Match electronic pol. charge
Commits >
Commit 04b2a32c6063188a192f0d4e38b2e2adad504be9 >
Run cmake_foss_2022a_full_serial >
Input 29-pcm_chlorine_anion.04-ground_state-n240.inp
Value | Reference | Precision | Status |
-7.840949930000000e+00 | -7.840949930000000e+00 | 3.920000000000000e-07 | PASS |
Command: GREPFIELD(pcm/pcm_info.out, ' 9 ', 7)