Match Hartree energy
Commits >
Commit d48128afc066bfe2b1bb5979f9ee62249e46c834 >
Run cmake_foss_2022a_min_mpi >
Input 12-boron_nitride.01-gs.inp
| Value | Reference | Precision | Status |
| -5.236158370300000e+02 | -5.236158373600000e+02 | 8.630000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)