Match Partial charge 2
Commits >
Commit b7dcc99023940be2b83de00317ffa33e598f3f55 >
Run foss_omp_autotools: [foss2023a-serial] >
Input 33-cg.01-orthogonalize_all.inp
| Value | Reference | Precision | Status |
| 9.690000000000000e-01 | 9.550000000000000e-01 | 4.780000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 3)