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. 2018 Aug 14;6:e5472. doi: 10.7717/peerj.5472

Table A2. Absolute solvation energy of a water molecule in liquid hexadecane.

Model Elec. Disp. Rep. Total
mTIP3P −0.22 ± 0.04 −3.40 ± 0.06 4.80 ± 0.43 1.18 ± 0.53
TIP3P-FB −0.24 ± 0.02 −3.33 ± 0.09 4.69 ± 0.52 1.12 ± 0.63
TIP4P-FB −0.23 ± 0.03 −3.59 ± 0.14 4.78 ± 0.43 0.96 ± 0.60

Note:

Values are in kcal/mol.