Match nuclear pol. charge
Commits >
Commit 4b7a334ce1857269604388697d6e11d007df5aba >
Run foss-2022a_mpi_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)