A simultaneous method for phase identification and equilibrium calculations in reactive mixtures

Chemical Engineering Research and Design

Volumn 89, Issue 10, 2011, Pages 1901-1908

  Avami, Akram ^a   Saboohi, Yadollah ^a  

^a SHARIF UNIVERSITY OF TECHNOLOGY   (Iran)

Author keywords

Chemical equilibrium; Multiphase calculations; Reactive systems

Indexed keywords

CHEMICAL EQUILIBRIUMS; EQUILIBRIUM CALCULATION; GOVERNING EQUATIONS; MOLE FRACTION; PHASE IDENTIFICATION; PRIOR KNOWLEDGE; REACTIVE MIXTURES; REACTIVE SYSTEM; SIMULTANEOUS METHODS; THERMODYNAMIC MODEL;

PHASE EQUILIBRIA;

EID: 80052789645     PISSN: 02638762     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cherd.2010.12.013     Document Type: Article

References (24)

1. Balogh J., Csendes T., Stateva R.P. Application of a stochastic method to the solution of the phase stability problem: cubic equations of state. Fluid Phase Equilibria 2003, 212:257-267.
2. Bonilla-Petriciolet A., Bravo-Sanchez U.I., Castillo-Borja F., Frausto-Hernandez S., Segovia-Hernandez J.G. Gibbs energy minimization using simulated annealing for two-phase equilibrium calculations in reactive systems. Chemical and Biochemical Engineering Quarterly 2008, 22:285-298.
3. Castier M., Rasmussen P., Fredenslund A. Calculation of simultaneous chemical and phase equilibria in nonideal systems. Chemical Engineering Science 1989, 44:237-248.
4. Guo M., Wang S., Repke J.U., Wozny G. A simultaneous method for two- and three-liquid-phase stability determination. AIChE Journal 2004, 50:2571-2582.
5. Gupta A.K., Bishnoi P.R., Kalogerakis N. A method for the simultaneous phase equilibria and stability calculations for multiphase reacting and non-reacting systems. Fluid Phase Equilibria 1991, 63:65-89.
6. Han G., Rangaiah G.P. A method for multiphase equilibrium calculations. Computers and Chemical Engineering 1998, 22:897-911.
7. Jalali F., Seader J.D. Homotopy continuation method in multi-phase multi-reaction equilibrium systems. Computers and Chemical Engineering 1999, 23:1319-1331.
8. Jalali F., Seader J.D., Khaleghi S. Global solution approaches in equilibrium and stability analysis using homotopy continuation in the complex domain. Computers and Chemical Engineering 2008, 32:2333-2345.
9. Kiss A.A. Separative reactors for integrated production of bioethanol and biodiesel. Computers and Chemical Engineering 2010, 34:812-820.
10. Khaledi R., Bishnoi P.R. A method for modeling two- and three-phase reactive distillation columns. Industrial & Engineering Chemistry Research 2006, 45:6007-6020.
11. Maurer G. Vapor-liquid equilibrium of formaldehyde- and water-containing multicomponent mixtures. AIChE Journal 1986, 32:932-948.
12. McDonald C.M., Floudas C.A. Global optimization for the phase stability problem. AIChE Journal 1995, 41:1798-1814.
13. Michelsen M.L. The isothermal flash problem. Part I. Stability. Fluid Phase Equilibria 1982, 9:1-20.
14. Michelsen M.L. The isothermal flash problem. Part II. Phase split calculations. Fluid Phase Equilibria 1982, 9:21.
15. Omota F., Dimian A.C., Bliek A. Fatty acid esterification by reactive distillation. Part 1: Equilibrium-based design. Chemical Engineering Science 2003, 58:3159-3174.
16. Rangaiah G.P. Evaluation of genetic algorithms and simulated annealing for phase equilibrium and stability problems. Fluid Phase Equilibria 2001, 83:187-188.
17. Reid R.C., Prausnitz J.M., Poling B.E. The Properties of Gases and Liquids 1987, McGraw-Hill, New York.
18. Seader W.D., Widagdo S. Multiphase equilibria of reactive systems. Fluid Phase Equilibria 1996, 123:283-303.
19. Shyamsundar V., Rangaiah G.P. A method for simulation and optimisation of multiphase distillation. Computers and Chemical Engineering 2000, 24:23-37.
20. Stateva R.P., Wakeham W.A. Phase equilibrium calculations for chemically reacting systems. Industrial & Engineering Chemistry Research 1997, 36:5474-5482.
21. Sun A.C., Seider W.D. Homotopy-continuation method for stability analysis in the global minimization of the Gibbs free energy. Fluid Phase Equilibria 1995, 103:213-249.
22. Ung S., Doherty M.F. Vapor-liquid phase equilibrium in systems with multiple chemical reactions. Chemical Engineering Science 1995, 50:23-48.
23. Xiao W., Zhu K., Yuan W., Chien H.H. An algorithm for simultaneous chemical and phase equilibrium calculation. AIChE Journal 1989, 35:1813-1820.
24. Xu G., Haynes W.D., Stadtherr M.A. Reliable phase stability analysis for asymmetric models. Fluid Phase Equilibria 2005, 235:152-165.