Match molecule-solvent int. energy
Commits >
Commit bb161c2d0107cec853e686df3a469ebc444968d7 >
Run intel_mpi_autotools: [intel2023a-mpi] >
Input 29-pcm_chlorine_anion.04-ground_state-n240.inp
| Value | Reference | Precision | Status |
| -3.210196400000000e+00 | -3.210196400000000e+00 | 1.610000000000000e-06 | PASS |
Command: GREPFIELD(static/info, 'E_M-solvent =', 3)