Match Hartree energy
Commits >
Commit 4eed2c655b9f478fca43a397c5feb863f7436add >
Run cmake_foss_2022a_min_mpi >
Input 12-boron_nitride.01-gs.inp
Value | Reference | Precision | Status |
-5.242796933900000e+02 | -5.242796937400001e+02 | 7.300000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)