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Molecular Physics

An International Journal at the Interface Between Chemistry and Physics

Volume 100, 2002 - Issue 14

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Original Articles

Excess thermodynamic properties of chainlike mixtures. II. Self-associating systems: predictions from soft-SAFT and molecular simulation

FELIPE J. BLAS Departamento de Física Aplicada, Escuela Politécnica Superior, Universidad de Huelva, 21819, La Rábida, Huelva, Spain

Pages 2221-2240 | Received 24 Sep 2001, Accepted 31 Jan 2002, Published online: 25 Nov 2009

Cite this article
https://doi.org/10.1080/00268970210130209

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McGlashan , M. L. 1985 . Pure appl. Chem. , 57 : 89
Google Scholar
McGlashan , M. L. 1985 . J. chem. Thermodyn. , 17 : 301
Google Scholar
Schneider , G. M. 1991 . Pure appl. Chem. , 63 : 1313
Web of Science ®Google Scholar
Sengers , J. V. , Kayser , R. F. , Peters , C. J. and White , H. J. Jr. 2000 . Equations of State for Fluids and Fluid Mixtures Amsterdam : Elsevier .
Google Scholar
Rowlinson , J. S. and Swinton , F. J. 1982 . Liquids and Liquid Mixtures, , 3rd Edn London : Butterworths .
Google Scholar
Staveley , L. A. K. and Spice , B. 1952 . J. chem. Soc. , : 406
Google Scholar
Van Ness , H. C. , Soczek , C. A. , Peloquin , G. L. and Machado , R. L. 1967 . J. chem. Eng. Data , 12 : 217
Google Scholar
Van Ness , H. C. , Soczek , C. A. and Kochar , N. K. 1967 . J. chem. Eng. data , 12 : 346
Google Scholar
Brown , I. , Fock , W. and Smith , F. 1969 . J. chem. Thermodyn. , 1 : 273
Google Scholar
Díaz Peña , M. and Rodríquez Cheda , D. 1970 . An. Quim. , 66 : 637
Google Scholar
Ruel , M. 1973 . An. Quim. , 69 : 821
Google Scholar
Marsh , K. N. and Burfitt , C. 1975 . J. chem. Thermodyn. , 7 : 955
Web of Science ®Google Scholar
Gupta , B. M.C.V. , Naidu , P. R. and Rao , M. V. P. 1976 . J. chem. Thermodyn. , 8 : 191
Google Scholar
Stokes , R. H. and Burfitt , C. 1973 . J. chem. Thermodyn. , 5 : 623 1975, J. chem. Thermodyn. 3, 955;Marsh, K. N., and Allan, W. A., 1977, J. chem. Thermodyn. 9, 1109;Stokes, R. H., Adamson, M., and Richards, A., 1979, J. chem. Thermodyn. 111, 303;French, H. T., Richards, A., and Stokes, R. H., 1979, J. chem. Thermodyn. 11, 671
Google Scholar
Christensen , J. J. , Izatt , R. M. , Stitt , B. D. and Hanks , R. W. 1979 . J. chem. Thermodyn. , 11 : 261
Web of Science ®Google Scholar
Wei , I.-Ch. and Rowley , R. L. 1984 . J. chem. Eng. Data , 29 : 332
Google Scholar
Bero , C. 1986 . Sel. Data Mixtures A , 62 : 64
Google Scholar
Ormanoudis , C. , Daikos , C. and Panayiotou , C. 1991 . J. chem. Eng. Data , 36 : 39
Google Scholar
Papalpoannou , D. , Ziakas , D. and Panayiotou , C. 1991 . J. chem. Eng. Data , 36 : 35
Google Scholar
Lemon , L. R. , Moore , J. D. , Brown , P. R. and Ott , J. B. 1996 . J. chem. Thermodyn. , 28 : 187
Google Scholar
Treszczanowicz , J. A. and Benson , G. C. 1977 . J. chem. Thermodyn. , 9 : 1189
Web of Science ®Google Scholar
Treszczanowicz , J. A. and Benson , G. C. 1978 . J. chem. Thermodyn. , 10 : 967
