Match molecule-solvent int. energy
Commits >
Commit ab5faecb27d88076e64ba8608dc3fc5641398a04 >
Run foss_ppc_autotools: [foss2022a-serial] >
Input 29-pcm_chlorine_anion.03-ground_state-n60-poisson.inp
Value | Reference | Precision | Status |
-3.216293760000000e+00 | -3.216293760000000e+00 | 1.610000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'E_M-solvent =', 3)