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Journal article

Ten years with the CPA (Cubic-Plus-Association) equation of state. Part 2. Cross-associating and multicomponent systems

From

Center for Phase Equilibria and Separation Processes, Department of Chemical and Biochemical Engineering, Technical University of Denmark1

Department of Chemical and Biochemical Engineering, Technical University of Denmark2

Center for Energy Resources Engineering, Centers, Technical University of Denmark3

In this second article of the review on the applications of the CPA (Cubic-Plus-Association) equation of state, the focus is placed on cross-associating systems. Various such mixtures are investigated, including (i) systems with two self-associating compounds ( e. g., water-alcohol systems or glycols, mixtures with organic acids, or two alcohols) but also binaries with only one self-associating substance, where solvation is expected (e.g., CO2 or styrene with water).

The method of accounting for cross-association ( combining rules) and the association scheme of alcohols are investigated. Finally, the manuscript concludes with a summary of current capabilities and limitations of CPA and a list of future challenges.

Language: English
Year: 2006
Pages: 4869-4878
ISSN: 15205045 and 08885885
Types: Journal article
DOI: 10.1021/ie051306n
ORCIDs: Kontogeorgis, Georgios , von Solms, Nicolas and Stenby, Erling Halfdan

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