Match Eigenvalues sum
Commits >
Commit 4eed2c655b9f478fca43a397c5feb863f7436add >
Run eb_intel-2022a_impi >
Input 28-carbon_big_box.01-ground_state.inp
| Value | Reference | Precision | Status |
| -9.213260999999999e+00 | -9.213246620000000e+00 | 1.000000000000000e-04 | PASS |
Command: GREPFIELD(static/info, 'Eigenvalues =', 3)