Match nuclear pol. charge
Commits >
Commit bb686499811dbfe67b92ca3aeb5b2659998636fa >
Run spack_intel-2022a_impi_omp >
Input 32-tdpcm_methane.01-ground_state.inp
| Value | Reference | Precision | Status |
| 7.897282980000000e+00 | 7.897282980000000e+00 | 3.950000000000000e-07 | PASS |
Command: GREPFIELD(pcm/pcm_info.out, ' 9 ', 9)