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. Author manuscript; available in PMC: 2016 Mar 1.
Published in final edited form as: J Phys Chem B. 2015 Feb 26;119(29):9423–9437. doi: 10.1021/jp510896n

Table 5.

Mean absolute deviations (MADs) from experiment of the liquid phase properties calculated by AMOEBA14 across all temperatures (249K to 373K).

Property MAD Units
ρ 1.22 kg/m3
ΔHvap 0.43 kJ/mol
α 0.66 10−4/K
κ T 1.31 10−6/bar
Cp 2.28 cal/mol/K
ε(0) 1.51 N/A