Match Hartree energy
Commits >
Commit 119356330ffc33ec037b7259f31bc868121af1f1 >
Run spack_intel-2022a_serial_omp >
Input 18-TiO2.01-gs.inp
Value | Reference | Precision | Status |
4.244572586000000e+01 | 4.244572722000000e+01 | 2.880000000000000e-06 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)