Web of Science ®Google Scholar
Treszczanowicz , J. A. and Benson , G. C. 1980 . J. chem. Thermodyn. , 12 : 173
Google Scholar
Treszczanowicz , J. A. and Benson , G. C. 1981 . J. chem. Thermodyn. , 13 : 253
Web of Science ®Google Scholar
Kumaran , M. K. and Benson , G. C. 1981 . J. chem. Thermodyn. , 15 : 245
Google Scholar
Treszczanowicz , J. A. and Benson , G. C. 1984 . J. chem. Thermodyn. , 16 : 237
Google Scholar
Treszczanowicz , J. A. and Benson , G. C. 1984 . J. chem. Thermodyn. , 16 : 175
Google Scholar
Treszczanowicz , J. A. and Benson , G. C. 1985 . Fluid Phase Equilibria , 23 : 117
Web of Science ®Google Scholar
Kaur , H. , Samra , N. S. , Mahl , B. S. , Khurma , J. R. , Bender , M. and Heintz , A. 1991 . Fluid Phase Equilibria , 67 : 241
Web of Science ®Google Scholar
Bender , M. and Heintz , A. 1993 . Fluid Phase Equilibria , 89 : 197
Google Scholar
Heintz , A. 1985 . Ber. Bunsenges. phys. Chem. , 89 : 172
Web of Science ®Google Scholar
Funke , H. , Wetzel , M. and Heintz , A. 1989 . Pure appl. Chem. , 61 : 1429
Web of Science ®Google Scholar
Amigo , A. , Legido , J. L. , Bravo , R. and Paz Andrade , M. I. 1990 . J. chem. Thermodyn. , 22 : 1059 Bravo, R., Pintos, M., Amigo, A., and García, M., 1991, Phys. Chem. Liquids 22, 245;Amigo, A., 1991, Ph.D. dissertation, University of Santiago de Compostela, Spain; Orge, B., Iglesias, M., Rodríguez, A., Canosa, J. M., and Tojo, J., 1997, Fluid Phase Equilibria 133, 213
Web of Science ®Google Scholar
Piñeiro , A. , Amigo , A. , Bravo , R. and Brocos , P. 2000 . Fluid Phase Equilibria , 173 : 211
Web of Science ®Google Scholar
Redlich , O. and Kister , A. T. 1948 . Ind. Eng. Chem. , 40 : 435
Google Scholar
Abrams , D. S. and Prausnitz , J. M. 1975 . AIChE J. , 21 : 16
Web of Science ®Google Scholar
Prausnitz , J. M. , Lichtenthaler , R. N. and Acevedo , F. G. 1986 . Molecular Thermodynamics of Fluid Phase Equilibria, , 2nd Edn Englewood Cliffs, NJ : Prentice-Hall .
Google Scholar
Renon , H. and Prausnitz , J. M. 1968 . AIChE J. , 14 : 135
Web of Science ®Google Scholar
Kehiaian , H. V. 1983 . Fluid Phase Equilibria , 13 : 243
Web of Science ®Google Scholar
Guggenheim , E. A. 1944 . Proc. R. Soc. Lond. A , 183 : 213 1948, Trans. Faraday Soc. 44, 1007
Google Scholar
Flory , P. J. 1965 . J. Amer. chem. Soc. , 87 : 1833 Orwoll, R. A., and Flory, P. J., 1967, J. Amer. chem. Soc. 89, 6822
Web of Science ®Google Scholar
Hansen , J. P. and McDonald , I. R. 1990 . Theory of Simple Liquids, , 2nd Edn London : Academic Press .
Google Scholar
Gubbins , K. E. and Gray , G. C. 1984 . Theory of Molecular Liquids Vol. 1 , Oxford : Clarendon Press .
Google Scholar
Gubbins , K. E. 1989 . Molec. Simulation , 2 : 223
Web of Science ®Google Scholar
Gubbins , K. E. 1993 . Fluid Phase Equilibria , 83 : 1
Web of Science ®Google Scholar
Allen , M. P. and Tildesley , D. J. 1987 . Computer Simulation of Liquids, , 2nd Edn Oxford : Clarendon Press .
Google Scholar
Frenkel , D. and Smit , B. 1996 . Understanding Molecular Simulation: From Algorithms to Applications London : Academic Press .
