Match Hartree energy
Commits >
Commit b2c9b4a951ad3e3faeb99c2d543d652f634c0371 >
Run cmake_foss_2022a_full_serial >
Input 12-boron_nitride.01-gs.inp
Value | Reference | Precision | Status |
-5.242796933400000e+02 | -5.242796937400001e+02 | 7.040000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)