Match Partial charge 1
Commits >
Commit e09e54217c6ccfa05cd54e62fc481dbeeea35df8 >
Run intel_omp_autotools: [intel2022a-serial] >
Input 33-cg.01-orthogonalize_all.inp
| Value | Reference | Precision | Status |
| 4.123000000000000e+00 | 4.123000000000000e+00 | 2.060000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 2)