Match molecule-solvent int. energy
Commits >
Commit f8aeac8acec97cad57d0dc81a915c34dc5591a3a >
Run foss-omp-full: [foss2023a-serial] >
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)