Match Hartree energy
Commits >
Commit 705c4760eef009c58a165e8716adc8057257a566 >
Run intel_omp_autotools: [intel2022a-serial] >
Input 12-boron_nitride.01-gs.inp
| Value | Reference | Precision | Status |
| -5.236158349200000e+02 | -5.236158307700000e+02 | 7.780000000000000e-06 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)