Match Total energy
Commits >
Commit 6e9e1a4536d8fe2a292bd24d601ed608cb4be1e6 >
Run foss-mpi-full: [foss2023a-mpi] >
Input 01-hydrogen.01-ground_state.inp
Value | Reference | Precision | Status |
-6.697860300000000e-01 | -6.697860300000000e-01 | 1.000000000000000e-04 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)