Match Hartree energy
Commits >
Commit 9bb80dbc43fc7b1ccbcadf899a686fb8cb0164a9 >
Run intel-2022b_impi >
Input 18-TiO2.01-gs.inp
Value | Reference | Precision | Status |
4.244572617000000e+01 | 4.244572722000000e+01 | 2.880000000000000e-06 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)