Match Eigenvalue 3
Commits >
Commit 705c4760eef009c58a165e8716adc8057257a566 >
Run foss-mpi-min: [foss2023a-mpi] >
Input 31-acetylene_b3lyp.01-gs.inp
| Value | Reference | Precision | Status |
| -4.847320000000000e-01 | -4.847150000000000e-01 | 2.420000000000000e-05 | PASS |
Command: GREPFIELD(static/info, ' 3 --', 3)