Input 14-silicon_shifts.03-td_parstates.inp
Commits >
Commit 0fe8dcc2cda723db7bfa614b73e6eb662c8bbe1e >
Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Projections [step 100] | 9.402375126689865e-01 | 9.400425766754038e-01 | 3.140000000000000e-04 | 1.949359935826678e-04 | PASS |
| Projections [step 100] | -3.405135168528514e-01 | -3.410432996471690e-01 | 5.830000000000000e-04 | 5.297827943176459e-04 | PASS |
| Total current [step 100] | -1.213690524603952e-02 | 1.226255951247051e-02 | 2.680000000000000e-02 | -2.439946475851004e-02 | PASS |
| Number of excited electrons [step 100] | 2.021240736305163e-05 | 2.020866884308581e-05 | 4.460000000000000e-09 | 3.738519965820140e-09 | PASS |