Input 14-silicon_shifts.03-td_parstates.inp
Commits >
Commit c335ce26b11dabfe3619506d15cfc1285f92daaf >
Run foss_mpi_omp_autotools: [foss2023a-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
Projections [step 100] | 9.402375139284102e-01 | 9.400425766754038e-01 | 3.140000000000000e-04 | 1.949372530063442e-04 | PASS |
Projections [step 100] | -3.405135133866235e-01 | -3.410432996471690e-01 | 5.830000000000000e-04 | 5.297862605455061e-04 | PASS |
Total current [step 100] | -1.213690334936428e-02 | 1.226255951247051e-02 | 2.680000000000000e-02 | -2.439946286183479e-02 | PASS |
Number of excited electrons [step 100] | 2.021240367922061e-05 | 2.020866884308581e-05 | 4.460000000000000e-09 | 3.734836134802131e-09 | PASS |