Match Partial charge 3
Commits >
Commit c461bdde143a1ab201b7896fffa943f7e4c29d0f >
Run foss-mpi-full: [foss2023a-mpi] >
Input 16-scfinlcao_std.01-gs.inp
| Value | Reference | Precision | Status |
| 7.031000000000000e+00 | 7.032000000000000e+00 | 3.520000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 4)