Match Hartree energy
Commits >
Commit 69bdc22e524ab1df7701119670aff9b913714e90 >
Run foss_cmake: [foss2022a-serial, foss-full] >
Input 12-boron_nitride.01-gs.inp
| Value | Reference | Precision | Status |
| -5.236158347500000e+02 | -5.236158307700000e+02 | 7.780000000000000e-06 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)