Match Hartree energy
Commits >
Commit ff858744384f796bd1ad65ff45f26dd2d219c42c >
Run foss_ppc_autotools: [foss2022a-serial] >
Input 16-scfinlcao_std.01-gs.inp
Value | Reference | Precision | Status |
2.713253508940000e+03 | 2.713253508940000e+03 | 1.360000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)