Match Partial charge 5
Commits >
Commit b27eded3d993de0343d6f1363463df82eb2e5c60 >
Run foss-mpi-min: [foss2023a-mpi] >
Input 17-scfinlcao_alt.01-gs.inp
Value | Reference | Precision | Status |
7.024000000000000e+00 | 7.024000000000000e+00 | 3.510000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 6)