Match Hartree energy
Commits >
Commit 4eed2c655b9f478fca43a397c5feb863f7436add >
Run eb_intel-2022a_impi >
Input 18-TiO2.01-gs.inp
Value | Reference | Precision | Status |
4.244572642000000e+01 | 4.244572722000000e+01 | 2.880000000000000e-06 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)