Match Hartree energy
Commits >
Commit f1dbe11076ccb3bb542605fe66566061d8720041 >
Run cmake_foss_2022a_min_serial >
Input 14-fullerene_unpacked.01-gs.inp
Value | Reference | Precision | Status |
3.988936437660000e+03 | 3.988936413230000e+03 | 2.750000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)