Match Partial charge 2
Commits >
Commit 45adf9b0e5ec0c590d65885bc40efffc0d377767 >
Run intel_omp_autotools: [intel2022a-serial] >
Input 24-o2-spin.01-gs.inp
Value | Reference | Precision | Status |
6.000000000000000e+00 | 6.000000000000000e+00 | 1.000000000000000e-01 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 3)