Input 07-casida-photons.06-spectrum.inp
Commits >
Commit 16a288d93f4684890591c6dab8ffeadb82c84e9a >
Run foss_mpi_min_autotools: [foss2022a-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 | 4.191698000000000e-01 | 4.191558000000000e-01 | 1.000000000000000e-04 | 1.399999999995849e-05 | PASS |
Casida spectrum z | 4.048042000000000e-01 | 4.047906000000000e-01 | 1.000000000000000e-04 | 1.360000000000250e-05 | PASS |
Casida spectrum tot | 4.491394000000000e+00 | 4.491362000000000e+00 | 1.000000000000000e-04 | 3.200000000003200e-05 | PASS |