Input 07-casida-photons.06-spectrum.inp
Commits >
Commit ff858744384f796bd1ad65ff45f26dd2d219c42c >
Run foss_mpi_debug_autotools: [foss2023a-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
Casida spectrum x | 1.265021000000000e+01 | 1.265014000000000e+01 | 1.000000000000000e-04 | 6.999999999912632e-05 | PASS |
Casida spectrum y | 4.191689000000000e-01 | 4.191558000000000e-01 | 1.000000000000000e-04 | 1.309999999998812e-05 | PASS |
Casida spectrum z | 4.048034000000000e-01 | 4.047906000000000e-01 | 1.000000000000000e-04 | 1.279999999997949e-05 | PASS |
Casida spectrum tot | 4.491393000000000e+00 | 4.491362000000000e+00 | 1.000000000000000e-04 | 3.100000000078040e-05 | PASS |