Input 01-casida.09-spectrum.inp
Commits >
Commit 3186a8a51be7ad5a27ccff6e8e2901df0a16a559 >
Run GCI_foss_mpi_debug_autotools: [foss2023a-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
eps_diff spectrum x | 2.902434000000000e-01 | 2.902434000000000e-01 | 1.450000000000000e-06 | 0.000000000000000e+00 | PASS |
eps_diff spectrum y | 1.521389000000000e+01 | 1.521389000000000e+01 | 7.610000000000001e-05 | 0.000000000000000e+00 | PASS |
eps_diff spectrum z | 1.521389000000000e+01 | 1.521389000000000e+01 | 7.610000000000001e-05 | 0.000000000000000e+00 | PASS |
eps_diff spectrum tot | 1.023934000000000e+01 | 1.024100000000000e+01 | 5.120000000000000e-03 | -1.659999999999329e-03 | PASS |
Petersilka spectrum x | 2.605148000000000e-01 | 2.605148000000000e-01 | 1.300000000000000e-06 | 0.000000000000000e+00 | PASS |
Petersilka spectrum y | 2.348781000000000e+01 | 2.348781000000000e+01 | 1.170000000000000e-04 | 0.000000000000000e+00 | PASS |
Petersilka spectrum z | 2.348781000000000e+01 | 2.348781000000000e+01 | 1.170000000000000e-04 | 0.000000000000000e+00 | PASS |
Petersilka spectrum tot | 1.574538000000000e+01 | 1.574538000000000e+01 | 7.870000000000000e-05 | 0.000000000000000e+00 | PASS |
Casida spectrum x | 6.740964000000000e-01 | 6.740964000000000e-01 | 3.370000000000000e-06 | 0.000000000000000e+00 | PASS |
Casida spectrum y | 1.419945000000000e+01 | 1.419944000000000e+01 | 7.100000000000000e-05 | 1.000000000139778e-05 | PASS |
Casida spectrum z | 1.419944000000000e+01 | 1.419944000000000e+01 | 7.100000000000000e-05 | 0.000000000000000e+00 | PASS |
Casida spectrum tot | 9.690994999999999e+00 | 9.690990000000001e+00 | 4.850000000000000e-05 | 4.999999998034355e-06 | PASS |
CV(2) spectrum x | 4.808010000000000e-01 | 4.808010000000000e-01 | 2.400000000000000e-05 | 0.000000000000000e+00 | PASS |
CV(2) spectrum y | 1.181218000000000e+00 | 1.181211000000000e+00 | 2.370000000000000e-05 | 7.000000000090267e-06 | PASS |
CV(2) spectrum z | 1.181218000000000e+00 | 1.181212000000000e+00 | 2.310000000000000e-05 | 6.000000000172534e-06 | PASS |
CV(2) spectrum tot | 9.477457000000000e-01 | 9.477416000000000e-01 | 1.570000000000000e-05 | 4.100000000062387e-06 | PASS |
Tamm-Dancoff spectrum x | 6.050210000000000e-01 | 6.050210000000000e-01 | 3.030000000000000e-05 | 0.000000000000000e+00 | PASS |
Tamm-Dancoff spectrum y | 1.213956000000000e+01 | 1.213955000000000e+01 | 6.070000000000000e-05 | 9.999999999621423e-06 | PASS |
Tamm-Dancoff spectrum z | 1.213956000000000e+01 | 1.213955000000000e+01 | 6.070000000000000e-05 | 9.999999999621423e-06 | PASS |
Tamm-Dancoff spectrum tot | 8.294713000000000e+00 | 8.294709000000001e+00 | 1.540000000000000e-05 | 3.999999998782755e-06 | PASS |