Input 23-go-na2.04-fire_restart.inp
Commits >
Commit b5086f89e5ba3598cb2c5ef57ca1b3f99761e498 >
Run foss_cmake: [foss2023a-mpi, foss-min-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Total energy | -4.177694000000000e-01 | -4.177694000000000e-01 | 2.090000000000000e-06 | 0.000000000000000e+00 | PASS |
| Force [1] | 5.221468150000000e-05 | 5.221468149999999e-05 | 5.220000000000000e-19 | 6.776263578034403e-21 | PASS |
| Force [2] | -5.221468150000000e-05 | -5.221468149999999e-05 | 5.220000000000000e-19 | -6.776263578034403e-21 | PASS |
| Geometry [1] | -1.465628000000000e+00 | -1.465628000000000e+00 | 7.330000000000000e-06 | 0.000000000000000e+00 | PASS |
| Geometry [2] | 1.465628000000000e+00 | 1.465628000000000e+00 | 7.330000000000000e-06 | 0.000000000000000e+00 | PASS |