Input 24-adsic_freeze_orbitals.01-gs.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-04 | 0.000000000000000e+00 | PASS |
| Initial energy | -1.977413220000000e+00 | -1.977413220000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |