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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

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Read on this site (12)

MITHUN KAMAT & DAVID KEFFER. (2003) An analytical theory for diffusion of fluids in crystalline nanoporous materials. Molecular Physics 101:10, pages 1399-1412.
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MITHUNR. KAMAT & D. KEFFER. (2002) A generalized analytical theory for adsorption of fluids in nanoporous materials. Molecular Physics 100:16, pages 2689-2701.
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By JAN FORSMAN and C. E. WOODWARD. (1997) Simulations of phase equilibria in planar slits. Molecular Physics 90:4, pages 637-652.
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N. Quirke. (1996) Some Recent Developments in Computational Chemistry. Molecular Simulation 16:1-3, pages 193-208.
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Karthik Raghavan & J.M. D. Macelroy. (1995) Molecular Dynamics Simulations of Adsorbed Alkanes in Silica Micropores at Low-to-Moderate Loadings. Molecular Simulation 15:1, pages 1-33.
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StevenY. Liem, Kwong-Yu Chan & RobertF. Savinell. (1994) Molecular Dynamics Simulation of Platinum Particles Between Graphite Walls. Molecular Simulation 13:1, pages 47-60.
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MaryJ. Bojan, Richard van Slooten & William Steele. (1992) Computer Simulation Studies of the Storage of Methane in Microporous Carbons. Separation Science and Technology 27:14, pages 1837-1856.
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S. Sokołowski. (1992) Adsorption of oxygen in slit-like pores: grand canonical ensemble Monte Carlo studies. Molecular Physics 75:5, pages 999-1022.
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M. Calleja, A.N. North, J.G. Powles & G. Rickayzen. (1991) The structure of fluids confined to spherical pores: theory and simulation. Molecular Physics 73:5, pages 973-983.
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Articles from other publishers (24)

R. L. C. Vink, K. Binder & J. Horbach. (2006) Critical behavior of a colloid-polymer mixture confined between walls. Physical Review E 73:5.
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S. H. Krishnan & K. G. Ayappa. (2006) Model for dynamics of inhomogeneous and bulk fluids. The Journal of Chemical Physics 124:14.
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S. H. Krishnan & K. G. Ayappa. (2004) Modeling velocity autocorrelation functions for confined fluids using γ distributions. The Journal of Chemical Physics 121:7, pages 3197-3205.
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S. H. Krishnan & K. G. Ayappa. (2003) Modeling velocity autocorrelation functions of confined fluids: A memory function approach. The Journal of Chemical Physics 118:2, pages 690-705.
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J.M.D. MacElroy, L.A. Pozhar & S.-H. Suh. (2001) Self-diffusion in a fluid confined within a model nanopore structure. Colloids and Surfaces A: Physicochemical and Engineering Aspects 187-188, pages 493-507.
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P. Bryk, L. Łajtar, O. Pizio, Z. Sokołowska & S. Sokołowski. (2000) Adsorption of Fluids in Pores Formed between Two Hard Cylinders. Journal of Colloid and Interface Science 229:2, pages 526-533.
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David Nicholson & Karl Travis. 2000. Recent Advances in Gas Separation by Microporous Ceramic Membranes. Recent Advances in Gas Separation by Microporous Ceramic Membranes 257 296 .
Fei Zhang. (1999) Molecular dynamics studies of chainlike molecules confined in a carbon nanotube. The Journal of Chemical Physics 111:19, pages 9082-9085.
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S Mohanty & A.V McCormick. (1999) Prospects for principles of size and shape selective separations using zeolites. Chemical Engineering Journal 74:1-2, pages 1-14.
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William A. Steele & Mary J. Bojan. (1998) Simulation studies of sorption in model cylindrical micropores. Advances in Colloid and Interface Science 76-77, pages 153-178.
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Soong-Hyuck Suh, Byung-Ho Kim & Soon-Chul Kim. (1996) Equilibrium and structural properties of gas molecules adsorbed in zeolite A. Korean Journal of Chemical Engineering 13:1, pages 30-34.
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D. Keffer, H. Ted Davis & Alon V. McCormick. (1996) The effect of nanopore shape on the structure and isotherms of adsorbed fluids. Adsorption 2:1, pages 9-21.
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Soong-Hyuck Suh. (1995) Solvation pressure of simple fluids in spherical pores. Korean Journal of Chemical Engineering 12:4, pages 491-493.
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Soong-Hyuck Suh & Heai-Ku Park. (1994) Thermodynamic and structural properties of hard-sphere fluids confined within a spherical hard-wall pore. Korean Journal of Chemical Engineering 11:3, pages 198-203.
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Stefan Sokolowski & Johann Fischer. (1993) ‘Liquid–vapour’ density profiles for fluids in pores from density functional theory. J. Chem. Soc., Faraday Trans. 89:5, pages 789-794.
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Mary J. Bojan & William Steele. 1993. Fundamentals of Adsorption, Proceedings of the Fourth International Conference on Fundamentals of Adsorption. Fundamentals of Adsorption, Proceedings of the Fourth International Conference on Fundamentals of Adsorption 51 58 .
S. Yashonath & Prakriteswar Santikary. (1992) Dynamics of adsorbates in micropores of zeolites and breakdown of Arrhenius behavior. Physical Review B 45:17, pages 10095-10098.
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Mary J. Bojan & William Steele. (2011) Computer Simulations of Diffusion in Monolayers Physisorbed in Model Pores. MRS Proceedings 290.
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P.N. Aukett, N. Quirke, S. Riddiford & S.R. Tennison. (1992) Methane adsorption on microporous carbons—A comparison of experiment, theory, and simulation. Carbon 30:6, pages 913-924.
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S. Sokoowski. (1991) Capillary condensation and molecular-dynamics simulations of flow in narrow pores. Physical Review A 44:6, pages 3732-3741.
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R. D. Kaminsky & P. A. Monson. (1991) The influence of adsorbent microstructure upon adsorption equilibria: Investigations of a model system. The Journal of Chemical Physics 95:4, pages 2936-2948.
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Theodora Demi & David Nicholson. (1991) Effect of the ratio of length of sphere to length of cylinder on adsorption and self-diffusion in a ‘sphere-cylinder’ micropore. J. Chem. Soc., Faraday Trans. 87:23, pages 3791-3797.
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J. M. D. MacElroy & K. Raghavan. (1990) Adsorption and diffusion of a Lennard-Jones vapor in microporous silica. The Journal of Chemical Physics 93:3, pages 2068-2079.
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Nick Quirke. 1990. Correlations and Connectivity. Correlations and Connectivity 231 243 .

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