Google Scholar
Kirkwood , J. G. 1935 . J. chem. Phys. , 3 : 300 1936, Chem. Rev. 19, 275
Web of Science ®Google Scholar
McDonald , I. R. 1972 . Molec. Phys. , 23 : 41
Web of Science ®Google Scholar
McDonald , I. R. 1972 . Molec. Phys. , 24 : 391
Web of Science ®Google Scholar
Singer , J. V. L. and Singer , K. 1972 . Molec. Phys. , 24 : 357
Web of Science ®Google Scholar
Haile , J. M. 1986 . Fluid Phase Equilibria , 26 : 103 Shukla, K., and Haile, J. M., 1987, Molec. Phys. 62, 617;1988, Molec. Phys. 64, 1041;Chialvo, A. A., and Haile, J. M., 1987, Fluid Phase Equilibria 37, 293;Chialvo, A. A., 1990;J. chem. Phys. 92, 673;1991, J. phys. Chem. 95, 6683;Molec. Simulation 7, 265;1993, Fluid Phase Equilibria 83, 23
Web of Science ®Google Scholar
Shukla , K. 1997 . Fluid Phase Equilibria , 128 : 47
Google Scholar
Fotouh , K. and Shukla , K. 1997 . Chem. Eng. Sci. , 52 : 2369
Google Scholar
Fotouh , K. and Shukla , K. 1996 . Chem. Eng. Sci. , 51 : 4923
Google Scholar
Blas , F. J. 2000 . J. phys. Chem. B , 104 : 9239
Google Scholar
Beret , S. and Prausnitz , J. M. 1975 . AIChE J. , 21 : 1123
Web of Science ®Google Scholar
Kim , C.-H. , Vimalchand , P. , Donohue , M. D. and Sandler , S. I. 1986 . AIChE J. , 32 : 1726
Web of Science ®Google Scholar
Lee , K. H. , Lombardo , M. and Sandler , S. I. 1985 . Fluid Phase Equilibria , 21 : 177
Web of Science ®Google Scholar
Vimalchand , P. and Donohue , M. D. 1985 . Ind. Eng. Chem. Res. , 24 : 246
Google Scholar
Dolezalek , F. 1908 . Z. phys. Chem. , 64 : 727
Google Scholar
Heidemann , R. A. and Prausnitz , J. M. 1976 . Proc. Natl Acad. Sci. USA , 73 : 1773
PubMed Web of Science ®Google Scholar
Ikonomou , G. D. and Donohue , M. D. 1986 . Ind. Eng. Chem. Res. , 32 : 1716
Google Scholar
Chapman , W. G. , Gubbins , K. E. , Jackson , G. and Radosz , M. 1989 . Fluid Phase Equilibria , 52 : 31
Web of Science ®Google Scholar
Chapman , W. G. , Gubbins , K. E. , Jackson , G. and Radosz , M. 1990 . Ind. Eng. Chem. Res. , 29 : 1709
Web of Science ®Google Scholar
Wertheim , M. S. 1984 . J. statist. Phys. , 35 : 19 35;1986, J. statist. Phys. 42, 459, 477
Web of Science ®Google Scholar
Jackson , G. , Chapman , W. G. and Gubbins , K. E. 1988 . Molec. Phys. , 65 : 1
Web of Science ®Google Scholar
Chapman , W. G. , Jackson , G. and Gubbins , K. E. 1988 . Molec. Phys. , 65 : 1057
Web of Science ®Google Scholar
Wertheim , M. S. 1986 . J. chem. Phys. , 85 : 2929
Web of Science ®Google Scholar
Wertheim , M. S. 1987 . J. chem. Phys. , 87 : 7323
Web of Science ®Google Scholar
Huang , S. H. and Radosz , M. 1990 . Ind. Eng. Chem. Res. , 29 : 2284
Web of Science ®Google Scholar
Huang , S. H. and Radosz , M. 1991 . Ind. Eng. Chem. Res. , 30 1994
Web of Science ®Google Scholar
Müller , E. A. and Gubbins , K. E. 2000 . “ chap. 12 ” . In Equations of State for Fluids and Fluid Mixtures Edited by: Sengers , J. V. , Kayser , R. F. , Peters , C. J. and White , H. J. Amsterdam : Elsevier .
Google Scholar
Müller , E. A. and Gubbins , E. A. 2001 . Ind. Eng. Chem. Res. , 40 : 2193
Web of Science ®Google Scholar
Blas , F. J. and Vega , L. F. 2001 . J. chem. Phys. , 115 : 3906
