Match Hartree energy
Commits >
Commit fa579c158b779976d5f0fa5d04f6d011c21f022f >
Run spack_foss-2022a_serial >
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)