Match Partial charge 1
Commits >
Commit dbbd967b788cdda4a2df74a46ac2e5066a09d99b >
Run foss-serial-full: [foss2023b-serial] >
Input 16-scfinlcao_std.01-gs.inp
Value | Reference | Precision | Status |
3.966000000000000e+00 | 3.973000000000000e+00 | 1.990000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 2)