Match Hartree energy
Commits >
Commit db5a37a45dcf968be97880dd1f5766f32ce63f3a >
Run foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] >
Input 08-loewdin.02-intersite.inp
| Value | Reference | Precision | Status |
| 5.742183100000000e-01 | 5.742183100000000e-01 | 2.870000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)