Match Hartree energy
Commits >
Commit a4341ac9f169107ec4cef5019cc6269df7c401ac >
Run cmake_foss_2022a_min_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)