Match Hartree energy
Commits >
Commit 6099f031302cffa2938f492784ba2f7b55faffa3 >
Run foss_autotools: [foss2023a-serial] >
Input 07-mgga.04-br89_gs.inp
Value | Reference | Precision | Status |
4.246899410000000e+00 | 4.246899510000000e+00 | 2.120000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)