Match Partial charge 4
Commits >
Commit 332f9cd714e196a805e42e2741bfb36d81a9f700 >
Run intel_omp_autotools: [intel2022a-serial] >
Input 20-eigensolver.04-evolution.inp
Value | Reference | Precision | Status |
9.610000000000000e-01 | 9.610000000000000e-01 | 4.810000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 5)