Match Hartree energy
Commits >
Commit 4eed2c655b9f478fca43a397c5feb863f7436add >
Run eb_intel-2022a_omp >
Input 14-fullerene_unpacked.01-gs.inp
Value | Reference | Precision | Status |
3.988936435550000e+03 | 3.988936413230000e+03 | 2.750000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)