Características y aplicaciones de ecuaciones de estado en la ingeniería química. Avances recientes. Parte 1.
DOI:
https://doi.org/10.17533/udea.redin.326569Keywords:
Ecuaciones de estado, métodos de contribución de grupos, ecuaciones.Abstract
Se hace una revisión de las principales ecuaciones de estado desde su surgimiento hasta la fecha, con especial énfasis en las ecuaciones de estado cúbicas, las del virial y las basadas en simulación molecular, su aplicación a la ingeniería química de procesos y su conjunción con los métodos de contribuciones de grupos. Otras ecuaciones de estado se tratan en la segunda parte de esta revisión.Downloads
References
Westhaus, U. et al. "DETHERM, a thermophysical property database". En: Fluid Phase Equilibria. Vol. 159. No. l. 1999. pp. 429-435.
Walas, S.M. Phase Equilibria in Chemical Engineering. Boston. Butterworth Publishers. 1985.
Poling B. E. et al. The Properties of Gases and Liquids. Nueva York. McGraw-Hill. 2001.
Marrero, J. y E. Pardillo. "Estimation of pure compounds properties using group-interaction contributions". En: AIChE Journal. Vol. 45. No. 1. 1999. pp. 615-622.
Gani, R. y L. Constantinou. "Molecular Structure Based Estimation of Properties for Process Design". En: Fluid Phase Equilibria. Vol. 116. No. 1. 1996. pp. 75-86.
Marmur, A. "Mathematical Properties of Equations of State". En: Chemical Engineering Science. Vol. 40. No.1l. 1985. pp. 1.881-1.884.
Smith, J. M. et al. Introducción a la Termodinámica en Ingeniería Química. México. McGraw-Hill. 1997.
Sandler, S. l. y B. l. Lee. "Equations of State". En: Model for Thermodynamycs and Phase Equilibria Calculations. Nueva York. Marcel Dekker Inc. 1994.
Riedlich, O. y J. N. S. Kwong. "On therrnodynamics of solutions V: An equation of state. Fugacities of gaseous solutions". En: Chemical Review. Vol. 44. 1949. pp. 233-244.
Wilson, G. M. "Vapor-liquid equilibria correlated by means of a modified Riedlich-Kwong equation of state". En: Advances in Cryogenic Engineering. Vol. 9. No. 1. 1964. pp. 168-176.
Soave, G. "Equilibrium constants from a modified Riedlich-Kwong equation of state". En: Chemical Engineering Science. Vol. 27. No. 1. 1972. pp. 1.197-1.203.
Graboski, M. S. y T. E. Daubert. "A modified Soave equation of state for phase equilibria calculations". En: Industrial Engineering and Chemical Process Design and Development. Vol. 17. No. 1. 1978. pp. 443-448.
Soave, G. "Rigorous and simplified procedures for determining the pure-component parameters in the Riedlich-Kwong-Soave equation of state". En: Chemical Engineering Science. Vol. 35. No. 1. 1980. pp. 1.725-1.729.
Peng, D. Y. y D. B. Robinson, "A new two-constant equation of state". En: Industrial Chemical Engineering Fundamentals. Vol. 15. No. l. 1976. p. 59-64.
Schmidt, G. y Wenzel, H. "A modified Van der Waals type of equation of state". En: Chemical Engineering Science. Vol. 35. No. l. 1980. pp. 1.503-1.512.
Patel, N. C. y Teja, A. S. "A new cubic equation of state for fluid and fluid mixtures". En: Chemical Engineering Science. Vol. 37. No. 1. 1982. pp. 463-473.
Stryjek, R. y Vera, J. H. "An improved Peng-Robinson equation of state for accurate vapour-liquid equilibrium calculations". En: The Canadian Journal of Chemical Engineering. Vol. 64. No. 1. 1986. pp. 334-340.
Adroulakis, l. P. et al. "Thermophysical properties of pure polar and non-polar compounds with a modified vdW-711 equation of state". En: Fluid Phase Equilibria. Vol. 45. No. 1. 1989. pp. 135-163.
Melhern, G. A., Saini, R. et al. "An modified PengRobinson equation of state". En: Fluid Phase Equilibria. Vol. 47. No. 1. 1989. pp. 189-237.
Twu, C. H. et al. "A new generalized alpha function for a cubic equation of state. Part 1 Peng-Robinson equation". En: Fluid Phase Equilibria. Vol. 105. No. 1. 1995. pp. 49-59.
Twu, C. H. et al. "A new generalized alpha function for a cubic equation of state. Part 2 Riedlich-Kwong equation". En: Fluid Phase Equilibria. Vol. 105. No. 1. 1995. pp. 61-69.
Huang, S. H. y Radosz, M. "Equation of state for small, large, polydisperse and associating molecules". En: Industrial Engineering and Chemistry Research. Vol. 29. No. 1. 1990. pp. 2.284-2.294.
