Match Partial charge 1
Commits >
Commit 6d797cea4015e569c9484b6f40396252a005b517 >
Run spack_foss-2022a_serial_min >
Input 16-scfinlcao_std.01-gs.inp
Value | Reference | Precision | Status |
3.973000000000000e+00 | 3.973000000000000e+00 | 1.990000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 2)