Thermodynamic Modeling of Vapor-Liquid Equilibria and Excess Properties of the Binary Systems Containing Diethers and n-Alkanes by Cubic Equation of State

Slobodan P. Serbanovi; Ivona R. Grguri; Mirjana Lj. Kijev anin; Aleksandar . Tasi; Bojan D. Djordjevi

Korean Journal of Chemical Engineering, Vol.21, No.4, 858-866, July, 2004

Slobodan P. Serbanovi, Ivona R. Grguri, Mirjana Lj. Kijev anin, Aleksandar . Tasi, and Bojan D. Djordjevi^†

Department of Chemical Engineering, Faculty of Technology and Metallurgy, University of Belgrade, 11120 Belgrade, Karnegijeva 4, Serbia and Montenegro, Korea

E-mail:

A comparison of the performances of two different approaches of cubic equations of state models, based on a classical van der Waals and mixing rules incorporating the G^E equation, was carried out for correlation of Vapor-Liquid Equilibria (VLE), H^E and c_P^E data alone, and simultaneous correlation of VLE+H^E, VLE+c_P^E, H^E+c_P^E and VLE+H^E+c_P^E data for the diethers (1,4-dioxane or 1,3-dioxolane) with n-alkane systems. For all calculations the Peng-Robinson-Stryjek-Vera cubic equation of state (PRSV CEOS) was used. A family of mixing rules for the PRSV CEOS based on the Modified van der Waals one-fluid mixing rule (MvdW1) and two well-known CEOS/G^E mixing rules (MHV1 and MHV2), was considered. The NRTL equation, as the G^E model with linear or reciprocal temperature dependent parameters, was incorporated in the CEOS/GE models. The results obtained by the CEOS/GE models exhibit significant improvement in comparison to the MvdW1 models.

Keywords:Cubic Equation of State;Thermodynamic Properties;Diether;n-Alkane;Simultaneous Correlation

[References]

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Calvo E, Brocos P, Bravo R, Pintos M, Amigo A, Roux AH, Roux-Desgranges G, J. Chem. Eng. Data, 43(1), 105 (1998)
Dahl S, Michelsen ML, AIChE J., 36, 1829 (1990)
Djordjevic BD, Kijevcanin ML, Serbanovic SP, Fluid Phase Equilib., 155(2), 205 (1999)
Djordjevic BD, Grguric IR, Kijevcanin ML, Tasic AZ, Serbanovic SP, "Simultaneous Representation of Binary H^E and c_p^E Data Usingthe PRSV-MHV-1 Model," ICheaP-4, The Fourth Italian Conference on Chemical and Process Engineering, Florence (1999)
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Djordjevic BD, Kijevcanin ML, Tasic AZ, Serbanovic SP, J. Serb. Chem. Soc., 64, 801 (1999)
Grguric IR, Serbanovic SP, Kijevcanin ML, Tasic AZ, Djordjevic BD, Thermochim. Acta, 412, 25 (2004)
Heidemann RA, Fluid Phase Equilib., 116, 454 (1996)
Hooke R, Jeeves TA, J. Assoc. Comput. Mach., 8, 212 (1961)
Kang SP, Lee H, Lee YW, Lee YY, Korean J. Chem. Eng., 12(5), 535 (1995)
Kijevcanin ML, Djordjevic BD, Serbanovic SP, Grguric IR, Tasic AZ, Phys. Chem. Liquids, 42, 147 (2004)
Knudsen K, Stenby EH, Fredenslund A, Fluid Phase Equilib., 82, 361 (1993)
Malanowski S, Anderko A, "Modeling Phase Equilibria. Thermodynamic Background and Practical Tools," John Wiley & Sons, Inc., New York (1992)
Michelsen ML, Fluid Phase Equilib., 60, 213 (1990)
Ohta T, Fluid Phase Equilib., 129(1-2), 89 (1997)
Orbey H, Sandler SI, Fluid Phase Equilib., 121(1-2), 67 (1996)
Orbey H, Sandler SI, Fluid Phase Equilib., 111(1), 53 (1995)
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Park BH, Yoo KP, Lee CS, Fluid Phase Equilib., 212(1-2), 221 (2003)
Renon H, Prausnitz JM, AIChE J., 14, 135 (1968)
Sandler SI, Orbey H, "Mixing and Combining Rules," Equation of State for Fluid and Fluid Mixtures, Part I, Sengers, J.V., Kayser, R.F., Peters, C.J. and White Jr., H.J., eds., Elsevier, Amsterdam (2000)
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Sandler SI, "Models for Thermodynamics and Phase Equilibria Calculations," Marcel-Dekker, New York (1994)
Schwartzentruber J, Renon H, Ind. Eng. Chem. Res., 28, 1049 (1989)
Stryjek R, Vera JH, Can. J. Chem. Eng., 64, 323 (1986)
Tassios D, vanWinkle M, J. Chem. Eng. Data, 12, 555 (1967)
Valderrama JO, Silva A, Korean J. Chem. Eng., 20(4), 709 (2003)
Voros NG, Tassios DP, Fluid Phase Equilib., 91, 1 (1993)
Wu HS, Sandler SI, J. Chem. Eng. Data, 34, 209 (1989)

