Match Partial charge 30
Commits >
Commit 1d082993d3bad72c6bb5f6456239111dd26ba4bd >
Run foss-serial-full: [foss2023b-serial] >
Input 10-fullerene.01-gs.inp
Value | Reference | Precision | Status |
3.998000000000000e+00 | 3.998000000000000e+00 | 2.000000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 31)