Input 14-silicon_shifts.03-td_parstates.inp
Commits >
Commit 32c00845502bbc3ac64555e3c727792a7ab72a6a >
Run GCI_foss-cmake: [foss2022a-serial, foss-min]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Number of excited electrons [step 100] | 6.185387531210118e-05 | 6.185219895782357e-05 | 3.230000000000000e-09 | 1.676354277613257e-09 | PASS |
| Projections [step 100] | 9.402375126487268e-01 | 9.400425766754038e-01 | 3.140000000000000e-04 | 1.949359733229850e-04 | PASS |
| Projections [step 100] | -3.405135197268204e-01 | -3.410432996471690e-01 | 5.830000000000000e-04 | 5.297799203485831e-04 | PASS |
| Total current [step 100] | -1.213965426768475e-02 | 1.226255951247051e-02 | 2.680000000000000e-02 | -2.440221378015526e-02 | PASS |