[Referenced By]

[1] Anderko A, Fluid Phase Equilib., 61, 145 (1990)

[2] Brocos P, Calvo E, Amigo A, Bravo R, Pintos M, Roux AH, Roux-Desgranges G, J. Chem. Eng. Data, 43(1), 112 (1998)

[3] Calvo E, Brocos P, Bravo R, Pintos M, Amigo A, Roux AH, Roux-Desgranges G, J. Chem. Eng. Data, 43(1), 105 (1998)

[4] Dahl S, Michelsen ML, AIChE J., 36, 1829 (1990)

[5] Djordjevic BD, Kijevcanin ML, Serbanovic SP, Fluid Phase Equilib., 155(2), 205 (1999)

[6] Djordjevic BD, Grguric IR, Kijevcanin ML, Tasic AZ, Serbanovic SP, "Simultaneous Representation of Binary H^E and c_p^E Data Usingthe PRSV-MHV-1 Model," ICheaP-4, The Fourth Italian Conference on Chemical and Process Engineering, Florence (1999)

[7] Djordjevic BD, Kijevcanin ML, Orlovic JP, Serbanovic SP, J. Serb. Chem. Soc., 66, 213 (2001)

[8] Djordjevic BD, Kijevcanin ML, Tasic AZ, Serbanovic SP, J. Serb. Chem. Soc., 64, 801 (1999)

[9] Grguric IR, Serbanovic SP, Kijevcanin ML, Tasic AZ, Djordjevic BD, Thermochim. Acta, 412, 25 (2004)

[10] Heidemann RA, Fluid Phase Equilib., 116, 454 (1996)

[11] Hooke R, Jeeves TA, J. Assoc. Comput. Mach., 8, 212 (1961)

[12] Kang SP, Lee H, Lee YW, Lee YY, Korean J. Chem. Eng., 12(5), 535 (1995)

[13] Kijevcanin ML, Djordjevic BD, Serbanovic SP, Grguric IR, Tasic AZ, Phys. Chem. Liquids, 42, 147 (2004)

[14] Knudsen K, Stenby EH, Fredenslund A, Fluid Phase Equilib., 82, 361 (1993)

[15] Malanowski S, Anderko A, "Modeling Phase Equilibria. Thermodynamic Background and Practical Tools," John Wiley & Sons, Inc., New York (1992)

[16] Michelsen ML, Fluid Phase Equilib., 60, 213 (1990)

[17] Ohta T, Fluid Phase Equilib., 129(1-2), 89 (1997)

[18] Orbey H, Sandler SI, Fluid Phase Equilib., 121(1-2), 67 (1996)

[19] Orbey H, Sandler SI, Fluid Phase Equilib., 111(1), 53 (1995)

[20] Panagiotopoulos AZ, Reid RC, "New Mixing Rule for Cubic Equations of State for Highly Polar, Asymmetric Systems," Equation of State Theories and Applications, Chao, K.C. and Robinson Jr., R.L., Eds., ACS Symposium Series 300, American Chemical Society, Washington, DC (1986)

[21] Park BH, Yoo KP, Lee CS, Fluid Phase Equilib., 212(1-2), 221 (2003)

[22] Renon H, Prausnitz JM, AIChE J., 14, 135 (1968)

[23] Sandler SI, Orbey H, "Mixing and Combining Rules," Equation of State for Fluid and Fluid Mixtures, Part I, Sengers, J.V., Kayser, R.F., Peters, C.J. and White Jr., H.J., eds., Elsevier, Amsterdam (2000)

[24] Sandler SI, Orbey H, "Modeling Vapor-Liquid Equilibria. Cubic Equation of State and Their Mixing Rules," Cambridge Series in Chemical Engineering: Cambridge University Press (1998)

[25] Sandler SI, "Models for Thermodynamics and Phase Equilibria Calculations," Marcel-Dekker, New York (1994)

[26] Schwartzentruber J, Renon H, Ind. Eng. Chem. Res., 28, 1049 (1989)

[27] Stryjek R, Vera JH, Can. J. Chem. Eng., 64, 323 (1986)

[28] Tassios D, vanWinkle M, J. Chem. Eng. Data, 12, 555 (1967)

[29] Valderrama JO, Silva A, Korean J. Chem. Eng., 20(4), 709 (2003)

[30] Voros NG, Tassios DP, Fluid Phase Equilib., 91, 1 (1993)

[31] Wu HS, Sandler SI, J. Chem. Eng. Data, 34, 209 (1989)