Match Hartree energy
Commits >
Commit 23cadfdc08b3b148a9c434cb52e4be78ff32991e >
Run foss_min_autotools: [foss2023b-serial] >
Input 07-sic.02-scdm.inp
Value | Reference | Precision | Status |
1.818234504000000e+01 | 1.818233000000000e+01 | 9.090000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)