Input 14-silicon_shifts.03-td_parstates.inp
Commits >
Commit 4ba99df89cd19114311b0fcb367f44d4f4e26fb8 >
Run foss-cmake-zen4: [foss2023a-mpi, ci-foss-full-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Projections [step 100] | 9.402375138791370e-01 | 9.400425766754038e-01 | 3.140000000000000e-04 | 1.949372037332031e-04 | PASS |
| Projections [step 100] | -3.405135135084461e-01 | -3.410432996471690e-01 | 5.830000000000000e-04 | 5.297861387228986e-04 | PASS |
| Total current [step 100] | -1.213690445895830e-02 | 1.226255951247051e-02 | 2.680000000000000e-02 | -2.439946397142881e-02 | PASS |
| Number of excited electrons [step 100] | 2.021241545227537e-05 | 2.020866884308581e-05 | 4.460000000000000e-09 | 3.746609189555437e-09 | PASS |