Input 17-absorption-spin_symmetry.01-gs.inp
Commits >
Commit cbea69fbf625d621b43d7bf990e8d9b27d6c495d >
Run GCI_foss_min_autotools: [foss2022a-serial]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| SCF convergence | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| Initial energy | -1.135646826000000e+01 | -1.135646828000000e+01 | 5.680000000000000e-08 | 1.999999987845058e-08 | PASS |