Match Hartree energy
Commits >
Commit 32c00845502bbc3ac64555e3c727792a7ab72a6a >
Run GCI_foss_min_autotools: [foss2022a-serial] >
Input 10-fullerene.01-gs.inp
Value | Reference | Precision | Status |
3.954895867620000e+03 | 3.954895867480000e+03 | 3.710000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)