Input 02-fock-darwin.01-ground_state.inp
Commits >
Commit 6099f031302cffa2938f492784ba2f7b55faffa3 >
Run foss_cmake: [foss2023a-mpi, foss-full-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| SCF convergence | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-05 | 0.000000000000000e+00 | PASS |
| Eigenvalue 1 | 2.502000000000000e-01 | 2.502000000000000e-01 | 1.000000000000000e-05 | 0.000000000000000e+00 | PASS |
| Eigenvalue 2 | 4.904000000000000e-01 | 4.904000000000000e-01 | 1.000000000000000e-05 | 0.000000000000000e+00 | PASS |
| Eigenvalue 3 | 5.104000000000000e-01 | 5.104000000000000e-01 | 1.000000000000000e-05 | 0.000000000000000e+00 | PASS |
| Eigenvalue 4 | 7.305990000000000e-01 | 7.305990000000000e-01 | 1.000000000000000e-05 | 0.000000000000000e+00 | PASS |
| Eigenvalue 5 | 7.505990000000000e-01 | 7.505990000000000e-01 | 1.000000000000000e-05 | 0.000000000000000e+00 | PASS |
| Eigenvalue 6 | 7.705990000000000e-01 | 7.705990000000000e-01 | 1.000000000000000e-05 | 0.000000000000000e+00 | PASS |
| Eigenvalue 7 | 9.707980000000000e-01 | 9.707980000000000e-01 | 1.000000000000000e-05 | 0.000000000000000e+00 | PASS |
| Eigenvalue 8 | 9.907970000000000e-01 | 9.907970000000000e-01 | 1.000000000000000e-05 | 0.000000000000000e+00 | PASS |
| Eigenvalue 9 | 1.010796000000000e+00 | 1.010796000000000e+00 | 1.000000000000000e-05 | 0.000000000000000e+00 | PASS |
| Eigenvalue 10 | 1.030798000000000e+00 | 1.030798000000000e+00 | 1.000000000000000e-05 | 0.000000000000000e+00 | PASS |