Match nuclei-solvent int. energy
Commits >
Commit 77b19a812457519ffe2e63888ffe5f5b10958dc8 >
Run eb_foss-2022a >
Input 32-tdpcm_methane.01-ground_state.inp
| Value | Reference | Precision | Status |
| -2.372987200000000e-01 | -2.372987200000000e-01 | 1.190000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'E_n-solvent =', 3)