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Describing vapor-liquid equilibria in methanol +n-alkane systems by means of an equation of state with association

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Abstract

The ability of an equation of state incorporating association to describe vapor-liquid equilibrium of methanol +n-alkane systems has been tested. An equation of state with association is divided into “physical” and “chemical” parts, where the Patel-Teja cubic equation of state is used for the description of the physical part and an association tenn forms the chemical part. Five two- and threeparameter mixing rules were tested and compared with an equation of state without association. On the average for the first eight n-alkanes, the improvement in fit of pressure using association was 30–50 % and the calculated vapor compositions were also much improved. In addition, there were lewer points with unstable liquid phase (false liquid-liquid split). Both with and without association, density-dependent mixing rules based on a local-composition concept gave the best result.

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Vonka, P., Lovland, J. & Prokes, T. Describing vapor-liquid equilibria in methanol +n-alkane systems by means of an equation of state with association. Int J Thermophys 16, 227–236 (1995). https://doi.org/10.1007/BF01438973

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