Match Hartree energy
Commits >
Commit bb161c2d0107cec853e686df3a469ebc444968d7 >
Run foss_min_autotools: [foss2023a-serial] >
Input 10-fullerene.01-gs.inp
Value | Reference | Precision | Status |
3.954895867620000e+03 | 3.954895868660000e+03 | 9.079999999999999e-06 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)