Table 1.
Interaction Energies Balance (kJ/mol) for Different Solute–Solvent Systems
solute type | 〈Nwet〉a | ∊CC | Euvb | ||
---|---|---|---|---|---|
solute-I | 5.8 | 34.8 | 0.1 | −54.2 | |
0.2 | −96.1 | ||||
solute-II | 15.2 | 91.2 | 0.1 | −59.8 | |
0.2 | −177.4 | ||||
solute-III | 48.5 | 291.0 | 0.1 | −171.6 | |
0.2 | −540.1 |
Average number of intersolute water in the fully wet state.
Solute–solvent potential energy/2.