Input 06-rdmft.02-gs_basis.inp
Commits >
Commit 917d830e9234ff154f8a96d6b6c157a89a03a450 >
Run intel_omp_autotools: [intel2022a-serial]
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 | -1.150819624600000e+00 | -1.150582391700000e+00 | 1.000000000000000e-03 | -2.372328999999951e-04 | PASS |
| RDMFT highest occupation number | 1.935739519108000e+00 | 1.935709828519000e+00 | 1.000000000000000e-03 | 2.969058900004207e-05 | PASS |