Incorporation of a volume translation in an equation of state for fluid mixtures: which combining rule? which effect on properties of mixing?

• Published in: Fluid phase equilibria 2016-11, Vol.427, p.414-420
• Main Authors: Privat, Romain, Jaubert, Jean-Noël, Le Guennec, Yohann
• Format: Article
• Language: English
• Subjects: Chemical and Process Engineering; Engineering Sciences; Equation of state; Equations of state; Equilibrium conditions; Fluids; Mixing rules; Moles; Parameters; Phase equilibria; Preserves; Property of mixing; Reactive fluid environment; Translations; Volume correction; Volume translation
• ISSN: 0378-3812; 1879-0224
• DOI: 10.1016/j.fluid.2016.07.035

In a previous work, we showed that the incorporation of a temperature-dependent volume-translation parameter in an equation of state for pure components alters necessarily the prediction of 1-phase and 2-phase properties. On the contrary, if a temperature-independent volume translation parameter is used, most of the 1-phase and 2-phase properties are preserved. In the present study, the influence of the incorporation of a volume translation in an equation of state, on mixture properties (essentially phase equilibria and properties of mixing) is addressed. It is first assumed that the volume-translation parameter of a mixture (c) is related to mole fractions through a quadratic mixing rule involving mutual volume translation parameters (cij). It is found that only a simple arithmetic-mean combining rule for cij makes it possible to preserve phase equilibria. Using such a combining rule entails that the quadratic mixing rule for the c parameter degenerates to a linear mixing rule. Secondly, it is proved that properties of mixing (gM, hM, sM, cPM …) are preserved if a linear mixing rule is used for the c parameter and altered otherwise. [Display omitted]