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Original Articles

Simulation Studies of a Lennard-Jones Liquid in Micropores

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Pages 313-351 | Received 01 Mar 1988, Accepted 01 May 1988, Published online: 23 Sep 2006

References

  • Fischer , J. 1977 . “A Fluid in Contact with a Wall. The Percus-Yevick versus the Superposition Approximation” . Mol. Phys. , 33 : 75
  • van Megen , W. and Snook , I. K. 1979 . “Structure and Solvation Forces Between Solid Bodies” . J. Chem. Soc. Faraday Trans. II , 75 : 1095
  • Lane , J. E. and Spurling , T. H. 1979 . “Forces Between Adsorbing Walls: Monte Carlo Calculations” . Chem. Phys. Lett. , 67 : 107
  • Fischer , J. and Methfessel , M. 1980 . “Born-Green-Yvon Approach to the Local Densities of a Fluid at Interfaces” . Phys. Rev. A. , 22 : 2836
  • Nordholm , S. , Johnson , M. and Freasier , B. C. 1980 . “Generalized van der Waals Theory. III The Prediction of Hard-Sphere Structure” . Aust. J. Chem. , 33 : 2139
  • Snook , I. K. and van Megen , W. 1980 . “Solvation Forces in Simple Dense Fluids. I.” . J. Chem. Phys. , 72 : 2907
  • van Megen , W. and Snook , I. K. 1981 . “Solvation Forces in Simple Dense Fluids. II. Effect of Chemical Potential” . J. Chem. Phys. , 74 : 1409
  • Nicholson , D. and Parsonage , N. G. 1982 . Computer Simulation and the Statistical Mechanics of Adsorption , N. Y. : Academic Press .
  • Freasier , B. C. and Nordholm , S. 1983 . “A General van der Waals Model for Solvation Forces Between Solute Particles in A Colloidal Suspension” . J. Chem. Phys. , 79 : 4431
  • Antonchenko , Ya. V. , Ilyin , V. V. , Makovsky , N. N. , Pavlov , A. N. and Sokhan , V. P. 1984 . “On the Nature of Disjoining Pressure Oscillations in Fluid Films” . Mol. Phys. , 52 : 345
  • Magda , J. J. , Tirrell , M. and Davis , H. T. 1985 . “Molecular Dynamics of Narrow, Liquid-Filled Pores” . J. Chem. Phys. , 83 : 1888
  • Peterson , B. K. and Gubbins , K. E. 1987 . “Phase Transitions in a Cylindrical Pore. Grand Canonical Monte Carlo, Mean Field Theory and the Kelvin Equation” . Mol. Phys. , 62 : 215
  • Heinbuch , U. and Fischer , J. 1987 . “On the Application of Widom's Test Particle Method to Homogeneous and Inhomogeneous Fluids” . Mol. Sim. , 1 : 109
  • Horn , R. G. and Israelachvili , J. N. 1981 . “Direct Measurement of Structural Forces Between Two Surfaces in a Nonpolar Liquid” . J. Chem. Phys. , 75 : 1400
  • Pashley , R. M. and Israelachvili , J. N. 1984 . “Molecular Layering of Water in Thin Films Between Mica Surfaces and its Relation to Hydration Forces” . J. Colloid Interface Sci. , 101 : 511
  • Christenson , H. K. 1983 . “Experimental Measurements of Solvation Forces in Nonpolar Liquids” . J. Chem. Phys. , 78 : 6906
  • Haberman , W. L. and Sayre , R. M. 1958 . “Motion of Rigid and Fluid Spheres in Stationery and Moving Liquids Inside Cylindrical Tubes” , Washington, D. C. : U. S. Navy . David Taylor Model Basin Report No. 1143
  • Anderson , J. L. and Quinn , J. A. 1974 . “Restricted Transport in Small Pores. A Model for Steric Exclusion and Hindered Particle Motion” . Biophys. J. , 14 : 130
  • Brenner , H. and Gaydos , L. J. 1977 . “This Constrained Brownian Movement of Spherical Particles in Cylindrical Pores of Comparable Radius. Models of the Diffusive and Convective Transport of Solute Molecules in Membranes and Porous Media.” . J. Colloid Interface Sci. , 58 : 312
  • Beck , R. E. and Schultz , J. S. 1972 . “Hindrance of Solute Diffusion within Membranes as Measured with Microporous Membranes of Known Pore Geometry” . Biochim. Biophys. ACTA , 255 : 273
  • Satterfield , C. N. , Colton , C. K. and Pitcher , W. H. Jr. 1973 . “Restricted Diffusion in Liquids within Fine Pores” . AIChE Journal , 19 : 628
