Match Hartree energy
Commits >
Commit 7ddcca10159cfd3a5f031627bc95daf6cfe3e221 >
Run spack_intel-2023a_impi >
Input 12-boron_nitride.02-gs_gamma.inp
| Value | Reference | Precision | Status |
| -5.224848078700001e+02 | -5.224848078699999e+02 | 2.610000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)