Pheneloux, A. et al. "Aconsistent correction for RiedlichKwong-Soave volumes". En: Fluid Phase Equilibria. Vol. 8. No. l. 1982. pp. 7-23.
Adachj, Y. et al. "Simplest equation of state for vapourliquid equilibrium calculations". En: AIChE Journal. Vol. 30. No. l. 1985. pp. 991-993.
Adachi, Y. et al. "Taking advantage of available cubic equations of state". En: Tire Canadian Journal of Chemical Engineering. Vol. 68. No. 1. 1990. pp. 639-644.
Karlströn, A. "An improved SRK equation for the estimation of concentrations by inferential measurements". En: Chemical Engineering Technology. Vol. 14. No. 1. 1991. pp. 20-28.
Seader, J. D. et al. "Distillation ". En: Perry's Chemical Engineers Handbook. Nueva York. McGraw-Hill. 1999.
Segura, H. et al. "Prediction of azeotropic behavior using equations of state". En: Fluid Phase Equilibria. Vol. 166. No. 1. 1999. pp. 141-162.
Elsharkawy, A. M. y Foda, S. G. "EOS. Simulation and GRNN modeling of the constant volume depletion behavior of gas condensate reservoirs". En: Energy & Fuels. Vol. 12. No. 1. 1998. pp. 353-364.
Bett, K. E. et al. Thermodynamics for Chemical Engineers. Londres. The Athlone Press of the University of London. 1975.
Dymond, J. H. y Smith, E. B. The Virial Coefficients of Pure Gases and Mixtures: A Critical Compilation. Oxford. Claredon Press. 1980.
Gibbon, R. M. "Equations for the Second Virial Coefficient of Polar Molecule". En: Cryogenics. Vol. 14. No. 7. 1974. pp. 399-403.
Hayden, J. G. y O'Conell. "A generalized method for predicting Second Virial Coefficients". En: Industrial Engineering and Chemical Process Design and Development. Vol. 14. No. 1. 1975. pp. 209-216.
Tarakad, R. R. y Danner, D. P. "A improved corresponding state method for polar fluids: Correlation of second virial coefficients". En: AIChE Journal. Vol. 23. No. J. 1977. p. 685-695.
Benedict, M. et al. "An empirical equation for thermodynamic properties of light hydrocarbons and their mixtures". En: Journal of Chemical Physics. Vol. 8. No. 1. 1940. pp. 334-345.
Cooper, H. W. y Goldfrank, J. C. "BWR constants and new correlations". En: Hydrocarbon Processing. Vol. 46. No. l. 1967. p. 141.
Gómez-Nieto, M. y Todos, G. "BWR parameters for ethanol". En: The Canadian Journal of Chemical Engineering. Vol. 54. No. 1. 1976. pp. 438-440.
Gómez-Nieto, M. y Todos, G. "Vapor-liquid equilibrium behavior for the propane-acetone system at elevated pressures". En: Chemical Engineering Science. Vol. 33. No. 1. 1978. pp. 1.589-1.595.
Nishiumi, H. "A improved generalized BWR equation of state with three polar parameters aplicable to polar substances. En: Journal of Chemical Engineering of Japan. Vol. 13. No. 1. 1980. pp. 178-183.
Bishnoi, P. R. y Robinson, D. B. "Mixing rules improve BWR use". En: Hydrocarbon Procesing". Vol. 51. No. 1. 1972. p. 152-156.
Bishnoi, P. R. y Robinson, D. B. "New mixing rules for the BWR parameters to predict mjxtures properties". En: The Canadian Journal of Chemical Engineering. Vol. 50. No. 1. 1972. pp. 101-107.
Nishiumi, H. y Saito, S. "Correlation of the binary interaction parameter of the modified generalized BWR equation of state". En: Journal of Chemical Engineering of Japan. Vol. 10. No. 1. 1977. pp. 176-180.
Yamada T. "A improved generalized equation of state". En: AIChE Journal. Vol. 19. No. 1. 1973. pp. 286-291.
McCarty, R. D. "A modified BWR equation of state for methane using recent experimental data". En: Cryogenics. Vol. 14. No. 5. 1974. pp. 276-280.
Kedge, C. J. y Trebble, M. A. "Development of a new empirical non-cubic equation of state". En: Fluid Phase Equilibria. Vol. 158-160. 1999. pp. 219-228.
Starling, K. E. Fluid Thermodynamic Properties of Light Petroleum Systems. Houston. Gulf Publishing Company. 1973.
Lin C. J. y Hopke, S. W. "Application of the BWRS equation to methane, ethane, propane, and nitrogen systems". En: AIChE Symposium Series. Vol. 140. No. 1. 1974. pp. 37-47.