Web of Science ®Google Scholar
Galindo , A. , Whitehead , P. J. , Jackson , G. and Burgess , A. N. 1996 . J. phys. Chem. , 100 : 6781
Web of Science ®Google Scholar
Galindo , A. , Whitehead , P. J. , Jackson , G. and Burgess , A. N. 1997 . J. phys. Chem. B , 101 : 2082
Web of Science ®Google Scholar
García-Lisbona , M. N. , Galindo , A. , Jackson , G. and Burgess , A. N. 1998 . Molec. Phys. , 93 : 57
Web of Science ®Google Scholar
García-Lisbona , M. N. , Galindo , A. , Jackson , G. and Burgess , A. N. 1998 . J. Amer. chem. Soc. , 120 : 4191
Web of Science ®Google Scholar
Gil-Villegas , A. , Galindo , A. , Whitehead , P. J. , Mills , S. J. , Jackson , G. and Burgess , A. N. 1997 . J. chem. Phys. , 106 : 4168
Web of Science ®Google Scholar
Galindo , A. , Davies , L. A. , Gil-Villegas , A. and Jackson , G. 1998 . Molec. Phys. , 93 : 241
Web of Science ®Google Scholar
McCabe , C. , Galindo , A. , Gil-Villegas , A. and Jackson , G. 1998 . Intl J. Thermophys. , 19 : 1511
Web of Science ®Google Scholar
McCabe , C. , Gil-Villegas , A. and Jackson , G. 1998 . J. phys. Chem. B , 102 : 4183
Web of Science ®Google Scholar
McCabe , C. , Galindo , A. , Gil-Villegas , A. and Jackson , G. 1998 . J. phys. Chem. B , 102 : 8060
Web of Science ®Google Scholar
McCabe , C. M. and Jackson , G. 1999 . Phys. Chem. chem. Phys. , 1 : 2057
Web of Science ®Google Scholar
Galindo , A. , Gil-Villegas , A. , Whitehead , P. J. and Jackson , G. 1998 . J. phys. Chem. B , 102 : 7632
Web of Science ®Google Scholar
Galindo , A. , Florusse , L. J. and Peters , C. J. 1999 . Fluid Phase Equilibria , 160 : 123
Web of Science ®Google Scholar
Galindo , A. , Gil-Villegas , A. , Jackson , G. and Burgess , A. N. 1999 . J. phys. Chem. B , 103 : 10272
Web of Science ®Google Scholar
Gil-Villegas , A. , Galindo , A. and Jackson , G. 2001 . Molec. Phys. , 99 : 531
Web of Science ®Google Scholar
McCabe , C. M. , Galindo , A. , García-Lisbona , M. N. and Jackson , G. 2001 . Ind. Eng. Chem. Res. , 40 : 3835
Web of Science ®Google Scholar
Davies , L. A. , Gil-Villegas , A. and Jackson , G. 1998 . Intl J. Thermophys. , 19 : 675
Web of Science ®Google Scholar
Davies , L. A. , Gil-Villegas , A. and Jackson , G. 1999 . J. chem. Phys. , 111 : 8659
Web of Science ®Google Scholar
Gross , J. and Sadowski , G. 2000 . Fluid Phase Equilibria , 168 : 183
Web of Science ®Google Scholar
Gross , J. and Sadowski , G. 2001 . Ind. Eng. Chem. Res. , 40 : 1244
Web of Science ®Google Scholar
Chapman , W. G. 1990 . J. chem. Phys. , 93 : 4299
Web of Science ®Google Scholar
Ghonasgi , D. and Chapman , W. G. 1993 . Molec. Phys. , 80 : 161
Web of Science ®Google Scholar
Johnson , J. K. and Gubbins , K. E. 1992 . Molec. Phys. , 77 : 1033
Web of Science ®Google Scholar
Ghonasgi , D. , Llano-Restrepo , M. and Chapman , W. G. 1993 . J. chem. Phys. , 98 : 5662
Web of Science ®Google Scholar
Ghonasgi , D. and Chapman , W. G. 1994 . AIChE J. , 40 : 878
Web of Science ®Google Scholar
Johnson , J. K. , Müller , E. A. and Gubbins , K. E. 1994 . J. phys. Chem. , 98 : 6413
Web of Science ®Google Scholar
