메뉴 건너뛰기




Volumn 60, Issue 23, 2005, Pages 6607-6621

Application of the simplex simulated annealing technique to nonlinear parameter optimization for the SAFT-VR equation of state

Author keywords

Electrolyte solutions; Equation of state; Gradient based methods; Nonlinear parameter optimization; SAFT VR; Simplex method; Simulated annealing

Indexed keywords

ELECTROLYTES; GLOBAL OPTIMIZATION; NONLINEAR SYSTEMS; SOLVENTS;

EID: 24044548709     PISSN: 00092509     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.ces.2005.05.041     Document Type: Article
Times cited : (26)

References (46)
  • 1
    • 0017907025 scopus 로고
    • Evaluation of parameters of nonlinear thermodynarnic models
    • Anderson, T.F., Abrams, D.S., Grens II, E.A., 1978. Evaluation of parameters of nonlinear thermodynarnic models. A.I.Ch.E. Journal 24, 20.
    • (1978) A.I.Ch.E. Journal , vol.24 , pp. 20
    • Anderson, T.F.1    Abrams, D.S.2    Grens II, E.A.3
  • 3
    • 0006230811 scopus 로고
    • Mean spherical model for asymmetric electrolytes. I. Method of solution
    • Blum, L., 1975. Mean spherical model for asymmetric electrolytes. I. Method of solution. Molecular Physics 30, 1529.
    • (1975) Molecular Physics , vol.30 , pp. 1529
    • Blum, L.1
  • 4
    • 33847088999 scopus 로고
    • Mean spherical model for asymmetric electrolytes. 2. Thermodynamic properties and the pair correlation function
    • Blum, L., Hoye, J.S., 1977. Mean spherical model for asymmetric electrolytes. 2. Thermodynamic properties and the pair correlation function. Journal of Physical Chemistry 81, 1311.
    • (1977) Journal of Physical Chemistry , vol.81 , pp. 1311
    • Blum, L.1    Hoye, J.S.2
  • 5
  • 9
    • 0016522819 scopus 로고
    • Method for evaluation and reduction of vapor-liquid equilibrium data of binary mixtures
    • Fabries, J.-F., Renon, H., 1975. Method for evaluation and reduction of vapor-liquid equilibrium data of binary mixtures. A.I.Ch.E. Journal 21, 735.
    • (1975) A.I.Ch.E. Journal , vol.21 , pp. 735
    • Fabries, J.-F.1    Renon, H.2
  • 11
    • 0000347594 scopus 로고
    • A simplified SAFT equation of state for associating compounds and mixtures
    • Fu, Y.-H., Sandler, S.I., 1995. A simplified SAFT equation of state for associating compounds and mixtures. Industrial and Engineering Chemistry Research 34, 1897.
    • (1995) Industrial and Engineering Chemistry Research , vol.34 , pp. 1897
    • Fu, Y.-H.1    Sandler, S.I.2
  • 12
    • 85024863271 scopus 로고    scopus 로고
    • The thermodynamics of mixtures and the corresponding mixing rules in the SAFT-VR approach for potentials of variable range
    • Galindo, A., Davies, L.A., Gil-Villegas, A., Jackson, G., 1998. The thermodynamics of mixtures and the corresponding mixing rules in the SAFT-VR approach for potentials of variable range. Molecular Physics 93, 241.
    • (1998) Molecular Physics , vol.93 , pp. 241
    • Galindo, A.1    Davies, L.A.2    Gil-Villegas, A.3    Jackson, G.4
  • 13
    • 0000154582 scopus 로고    scopus 로고
    • SAFTVRE: Phase behavior of electrolyte solutions with the statistical associating fluid theory for potentials of variable range
    • Galindo, A., Gil-Villegas, A., Jackson, G., Burgess, A.N., 1999. SAFTVRE: phase behavior of electrolyte solutions with the statistical associating fluid theory for potentials of variable range. Journal of Physical Chemistry B 103, 10272.
    • (1999) Journal of Physical Chemistry B , vol.103 , pp. 10272
    • Galindo, A.1    Gil-Villegas, A.2    Jackson, G.3    Burgess, A.N.4
  • 16
    • 0035916697 scopus 로고    scopus 로고
    • A statistical associating fluid theory for electrolyte solutions (SAFT-VRE)
    • Gil-Villegas, A., Galindo, A., Jackson, G., 2001. A statistical associating fluid theory for electrolyte solutions (SAFT-VRE). Molecular Physics 99, 531.
    • (2001) Molecular Physics , vol.99 , pp. 531
    • Gil-Villegas, A.1    Galindo, A.2    Jackson, G.3
  • 18
    • 0003460614 scopus 로고
    • Vapor-liquid equilibrium data collection: Parts 1-8
    • DECHEMA, Frankfurt/Main, Germany
    • Gmehling, J., Onken, U., Arlt, W., 1977-1990. Vapor-liquid equilibrium data collection: Parts 1-8, Chemistry Data Series, vol. I, DECHEMA, Frankfurt/Main, Germany.
    • (1977) Chemistry Data Series , vol.1
    • Gmehling, J.1    Onken, U.2    Arlt, W.3
  • 20
    • 0025517266 scopus 로고
    • Equation of state for small, large, polydisperse and associating molecules
    • Huang, S.H., Radosz, M., 1990. Equation of state for small, large, polydisperse and associating molecules. Industrial and Engineering Chemistry Research 29, 2284.
    • (1990) Industrial and Engineering Chemistry Research , vol.29 , pp. 2284
