Match Partial charge 2
Commits >
Commit 45adf9b0e5ec0c590d65885bc40efffc0d377767 >
Run foss-serial-min: [foss2023a-serial] >
Input 17-scfinlcao_alt.01-gs.inp
Value | Reference | Precision | Status |
9.460000000000000e-01 | 9.460000000000000e-01 | 4.730000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 3)