Carnahan, N. F. y Starling, K. E. "lntemolecular repulsions and the equation of state for fluids". En: AIChE Journal. Vol. 18. No. 1. 1972. pp. 1.184-1.189.
Kim, C. H. et al. "Local composition model for chainlike molecules: Anew simplified version ofthe perturbed cha in theory". En: AIChE Journal. Vol. 32. No. 1. 1986. pp. 1.726-1.734.
Boublik, T. "Hard convex body equation of state". En: Journal of Chemical Physics. Vol. 63. No. 1. 1975. pp. 4.084-4.093.
Tildesley, D. J. y Streett, W. D. "An equation of state for hard dumbbell fluids ". En: Molecular Physics. Vol. 41. No. 1. 1980. pp. 85-94.
Honell, K. G. y Hall, C. K. "A new equation of state for a thermal chains". En: Journal of Chemical Physics. Vol. 90. No. 1. 1989. pp.1.841-1.855.
Alder, B. J. et al. "Studies in molecular dynamics. X. Corrections to the augmented Van der Waals theory for the square-well fluid''. En: Journal of Chemical Physics. Vol. 56. No. J. 1972. pp. 3.013-3.021.
Beret, S. y Prausni;,z, J. M. " Perturbed hard-chain theory: An equation of state for small and large molecules". En: AJChE Journal. Vol. 21. No. 1. 1975. pp. 12-20.
Beret, S. y Prausnitz, J. M. "A ge:neralized Van der Waals equation for polyrner and another fluids". • En: Macromolecules. Vol. 8. No. l. 1975. pp. 878-882.
Donohue, M. D. y Prausnitz, J. M. "Perturbed hardchain theory for fluid mixture: Thermodynamic properties for mixtures in natural gas and petroleum technology". En: AIChE Journal. Vol. 24. No. 1. 1978. pp. 849-859.
Ikonomu, G. D. y Donohue, M. D. "Compact: A simple equation of state for associated molecules". En: Fluid Phase Equilibria. Vol. 33. No. 1. 1988. pp. 61-90.
Ikonomu, G. D. y Donohue, M. D. "Extension of the associated perturbed anisotropic chain theory to mixtures with more than one associating component". En: Fluid Phase Equilibria. Vol. 39. No. 1. 1987. pp. 129-159.
Ikonomu, G. D. y Donohue, M. D. "Thermodynamics of hydrogen bonded molecules: The associated perturbed anisotropic chain theory". En: AIChE Journal. Vol. 32. No. 1. 1986. pp. 1.716-1.724.
Lee, M. J. y Chao, K. C. "Augmented BACK equation of state for polar fluids". En: AIChE Journal. Vol. 3. No. J. 1988. pp. 825-833.
Chapman, W. G. et al. "A new reference equation of state for associating liquids". En: Industrial Engineering and Chemistry Research. Vol. 29. No. 1. 1990. pp. l. 709-1. 721.
Huang, S. H. y Radosz, M. "Equation of state for small, large, polydisperse and associating molecules. Extension to fluid mixtures". En: Industrial Engineering and Chemistry Research. Vol. 29. No. 1. 1991. pp. 2.284-2.294.
Adidharma, H. y Radosz, M .. "Square-well SAFT equation of state for homopolymeric and heteropolymeric fluids". En: Fluid Phase Equilibria, Vol. 158-160. No. 1. 1999. pp. 165-174.
Chang, J. y Sandler, S. l. "An Equation of State for the .Hard-Sphere Chain Fluid: Theory and Monte Carlo Simulation". En: Chemical Engineering Science. Vol. 49. No. 1. 1994. pp. 2.777-2.785.
Ghonasgi, D. y Chapman, W. G. "Theory and Simulation for Associating Hard Chain Fluids". En: Molecular Physics. Vol. 83. No. 1. 1994. pp. 145-154.
Tavares, F. W. et al. "Equation of State for the SquareWell Chain Fluid Based on the Dimer Version of Wertheim's Perturbation Theory". En: Molecular Physics. Vol. 86. No. 1. 1995. pp. 451-457.
Gil-Villegas, A. et al. "Statistical Associating Fluid Theory for Chain Molecules with Attractive Potentials of Variable Range". En: Journal of Chemical Physics. Vol. 106. No. 1. 1997. pp. 4.168-4.176.
Pfohl, O. y Brunner, G. "2. Use of BACK to modify SAFT in order to enable density and phase equilibrium calculations connected to gas-extraction processes". En: Industrial Engeneering and Chemistry Research. Vol. 37. 1998. pp. 2.966-2.976.
Kiselev, S. B. y Ely, J. F. "Crossover SAFT Equation of State: Application for normal Alkanes". En: Industrial Engineering and Chemistry Research. Vol. 38. No. 1. 1999. pp. 4.993-5.004.
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