  • Chantong , A. and Massoth , F. E. 1983 . “Restrictive Diffusion in Aluminas” . AIChE Journal , 29 : 725
  • Davis , H. T. 1987 . “Kinetic Theory of Inhomogeneous Fluid: Tracer Diffusion” . J. Chem. Phys. , 86 : 1474
  • Vanderlick , T. K. and Davis , H. T. 1987 . “Self-Diffusion in Fluids in Microporous Solids” . J. Chem. Phys. , 87 : 1791
  • Suh , S.-H. and MacElroy , J. M. D. 1986 . “Molecular Dynamics Simulation of Hindered Diffusion in microcapillaries” . Mol. Phys. , 58 : 445
  • MacElroy , J. M. D. and Suh , S.-H. 1987 . “Computer Simulation of Moderately Dense Hard-Sphere Fluids and Mixtures in Microcapillaries” . Mol. Phys. , 60 : 475
  • Nicholson , D. 1975 . “Molecular Theory of Adsorption in Pore Spaces. Part 1. Isotherms and Simple Lattice Models” . J. Chem. Soc. Faraday Trans. I , 71 : 238
  • Putnam , F. A. and Fort , T. Jr. 1977 . “Physical Adsorption on Patchwise Heterogeneous Surfaces. 2. Virial Coefficient Theory Analysis of Krypton Adsorption on Graphitized Carbon Black” . J. Phys. Chem. , 81 : 2164
  • Karger , J. , Pfeifer , H. , Rauscher , M. and Walter , A. 1980 . “Self-Diffusion of n-Paraffins in NaX Zeolite” . J. Chem. Soc. Faraday Trans. I , 76 : 717
  • Abraham , F. F. 1978 . “The Interfacial Density Profile of a Lennard-Jones Fluid in Contact with a (100) Lennard-Jones Wall and its Relationship to Idealized Fluid/Wall Systems: A Monte Carlo Simulation” . J. Chem. Phys. , 68 : 3713
  • MacElroy , J. M. D. and Suh , S.-H. 1986 . “Concentration and Non-Continuum Effects in Size-Exclusion Partitioning” , AIChE Symp. Ser., 82 No. 248 133
  • Mason , E. A. and Viehland , L. A. 1978 . “Statistical-Mechanical Theory of Membrane Transport for Multi-component Systems: Passive Transport Through Open Membranes” . J. Chem. Phys. , 68 : 3562
  • Irving , J. H. and Kirkwood , J. G. 1950 . “The Statistical-Mechanical Theory of Transport Processes. IV. The Equations of Hydrodynamics” . J. Chem. Phys. , 18 : 817
  • Kirkwood , J. G. 1935 . “Statistical Mechanics of Fluid Mixtures” . J. Chem. Phys. , 3 : 300
  • Reed , T. M. and Gubbins , K. E. 1973 . Applied Statistical Mechanics , N. Y. : McGraw-Hill Book Co. .
  • Lebowitz , J. L. and Percus , J. K. 1967 . “Kinetic Equations and Density Expansions: Exactly Solvable One-Dimensional Systems” . Phys. Rev. , 155 : 122
  • Alder , B. J. , Gass , D. M. and Wainwright , T. E. 1970 . “Studies in Molecular Dynamics. VIII. The Transport Coefficients for a Hard-Sphere Fluid” . J. Chem. Phys. , 53 : 3813
  • Easteal , A. J. , Woolf , L. A. and Jolly , D. L. 1983 . “Self-Diffusion in a Dense Hard-Sphere Fluid: A Molecular Dynamics Simulation” . Physica , 121A : 286
  • Park , I.-A. and MacElroy , J. M. D. “Simulation of a Hard-Sphere Fluid in Bicontinuous Random Media” . Mol. Sim. , (in press)
  • Jaycock , M. J. and Parfitt , G. D. 1981 . Chemistry of Interfaces , N. Y. : J. Wiley & Sons .
  • Fischer , J. and Heinbuch , U. 1988 . “Relationship Between Free Energy Density Functional, Born-Green-Yvon, and Potential Distribution Approaches for Inhomogeneous Fluids” . J. Chem. Phys. , 88 : 1909
  • Adams , D. J. 1974 . “Chemical Potential of Hard-Sphere Fluids by Monte Carlo Methods” . Mol. Phys. , 28 : 1241
  • Adams , D. J. 1975 . “Grand Canonical Ensemble Monte Carlo for a Lennard-Jones Fluid” . Mol. Phys. , 29 : 307
  • Gear , C. W. 1971 . Numerical Initial Value Problems in Ordinary Differential Equations , Englewood Cliffs : Prentice-Hall .
  • Haile , J. M. 1980 . A Primer on the Computer Simulation of Atomic Fluids by Molecular Dynamics , Clemson : Clemson University .

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