Match Hartree energy
Commits >
Commit f2f698c8a25f386898063905e7c5eb25847969e0 >
Run spack_foss-2022a_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)