Match Hartree-Fock energy
Commits >
Commit 9c5e1a9ae4a97d24a493b8c6c0caa96edfef5d41 >
Run foss_mpi_debug_autotools: [foss2023a-mpi] >
Input 02-xc_2d.02-hf.inp
Value | Reference | Precision | Status |
3.718757500000000e-01 | 3.718757300000000e-01 | 1.000000000000000e-04 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)