Input 34-walltime.02-restart_gs.inp
Commits >
Commit 155f01ef7d18124a1050c3611747e8f8b44bbe31 >
Run intel_autotools: [intel2023a-serial]
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 | -3.792394745000000e+01 | -3.792394773000000e+01 | 1.700000000000000e-06 | 2.800000018510218e-07 | PASS |