Match nuclear pol. charge
Commits >
Commit 3c5618978387ff506850febf67c434621a2adfa2 >
Run cuda-serial: [foss2022a-cuda-mpi] >
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)