Match molecule-solvent int. energy
Commits >
Commit ff858744384f796bd1ad65ff45f26dd2d219c42c >
Run intel_mpi_autotools: [intel2023a-mpi] >
Input 29-pcm_chlorine_anion.01-ground_state-n60.inp
| Value | Reference | Precision | Status |
| -3.216044690000000e+00 | -3.216044690000000e+00 | 1.610000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'E_M-solvent =', 3)