Match Partial charge 1
Commits >
Commit ab5faecb27d88076e64ba8608dc3fc5641398a04 >
Run foss-serial-min: [foss2022a-serial] >
Input 24-o2-spin.01-gs.inp
Value | Reference | Precision | Status |
6.000000000000000e+00 | 6.000000000000000e+00 | 1.000000000000000e-01 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 2)