Input 07-qoct+tddft.01-ground_state.inp
Commits >
Commit efc44ae2259e56922145db535c825ce53e4127cb >
Run foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
Total energy | 3.350893350000000e+00 | 3.350893320000000e+00 | 1.000000000000000e-04 | 3.000000026176508e-08 | PASS |
Eigenvalue | 1.372935000000000e+00 | 1.372935000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
Eigenvalue | 1.481456000000000e+00 | 1.481456000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |