Match Total energy
Commits >
Commit 584f61e8603689505e758f366f49c21c2e481def >
Run foss-mpi-min: [foss2022a-mpi] >
Input 23-go-na2.02-simplex.inp
| Value | Reference | Precision | Status |
| -4.174826300000000e-01 | -4.174826000000000e-01 | 2.090000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)