An Equation of State for Associating Fluids and Vapour-Liquid Equilibria of Associating Mixtures

作者: Ki-Chang Kim , Mi Kyung Kim

DOI:

关键词:

摘要: The equation of state which combines Peng-Robinson EoS and the association term SAFT model was presented for describing thermodynamic properties phase behaviors associating fluids. resulting EoS(Peng- Robinson-Plus-Association) is not cubic with respect to volume contains five pure compound parameters. 5-param- eters chemical compounds were estimated correlations both saturated vapour pressures liquid vol- umes alcohols, primary amines, carboxyl acids water. A method reduce number adjustable parameters from three considered, then 3-parameters obtained. This 3- parameter maintained good volumes. Additionally proposed in this work applied calculations vapour-liquid equilibria binary mixtures containing chemicals, result showed a agreement experimental data all except ethanol/water system, examined work.

参考文章(35)
R. L. Danner, T. E. Daubert, Physical and thermodynamic properties of pure chemicals : data compilation Hemisphere Pub. Corp.. ,(1989)
Stanley H. Huang, Maciej Radosz, Equation of state for small, large, polydisperse, and associating molecules: extension to fluid mixtures Industrial & Engineering Chemistry Research. ,vol. 30, pp. 1994- 2005 ,(1991) , 10.1021/IE00056A050
Jeffrey P. Wolbach, Stanley I. Sandler, Using molecular orbital calculations to describe the phase behavior of cross-associating mixtures Industrial & Engineering Chemistry Research. ,vol. 37, pp. 2917- 2928 ,(1998) , 10.1021/IE970781L
Felipe J. Blas, Lourdes F. Vega, Prediction of Binary and Ternary Diagrams Using the Statistical Associating Fluid Theory (SAFT) Equation of State Industrial & Engineering Chemistry Research. ,vol. 37, pp. 660- 674 ,(1998) , 10.1021/IE970449+
Alejandro Gil-Villegas, Amparo Galindo, Paul J. Whitehead, Stuart J. Mills, George Jackson, Andrew N. Burgess, Statistical associating fluid theory for chain molecules with attractive potentials of variable range Journal of Chemical Physics. ,vol. 106, pp. 4168- 4186 ,(1997) , 10.1063/1.473101
B. A. Veytsman, Are lattice models valid for fluids with hydrogen bonds The Journal of Physical Chemistry. ,vol. 94, pp. 8499- 8500 ,(1990) , 10.1021/J100386A002
Ioannis G. Economou, George D. Ikonomou, P. Vimalchand, Marc D. Donohue, Thermodynamics of Lewis acid‐base mixtures Aiche Journal. ,vol. 36, pp. 1851- 1864 ,(1990) , 10.1002/AIC.690361209
Herbert Wenzel, Eugeniusz Krop, Phase equilibrium by equation of state: a short-cut method allowing for association Fluid Phase Equilibria. ,vol. 59, pp. 147- 169 ,(1990) , 10.1016/0378-3812(90)85032-6
C. Panayiotou, I. C. Sanchez, Hydrogen bonding in fluids: an equation-of-state approach The Journal of Physical Chemistry. ,vol. 95, pp. 10090- 10097 ,(1991) , 10.1021/J100177A086