Match electronic pol. charge
Commits >
Commit 57f8ca8d342504024fed98c8f4356f69f5870627 >
Run foss-omp-full: [foss2023a-serial] >
Input 29-pcm_chlorine_anion.04-ground_state-n240.inp
Value | Reference | Precision | Status |
-7.840514180000000e+00 | -7.840514180000000e+00 | 7.840000000000000e-14 | PASS |
Command: GREPFIELD(pcm/pcm_info.out, ' 9 ', 7)