Match Partial charge 1
Commits >
Commit 4104ea28a473696fae3c7fad4406bf86d5f6976c >
Run intel_autotools: [intel2023a-serial] >
Input 20-eigensolver.06-rmmdiis-noscalapack.inp
Value | Reference | Precision | Status |
4.157000000000000e+00 | 4.157000000000000e+00 | 2.080000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 2)