773052800000000e-10 | 1.557159700000000e-08 | 1.100000000000000e-07 | -1.489429172000000e-08 | PASS |
| Mag.-opt. Re alpha | -6.400707600000000e-03 | -6.400707700000000e-03 | 3.200000000000000e-09 | 1.000000004677815e-10 | PASS |
| Mag.-opt. Re alpha | -6.400707600000000e-03 | -6.400707700000000e-03 | 3.200000000000000e-09 | 1.000000004677815e-10 | PASS |
| Mag.-opt. Re alpha | -6.400707600000000e-03 | -6.400707700000000e-03 | 3.200000000000000e-09 | 1.000000004677815e-10 | PASS |
| Mag.-opt. Re alpha | -6.400707600000000e-03 | -6.400707700000000e-03 | 3.200000000000000e-09 | 1.000000004677815e-10 | PASS |
| MO Im alpha (w/o G=0) | -9.414677999999999e-03 | -9.414679000000000e-03 | 4.710000000000000e-08 | 1.000000001208368e-09 | PASS |
| MO Im alpha (w/o G=0) | -9.414677999999999e-03 | -9.414679000000000e-03 | 4.710000000000000e-08 | 1.000000001208368e-09 | PASS |
| MO Im alpha (w/o G=0) | -9.414677999999999e-03 | -9.414679000000000e-03 | 4.710000000000000e-08 | 1.000000001208368e-09 | PASS |
| MO Im alpha (w/o G=0) | -9.414677999999999e-03 | -9.414679000000000e-03 | 4.710000000000000e-08 | 1.000000001208368e-09 | PASS |
| Mag.-opt. Im epsilon | -9.790574700000000e-05 | -9.790575900000001e-05 | 4.900000000000000e-11 | 1.200000000626048e-11 | PASS |
| Mag.-opt. Im epsilon | -9.790574700000000e-05 | -9.790575900000001e-05 | 4.900000000000000e-11 | 1.200000000626048e-11 | PASS |
| Mag.-opt. Im epsilon | -9.790574700000000e-05 | -9.790575900000001e-05 | 4.900000000000000e-11 | 1.200000000626048e-11 | PASS |
| Mag.-opt. Im epsilon | -9.790574700000000e-05 | -9.790575900000001e-05 | 4.900000000000000e-11 | 1.200000000626048e-11 | PASS |
| MO Re eps (w/o G=0) | -6.631181200000000e-05 | -6.631181200000000e-05 | 3.320000000000000e-11 | 0.000000000000000e+00 | PASS |
| MO Re eps (w/o G=0) | -6.631181200000000e-05 | -6.631181200000000e-05 | 3.320000000000000e-11 | 0.000000000000000e+00 | PASS |
| MO Re eps (w/o G=0) | -6.631181200000000e-05 | -6.631181200000000e-05 | 3.320000000000000e-11 | 0.000000000000000e+00 | PASS |
| MO Re eps (w/o G=0) | -6.631181200000000e-05 | -6.631181200000000e-05 | 3.320000000000000e-11 | 0.000000000000000e+00 | PASS |
| Mag.-opt. Re eps at kpt | -6.516126900000000e-05 | -6.516128800000000e-05 | 3.260000000000000e-11 | 1.899999999184238e-11 | PASS |
| Mag.-opt. Im eps at kpt | -9.601856900000000e-05 | -9.601883550000001e-05 | 3.090000000000000e-10 | 2.665000000057682e-10 | PASS |
| Mag.-opt. Im eps at kpt | 4.008543300000000e-05 | 4.008575500000001e-05 | 3.990000000000000e-10 | -3.220000000076178e-10 | PASS |