Match Hartree energy
Commits >
Commit ee11de90c734467b7aebfc32d0117fe9ec1eea84 >
Run spack_foss-2022a_mpi >
Input 12-boron_nitride.02-gs_gamma.inp
| Value | Reference | Precision | Status |
| -5.223230991100000e+02 | -5.223230991099999e+02 | 2.610000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)