Match Partial charge 4
Commits >
Commit b7dcc99023940be2b83de00317ffa33e598f3f55 >
Run foss_min_autotools: [foss2022a-serial] >
Input 33-cg.02-additional_terms.inp
Value | Reference | Precision | Status |
9.690000000000000e-01 | 9.550000000000000e-01 | 4.780000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 5)