Match Hartree energy
Commits >
Commit eea8a333c8089a21a3b9f1d1480b55481f8cdee7 >
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)