Match Hartree energy
Commits >
Commit 12c5144371d4b1b6f2306d5bbdf3ce56936365b0 >
Run spack_foss-2022a_mpi >
Input 16-scfinlcao_std.01-gs.inp
Value | Reference | Precision | Status |
2.713253548410000e+03 | 2.713253548480000e+03 | 1.360000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)