Prediction of Saturation Densities and Critical Properties of n-Decane, n-Pentadecane, and n-Eicosane Using Molecular Dynamics with Different Force-Fields.

ACS Omega · 2022 · PMC9648167 · PMID 36385845

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a clear trendno p-value reported

For AMBER, a clear trend is observed where the percentage deviations seem to increase with the carbon number for all critical properties.

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Prediction of Saturation Densities and Critical Properties of <i>n</i>-Decane, <i>n</i>-Pentadecane, and <i>n</i>-Eicosane Using Molecular Dynamics with Different Force-Fields.

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