Accurate vapour-liquid equilibrium calculations of simple fluids

References

• Adams , D. J. 1976 . Calculating the low temperature vapour line by Monte Carlo . Molec. Phys. , 32 : 647 – 657 .
   Web of Science ®Google Scholar
• Aim , K. , Kolafa , J. , Nezbeda , I. and Vörtler , H. L. 1993 . The Lennard-Jones fluid revisited: new thermodynamic data and new equation of state . Fluid Phase Eq. , 83 : 15 – 22 .
   Web of Science ®Google Scholar
• Carnahan , N. F. and Starling , K. E. 1969 . Equation of state for non-attracting rigid spheres . J. Chem. Phys. , 51 : 635 – 636 .
   Web of Science ®Google Scholar
• Cuadros , F. 1984 . Doctoral Thesis , Spain : University of Extremadura .
   Google Scholar
• Cuadros , F. and Mulero , A. 1991 . Scaling the WCA reference system for two-dimensional Lennard-Jones fluids . Chem. Phys. , 156 : 33 – 41 .
   Web of Science ®Google Scholar
• Cuadros , F. and Mulero , A. 1992 . A validity test of the WCA perturbation theory for two-dimensional Lennard-Jones fluids . Chem. Phys. , 160 : 375 – 382 .
   Web of Science ®Google Scholar
• Cuadros , F. and Mulero , A. 1993 . Helmholtz free energy for two-dimensional Lennard-Jones fluids . Chem. Phys. , 177 : 53 – 60 .
   Web of Science ®Google Scholar
• Cuadros , F. , Mulero , A. and Ahumada , W. 1995a . An analytical expression for the Helmholtz free energy of Lennard-Jones fluids. . Thermochim. Acta , (in press)
   Google Scholar
• Cuadros , F. , Mulero , A. , Cachadiña , I. and Ahumada , W. 1995b . A new procedure for determining Lennard-Jones interaction parameters . International Rev. in Phys. Chem. , 14 : 205 – 213 .
   Web of Science ®Google Scholar
• Cuadros , F. and Ahumada , W. 1995c . Accurate analytical expressions of thermodynamic properties of Lennard-Jones fluids . Int. Rev. Phys. Chem. , (submitted for publication)
   Google Scholar
• Cuadros , F. , Valderrama , J. O. and Mulero , A. 1993 . Modification of the Soave equation of state suggested by using computer simulation . Chem. Engng. Sci. , 48 : 513 – 519 .
   Web of Science ®Google Scholar
• 1993 . “ DIPPD (Design Institute for Physical Property Data ” . American Institute of Chemical Engineers .
   Google Scholar
• Hansen , J. P. and McDonald , I. R. 1976 . Theory of Simple Liquids. , New York : Academic Press .
   Google Scholar
• Johnson , J. K. , Zollweg , J. A. and Gubbins , K. E. 1993 . The Lennard-Jones equation of state revised . Mol. Phys. , 78 : 591 – 618 .
   Web of Science ®Google Scholar
• Kolafa , J. and Nezbeda , I. 1994 . The Lennard-Jones fluid: An accurate analytic and theoreticaly based equation of state . Fluid Phase Eq. , 100 : 1 – 34 .
   Web of Science ®Google Scholar
• Lotfi , A. , Vrabec , J. and Fischer , J. 1992 . Vapour liquid equlibria of the Lennard-Jones fluid from the NpT plus test particle method . Molec. Phys. , 76 : 1319 – 1333 .
   Web of Science ®Google Scholar
• Mulero , A. , Cuadros , F. and Pérez-Ayala , M. 1993 . Displying the role of repulsive and attractive intermolecular forces in fluids . Am. J. Phys. , 61 : 641
   Google Scholar
• Panagiotopoulos , A. Z. , Quirke , N. , Stapleto , M. and Tildesley , D. J. 1988 . Phase equlibria by simulation in the Gibbs ensemble. Alternative derivation, generalization and application to mixture and membrane equlibria . Molec. Phys. , 63 : 527 – 545 .
   Web of Science ®Google Scholar
• Rull , L. F. , Cuadros , F. and Morales , J. J. 1987 . The van der Waals model of dense fluids, dependence of the Helmholtz free energy on temperature and density. . Phys. Letters.A , 123 : 217
   Web of Science ®Google Scholar
• de Souza , L. E. S. , Stamatopoulou , A. and Ben-Amotz , D. 1994 . Chemical potentials of hard sphere solutes in hard sphere solvents. Monte Carlo simulations and analytical approximations . J. Chem. Phys. , 100 : 1456
   Web of Science ®Google Scholar
• Verlet , L. and Weis , J. J. 1972 . Equlibrium theory of simple liquids . Phys. Rev. A , 5 : 939 – 952 .
   Web of Science ®Google Scholar
• Walas , S. M. 1985 . Phase Equilibria in Chemical Engineering. , Boston : Butterworth .
   Google Scholar
• Weeks , J. D. , Chandler , D. and Andersen , H. C. 1971 . Role of repulsive forces in determining the equilibrium structure of simple liquids . J. Chem. Phys. , 54 : 5237 – 5247 .
   Web of Science ®Google Scholar
• Weeks , J. D. and Broughton , J. Q. 1983 . Van der Waals theory of melting in two and three dimensions . J. Chem. Phys. , 78 : 4197 – 4205 .
   Web of Science ®Google Scholar