    • Huang, S.H.1    Radosz, M.2
  • 21
    • 0034024534 scopus 로고    scopus 로고
    • Vapor-liquid equilibrium data analysis for mixed solvent-electrolyte systems using neural network models
    • Iliuta, M.C., Iliuta, I., Larachi, F., 2000. Vapor-liquid equilibrium data analysis for mixed solvent-electrolyte systems using neural network models. Chemical Engineering Science 55, 2813.
    • (2000) Chemical Engineering Science , vol.55 , pp. 2813
    • Iliuta, M.C.1    Iliuta, I.2    Larachi, F.3
  • 22
    • 84890181589 scopus 로고
    • Phase equilibria of associating fluids, spherical molecules with multiple bonding sites
    • Jackson, G., Chapman, W.G., Gubbins, K.E., 1988. Phase equilibria of associating fluids, spherical molecules with multiple bonding sites. Molecular Physics 65, 1.
    • (1988) Molecular Physics , vol.65 , pp. 1
    • Jackson, G.1    Chapman, W.G.2    Gubbins, K.E.3
  • 23
    • 0343136966 scopus 로고
    • Optimization by simulated annealing: Quantitative studies
    • Kirkpatrick, S., 1984. Optimization by simulated annealing: quantitative studies. Journal of Statistical Physics 34 (5/6), 975.
    • (1984) Journal of Statistical Physics , vol.34 , Issue.5-6 , pp. 975
    • Kirkpatrick, S.1
  • 24
  • 28
    • 0033136134 scopus 로고    scopus 로고
    • SAFT-VR modeling of the phase equilibrium of long-chain n-alkanes
    • McCabe, C., Jackson, G., 1999. SAFT-VR modeling of the phase equilibrium of long-chain n-alkanes. Physical Chemistry & Chemical Physics 1, 2057.
    • (1999) Physical Chemistry & Chemical Physics , vol.1 , pp. 2057
    • McCabe, C.1    Jackson, G.2
  • 30
    • 0035897469 scopus 로고    scopus 로고
    • Molecular-based equations of state for associating fluids: A review of SAFT and related approaches
    • Muller, E.A., Gubbins, K.E., 2001. Molecular-based equations of state for associating fluids: a review of SAFT and related approaches. Industrial and Engineering Chemistry Research 40, 2193.
    • (2001) Industrial and Engineering Chemistry Research , vol.40 , pp. 2193
    • Muller, E.A.1    Gubbins, K.E.2
  • 31
    • 0000238336 scopus 로고
    • A simplex method for function minimization
    • Nelder, J.A., Mead, R., 1965. A simplex method for function minimization. Computer Journal 7, 308.
    • (1965) Computer Journal , vol.7 , pp. 308
    • Nelder, J.A.1    Mead, R.2
  • 32
    • 0037196837 scopus 로고    scopus 로고
    • Recent advances in the use of the SAFT approach in describing electrolytes, interfaces, liquid crystals and polymers
    • Paricaud, P., Galindo, A., Jackson, G., 2002. Recent advances in the use of the SAFT approach in describing electrolytes, interfaces, liquid crystals and polymers. Fluid Phase Equilibria 194-197, 87.
    • (2002) Fluid Phase Equilibria , vol.194-197 , pp. 87
    • Paricaud, P.1    Galindo, A.2    Jackson, G.3
  • 36
    • 0001166781 scopus 로고
    • Simulated annealing optimization over continuous spaces
    • Press, W.H., Teukolsky, S.A., 1991. Simulated annealing optimization over continuous spaces. Computers in Physics 5, 426.
    • (1991) Computers in Physics , vol.5 , pp. 426
    • Press, W.H.1    Teukolsky, S.A.2
  • 38
    • 0002091956 scopus 로고
    • The Yukawa potential
    • Rowlinson, J.S., 1989. The Yukawa potential. Physica A 156, 15.
    • (1989) Physica A , vol.156 , pp. 15
    • Rowlinson, J.S.1
  • 40
  • 42
    • 0034711843 scopus 로고    scopus 로고
    • Application of the MSA to the modeling of the activity coefficients of individual ions
    • Taghikhani, V., Modarres, H., Khoshkbarchi, M.K., Vera, J.H., 2001. Application of the MSA to the modeling of the activity coefficients of individual ions. Fluid Phase Equilibria 167, 161.
    • (2001) Fluid Phase Equilibria , vol.167 , pp. 161
    • Taghikhani, V.1    Modarres, H.2    Khoshkbarchi, M.K.3    Vera, J.H.4
  • 44
    • 0023229708 scopus 로고
    • An extended Marquardt-type procedure for fitting error-in-variables models
    • Valko, P., Vajda, S., 1987. An extended Marquardt-type procedure for fitting error-in-variables models. Computers and Chemical Engineering 11, 37.
    • (1987) Computers and Chemical Engineering , vol.11 , pp. 37
    • Valko, P.1    Vajda, S.2
  • 45
    • 0034724454 scopus 로고    scopus 로고
    • Regression of binary interaction parameters for thermodynamic models using an inside-variance estimation method (IVEM)
    • Vasquez, V.R., Whiting, W.B., 2000. Regression of binary interaction parameters for thermodynamic models using an inside-variance estimation method (IVEM). Fluid Phase Equilibria 170, 235.
    • (2000) Fluid Phase Equilibria , vol.170 , pp. 235
    • Vasquez, V.R.1    Whiting, W.B.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.