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

被引:214
作者
Kontogeorgis, Georgios M. [1 ]
Michelsen, Michael L. [1 ]
Folas, Georgios K. [1 ]
Derawi, Samer [1 ]
von Solms, Nicolas [1 ]
Stenby, Erling H. [1 ]
机构
[1] Tech Univ Denmark, Ctr Phase Equilibria & Separat Proc IVC SEP, Dept Chem Engn, DK-2800 Lyngby, Denmark
关键词
D O I
10.1021/ie051306n
中图分类号
TQ [化学工业];
学科分类号
0817 ;
摘要
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.
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收藏
页码:4869 / 4878
页数:10
相关论文
共 62 条
[1]  
Achary M. V. R., 1947, Trans., V1, P29
[2]   SAFT1 for associating fluids: Alkanols [J].
Adidharma, H ;
Radosz, M .
JOURNAL OF PHYSICAL CHEMISTRY B, 2001, 105 (40) :9822-9827
[3]  
[Anonymous], DECHEMA CHEM DATA 1
[4]   ASSOCIATION IN CARBOXYLIC-ACID ALIPHATIC ALCOHOL MIXTURES - THE BINARY-MIXTURES OF ACETIC-ACID WITH N-BUTANOL, N-HEXANOL, N-OCTANOL AND N-DODECANOL [J].
APELBLAT, A ;
TAMIR, A ;
WAGNER, M .
ZEITSCHRIFT FUR PHYSIKALISCHE CHEMIE-WIESBADEN, 1983, 137 (02) :129-137
[5]   ISOBARIC VAPOR-LIQUID-EQUILIBRIA OF METHANOL PLUS 1-OCTANOL AND ETHANOL PLUS 1-OCTANOL MIXTURES [J].
ARCE, A ;
BLANCO, A ;
SOTO, A ;
TOJO, J .
JOURNAL OF CHEMICAL AND ENGINEERING DATA, 1995, 40 (04) :1011-1014
[6]  
Arich G., 1958, Ric. Sci, V28, P2493
[7]  
Barr-David F, 1959, J CHEM ENG DATA, V4, P107, DOI DOI 10.1021/JE60002A003
[8]   Intra- and Intermolecular hydrogen bonding of 2-methoxyethanol and 2-butoxyethanol in n-hexane [J].
Brinkley, RL ;
Gupta, RB .
INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH, 1998, 37 (12) :4823-4827
[9]   The free energy of the normal aliphatic alcohols in aqueous solution - Part I The partial vapour pressures of aqueous solutions of methyl, n-propyl, and n-butyl alcohols - Part II The solubilities of some normal aliphatic alcohols in water - Part III The theory of binary solutions, and its application to aqueous-alcoholic solutions [J].
Butler, JAV ;
Thomson, DW ;
Maclennan, WH .
JOURNAL OF THE CHEMICAL SOCIETY, 1933, :674-686
[10]  
CORDINER J, 2003, ANN M EFCE WORK PART