Table 6. Calculated and experimental excess chemical potentials of water.
Model | Δμ (kcal/mol) |
---|---|
mTIP3P | −6.33 ± 0.07 |
TIP3P-FB | −7.46 ± 0.05 |
TIP4P-FB | −7.50 ± 0.07 |
Expt. | −6.32, Ben-Naim & Marcus (1984) −5.74 Hermans, Pathiaseril & Anderson (1988) |