Input 06-rdmft.02-gs_basis.inp
Commits >
Commit b5086f89e5ba3598cb2c5ef57ca1b3f99761e498 >
Run foss_cmake: [foss2022a-serial, foss-min]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| SCF convergence | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-03 | 0.000000000000000e+00 | PASS |
| RDMFT converged energy | -1.150819634200000e+00 | -1.150582391700000e+00 | 1.000000000000000e-03 | -2.372425000001233e-04 | PASS |
| RDMFT highest occupation number | 1.935739454233000e+00 | 1.935709828519000e+00 | 1.000000000000000e-03 | 2.962571400000336e-05 | PASS |