Applied thermodynamics for process modeling

[1]  J. Prausnitz,et al.  Statistical thermodynamics of liquid mixtures: A new expression for the excess Gibbs energy of partly or completely miscible systems , 1975 .

[2]  Daniel I. C. Wang,et al.  Molecular thermodynamic model for Helix‐Helix docking and protein aggregation , 1995 .

[3]  G. Soave Equilibrium constants from a modified Redlich-Kwong equation of state , 1972 .

[4]  J. F. Boston,et al.  A radically different formulation and solution of the single-stage flash problem , 1978 .

[5]  J. Prausnitz,et al.  Perturbed hard chain theory for fluid mixtures: Thermodynamic properties for mixtures in natural gas and petroleum technology , 1978 .

[6]  Jürgen Gmehling,et al.  Present status of group-contribution methods for the synthesis and design of chemical processes , 1998 .

[7]  Calculation of phase diagrams for aqueous protein solutions , 2001 .

[8]  Stephen S. Chen,et al.  Applications of the Augmented van der Waals Theory of Fluids.: I. Pure Fluids , 1977 .

[9]  Yuhua Song,et al.  A Perturbed Hard-Sphere-Chain Equation of State for Normal Fluids and Polymers , 1994 .

[10]  G. Rochelle,et al.  Thermodynamics of Piperazine/Methyldiethanolamine/Water/Carbon Dioxide , 2002 .

[11]  G. Pierotti,et al.  Activity Coefficients and Molecular Structure , 1959 .

[12]  Arno Laesecke,et al.  Through Measurement to Knowledge: The Inaugural Lecture of Heike Kamerlingh Onnes (1882) , 2002, Journal of research of the National Institute of Standards and Technology.

[13]  Sohail Murad,et al.  A computer simulation of the classic experiment on osmosis and osmotic pressure , 1993 .

[14]  Paul M. Mathias,et al.  Segment‐based excess Gibbs energy model for aqueous organic electrolytes , 2001 .

[15]  A. Klamt Comments on “A Priori Phase Equilibrium Prediction from a Segment Contribution Solvation Model” , 2002 .

[16]  S. Sandler,et al.  Infinite dilution activity coefficients from ab initio solvation calculations , 1999 .

[17]  Stanley I. Sandler,et al.  A Priori Phase Equilibrium Prediction from a Segment Contribution Solvation Model , 2002 .

[18]  G. M. Wilson,et al.  Vapor-Liquid Equilibrium. XI. A New Expression for the Excess Free Energy of Mixing , 1964 .

[19]  H. Orbey,et al.  Use of hydration and dissociation chemistries with the electrolyte–NRTL model , 1999 .

[20]  Manson Benedict,et al.  An Empirical Equation for Thermodynamic Properties of Light Hydrocarbons and Their Mixtures I. Methane, Ethane, Propane and n‐Butane , 1940 .

[21]  Erich A. Müller,et al.  Molecular-Based Equations of State for Associating Fluids: A Review of SAFT and Related Approaches , 2001 .

[22]  J. Prausnitz,et al.  LOCAL COMPOSITIONS IN THERMODYNAMIC EXCESS FUNCTIONS FOR LIQUID MIXTURES , 1968 .

[23]  George Jackson,et al.  SAFT: Equation-of-state solution model for associating fluids , 1989 .

[24]  Herbert I. Britt,et al.  Local composition model for excess Gibbs energy of electrolyte systems. Part I: Single solvent, single completely dissociated electrolyte systems , 1982 .

[25]  A. Sum,et al.  A Novel Approach to Phase Equilibria Predictions Using Ab Initio Methods , 1999 .

[26]  A. Klamt Conductor-like Screening Model for Real Solvents: A New Approach to the Quantitative Calculation of Solvation Phenomena , 1995 .

[27]  Sohail Murad,et al.  Molecular simulations of osmosis and reverse osmosis in aqueous electrolyte solutions , 1996 .

[28]  P. Mathias A versatile phase equilibrium equation of state , 1983 .

[29]  J. M. Prausnitz,et al.  Thermodynamics and the other chemical engineering sciences: old models for new chemical products and processes , 1999 .

[30]  D. Peng,et al.  A New Two-Constant Equation of State , 1976 .

[31]  Berend Smit,et al.  Simulating the critical behaviour of complex fluids , 1993, Nature.

[32]  R. Schmidt,et al.  A new form of the equation of state for pure substances and its application to oxygen , 1985 .

[33]  Aage Fredenslund,et al.  Group‐contribution estimation of activity coefficients in nonideal liquid mixtures , 1975 .

[34]  D. Bedrov,et al.  Discriminating between Correlations of Experimental Viscosity Data for Perfluorobutane Using Molecular Simulation , 2001 .

[35]  David Shan-Hill Wong,et al.  A theoretically correct mixing rule for cubic equations of state , 1992 .

[36]  M. Huron,et al.  New mixing rules in simple equations of state for representing vapour-liquid equilibria of strongly non-ideal mixtures☆ , 1979 .

[37]  J. Gmehling,et al.  PSRK: A Group Contribution Equation of State Based on UNIFAC , 1991 .

[38]  Chau-Chyun Chen,et al.  A segment-based local composition model for the gibbs energy of polymer solutions , 1993 .

[39]  Stanley H. Huang,et al.  Equation of state for small, large, polydisperse, and associating molecules , 1990 .

[40]  Joachim Gross,et al.  Modeling Polymer Systems Using the Perturbed-Chain Statistical Associating Fluid Theory Equation of State , 2002 .

[41]  C. Deal,et al.  Activity Coefficients and Molecular Structure. Activity Coefficients in Changing Environments-Solutions of Groups , 1962 .