Input 34-walltime.02-restart_gs.inp
Commits >
Commit e7de9bbf531ff65a0d18444fdbe173713a455724 >
Run foss-cmake-zen4: [foss2023a-serial, foss-full]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Reading States | 1.000000000000000e+00 | 1.000000000000000e+00 | 7.000000000000000e-06 | 0.000000000000000e+00 | PASS |
| SCF convergence | 1.000000000000000e+00 | 1.000000000000000e+00 | 7.000000000000000e-06 | 0.000000000000000e+00 | PASS |
| Initial energy | -3.792394752000000e+01 | -3.792394773000000e+01 | 1.700000000000000e-06 | 2.100000031646232e-07 | PASS |