Match Hartree energy
Commits >
Commit db5a37a45dcf968be97880dd1f5766f32ce63f3a >
Run valgrind: [foss2023a-serial] >
Input 18-mgga.02-br89_oep.inp
Value | Reference | Precision | Status |
4.641738290000000e+00 | 4.641734400000000e+00 | 1.920000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)