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Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 79, 1993 - Issue 1
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Original Articles

Implementation of the Gibbs ensemble using a thermodynamic model for one of the coexisting phases

Manoj Mehta Department of Chemical Engineering, State University of New York at Buffalo, Buffalo, NY, 14260, USA
&
David A. Kofke Department of Chemical Engineering, State University of New York at Buffalo, Buffalo, NY, 14260, USA
Pages 39-52 | Received 03 Aug 1992, Accepted 22 Sep 1992, Published online: 22 Aug 2006

Citations (13)

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Read on this site (2)

Martin B. Sweatman. (2009) New techniques for simulating crystals. Molecular Simulation 35:10-11, pages 897-909.
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M.B. Sweatman & N. Quirke. (2004) Simulating Fluid–Solid Equilibrium with the Gibbs Ensemble. Molecular Simulation 30:1, pages 23-28.
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Articles from other publishers (11)

Liwen Zhang, Yuhong Yang, Kun Yin & Yun Liu. (2023) A review of GEMC method and its improved algorithms. Acta Geochimica 42:3, pages 409-434.
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Mohammad Soroush Barhaghi, Korosh Torabi, Younes Nejahi, Loren Schwiebert & Jeffrey J. Potoff. (2018) Molecular exchange Monte Carlo: A generalized method for identity exchanges in grand canonical Monte Carlo simulations. The Journal of Chemical Physics 149:7.
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Chandan K. Das & Jayant K. Singh. (2013) Effect of confinement on the solid-liquid coexistence of Lennard-Jones Fluid. The Journal of Chemical Physics 139:17.
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Alan R Denton & Michael P Schmidt. (2013) Exploring fluctuations and phase equilibria in fluid mixtures via Monte Carlo simulation. European Journal of Physics 34:2, pages 475-487.
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. 2012. Molecular Modeling for the Design of Novel Performance Chemicals and Materials. Molecular Modeling for the Design of Novel Performance Chemicals and Materials 1 26 .
Nathan Duff & Baron Peters. (2009) Nucleation in a Potts lattice gas model of crystallization from solution. The Journal of Chemical Physics 131:18.
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Andrew J. Schultz & David A. Kofke. (2009) Virial coefficients of Lennard-Jones mixtures. The Journal of Chemical Physics 130:22.
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Martin Lı́sal, Carol K. Hall, Keith E. Gubbins & Athanassios Z. Panagiotopoulos. (2002) Self-assembly of surfactants in a supercritical solvent from lattice Monte Carlo simulations. The Journal of Chemical Physics 116:3, pages 1171-1184.
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Phillip R. Westmoreland, Peter A. Kollman, Anne M. Chaka, Peter T. Cummings, Keiji Morokuma, Matthew Neurock, Ellen B. Stechel & Priya VashishtaPeter T. Cummings. 2002. Applying Molecular and Materials Modeling. Applying Molecular and Materials Modeling 23 47 .
Yoshimori Miyano. (1999) Molecular simulation with an EOS algorithm for vapor–liquid equilibria of oxygen and ethane. Fluid Phase Equilibria 158-160, pages 29-35.
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Yoshimori Miyano. (1998) Vapor–liquid equilibria from molecular simulations using the algorithm in equation of state calculations. Fluid Phase Equilibria 144:1-2, pages 137-144.
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