Match Hartree energy
Commits >
Commit 467aee6bb6aa6bf5b31aed5cccd88bd7f10f5124 >
Run intel-2022a_impi >
Input 17-scfinlcao_alt.01-gs.inp
Value | Reference | Precision | Status |
2.714909395650000e+03 | 2.714909395650000e+03 | 1.360000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)