Müller , E. A. and Gubbins , K. E. 1995 . Ind. Eng. Chem. Res. , 34 : 3662
Web of Science ®Google Scholar
Kraska , T. and Gubbins , K. E. 1996 . Ind. Eng. Chem. Res. , 35 : 4727
Web of Science ®Google Scholar
Kraska , T. and Gubbins , K. E. 1996 . Ind. Eng. Chem. Res. , 35 : 4738
Web of Science ®Google Scholar
Johnson , J. K. 1996 . J. chem. Phys. , 104 : 1729
Web of Science ®Google Scholar
Müller , E. A. , Vega , L. F. and Gubbins , K. E. 1994 . Molec. Phys. , 96 : 1209
Google Scholar
Müller , E. A. , Vega , L. F. and Gubbins , K. E. 1995 . Intl J. Thermophys. , 16 : 705
Web of Science ®Google Scholar
Blas , F. J. and Vega , L. F. 1997 . Molec. Phys. , 92 : 135
Web of Science ®Google Scholar
Blas , F. J. and Vega , L. F. 1998 . Ind. Eng. Chem. Res. , 37 : 660
Web of Science ®Google Scholar
Blas , F. J. and Vega , L. F. 1998 . J. chem. Phys. , 109 : 7405
Web of Science ®Google Scholar
Vega , L. F. and Blas , F. J. 2000 . Fluid Phase Equilibria , 171 : 91
Web of Science ®Google Scholar
Blas , F. J. and Vega , L. F. 2001 . J. chem. Phys. , 115 : 4355
Web of Science ®Google Scholar
Pàmies , J. C. and Vega , L. F. 2001 . Ind. Eng. Chem. Res. , 40 : 2532
Web of Science ®Google Scholar
Johnson , J. K. , Zollweg , J. A. and Gubbins , K. E. 1993 . Molec. Phys. , 78 : 591
Web of Science ®Google Scholar
Tang , Y. , Wang , Z. and Lu , B. C.-Y. 2001 . Molec. Phys. , 99 : 65
Web of Science ®Google Scholar
Tang , Y. and Lu , B. C.-Y. 2000 . Fluid Phase Equilibria , 171 : 27
Web of Science ®Google Scholar
McCabe , C. M. , Dias , L. M. B. , Jackson , G. and Filipe , E. J. M. 2001 . Phys. Chem. chem. Phy. , 3 : 2852
Web of Science ®Google Scholar
Benzaghou , S. , Passarello , J. P. and Tobaly , P. 2001 . Fluid Phase Equilibria , 180 : 1
Google Scholar
Vega , C. and MacDowell , L. 2001 . J. chem. Phys. , 114 : 10411
Web of Science ®Google Scholar
Blas , F. J. , Martín del Río , E. , De Miguel , E. and Jackson , G. 2001 . Molec. Phys. , 99 : 1851
Web of Science ®Google Scholar
Gloor , G. J. , Blas , F. J. , Martín del Río , E. , De Miguel , E. and Jackson , G. 2002 . Fluid Phase Equilibria , 194-197 : 521
Web of Science ®Google Scholar
Vega , C. , Blas , F. J. and Galindo , A. 2002 . J. chem. Phys. , 116 : 7645
Web of Science ®Google Scholar
Filipe , E. J. M. , Gomez de Azebedo , E. J. S. , Martins , L. F. G. , Soares , V. A. M. , Calado , J. C. G. , McCabe , C. and Jackson , G. 2000 . J. phys. Chem. B , 104 : 1315
Web of Science ®Google Scholar
Filipe , E. J. M. , Martins , L. F. G. , Calado , J. C. G. , McCabe , C. and Jackson , G. 2000 . J. phys. Chem. B , 104 : 1322
Web of Science ®Google Scholar
MacDowell , L. G. , Vega , C. and López-Rodríguez , A. 1999 . J. chem. Phys. , 111 : 3192
Google Scholar
Frenkel , D. and Smit , B. 1991 . Molec. Phys. , 75 : 983
Web of Science ®Google Scholar
Frenkel , D. , Mooji , G. C. A. and Smit , B. 1992 . J. Phys. Condens Matter , 3 : 3053
Google Scholar
De Pablo , J. J. , Laso , M. and Suter , U. W. 1992 . J. chem. Phys. , 96 : 6157
Web of Science ®Google Scholar

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