What is the Optimal Dipole Moment for Nonpolarizable Models of Liquids?

J Chem Theory Comput · 2023 · PMC10061682 · PMID 36827585

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quite significantno p-value reported

The relatively poor performance of the gas-phase model for density and self-diffusion and of the liquid-phase model for enthalpy of vaporization is quite significant if we consider that they were fitted to match precisely those three properties for methanol.

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