Match Hartree energy
Commits >
Commit 69bdc22e524ab1df7701119670aff9b913714e90 >
Run foss_autotools: [foss2023a-serial] >
Input 28-carbon_big_box.01-ground_state.inp
| Value | Reference | Precision | Status |
| 1.067933980000000e+00 | 1.067941250000000e+00 | 1.000000000000000e-04 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)