Match Total energy
Commits >
Commit 3186a8a51be7ad5a27ccff6e8e2901df0a16a559 >
Run GCI_foss_mpi_autotools: [foss2023a-mpi] >
Input 31-acetylene_b3lyp.01-gs.inp
| Value | Reference | Precision | Status |
| -1.333939718000000e+01 | -1.333939704000000e+01 | 1.600000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)