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Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 92, 1997 - Issue 6
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Original Articles

Determination of vapour-liquid equilibrium using cavity-biased grand canonical Monte Carlo method

Pages 1067-1072 | Published online: 03 Dec 2010

Keep up to date with the latest research on this topic with citation updates for this article.

Read on this site (6)

Ping Yu, Guo-zhen Zhu & Mao Wen. (2020) Application of grand-canonical ensemble Monte Carlo simulation in metals using cavity-biased method. Molecular Simulation 46:10, pages 736-742.
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TAMÁS KRISTÓF, JÁNOS LISZI & DEZSŐ BODA. (2002) The extrapolation of phase equilibrium curves of mixtures in the isobaric—isothermal Gibbs ensemble. Molecular Physics 100:21, pages 3429-3441.
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DEZSŐ BODA, TAMÁS KRISTÓF, JÁNOS LISZI & ISTVÁN SZALAI. (2002) The extrapolation of the vapour—liquid equilibrium curves of pure fluids in the isothermal Gibbs ensemble. Molecular Physics 100:12, pages 1989-2000.
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DEZSÖ BODA, TAMÁS KRISTÓF, JÁNOS LISZI & ISTVÁN SZALAI. (2001) A new simulation method for the determination of phase equilibria in mixtures in the grand canonical ensemble. Molecular Physics 99:24, pages 2011-2022.
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TAMÁS KRISTÓF & JÁNOS LISZI. (2001) Phase coexistence and critical point determination in polydisperse fluids. Molecular Physics 99:3, pages 167-173.
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DAPENG CAO, KWONG-YU CHAN, DOUGLAS HENDERSON & WENCHUAN WANG. (2000) Monte Carlo data of dilute solutions of large spheres in binary hard sphere mixtures. Molecular Physics 98:9, pages 619-624.
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Articles from other publishers (13)

Richard J. Sadus. 2024. Molecular Simulation of Fluids. Molecular Simulation of Fluids 359 404 .
Philipp Ströker & Karsten Meier. (2021) Classical statistical mechanics in the grand canonical ensemble. Physical Review E 104:1.
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Bob Eisenberg. (2013) Ionic interactions in biological and physical systems: a variational treatment. Faraday Discuss. 160, pages 279-296.
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Dezső Boda, Mónika Valiskó, Douglas Henderson, Dirk Gillespie, Bob Eisenberg & Michael K. Gilson. (2009) Ions and Inhibitors in the Binding Site of HIV Protease: Comparison of Monte Carlo Simulations and the Linearized Poisson-Boltzmann Theory. Biophysical Journal 96:4, pages 1293-1306.
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D.R. Mason. (2005) Faster neighbour list generation using a novel lattice vector representation. Computer Physics Communications 170:1, pages 31-41.
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S.A. Baeurle. (2004) Grand canonical auxiliary field Monte Carlo: a new technique for simulating open systems at high density. Computer Physics Communications 157:3, pages 201-206.
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Stephan A. Baeurle, Roman Martoňák & Michele Parrinello. (2002) A field-theoretical approach to simulation in the classical canonical and grand canonical ensemble. The Journal of Chemical Physics 117:7, pages 3027-3039.
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Fernando M.S. Silva Fernandes, Rui P.S. Fartaria & Filomena F.M. Freitas. (2001) The starting state in simulations of the fluid–solid coexistence by Gibbs–Duhem integration. Computer Physics Communications 141:3, pages 403-411.
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B. V. R. Tata, Dezsö Boda, D. Henderson, A. Nikolov & D. T. Wasan. (2000) Structure of charged colloids under a wedge confinement. Physical Review E 62:3, pages 3875-3881.
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Dezsö Boda & Douglas Henderson. (2000) The capacitance of the solvent primitive model double layer at low effective temperatures. The Journal of Chemical Physics 112:20, pages 8934-8938.
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V.G. Baidakov, G.G. Chernykh & S.P. Protsenko. (2000) Effect of the cut-off radius of the intermolecular potential on phase equilibrium and surface tension in Lennard–Jones systems. Chemical Physics Letters 321:3-4, pages 315-320.
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Robert M. Shroll & David E. Smith. (1999) Molecular dynamics simulations in the grand canonical ensemble: Formulation of a bias potential for umbrella sampling. The Journal of Chemical Physics 110:17, pages 8295-8302.
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Dezső Boda, Kwong-Yu Chan & Douglas Henderson. (1998) Monte Carlo simulation of an ion-dipole mixture as a model of an electrical double layer. The Journal of Chemical Physics 109:17, pages 7362-7371.
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