Match Hartree energy
Commits >
Commit e7de9bbf531ff65a0d18444fdbe173713a455724 >
Run intel_autotools: [intel2023a-serial] >
Input 18-mgga.05-ncbr_oep.inp
Value | Reference | Precision | Status |
4.615016210000000e+00 | 4.615002520000000e+00 | 3.570000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)