Direct calculation of liquid–vapor phase equilibria from transition matrix Monte Carlo simulation

Jeffrey R. Errington

doi:10.1063/1.1572463

Direct calculation of liquid–vapor phase equilibria from transition matrix Monte Carlo simulation

The Journal of Chemical Physics ◽

10.1063/1.1572463 ◽

2003 ◽

Vol 118 (22) ◽

pp. 9915-9925 ◽

Cited By ~ 209

Author(s):

Jeffrey R. Errington

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Phase Equilibria ◽

Vapor Phase ◽

Transition Matrix ◽

Direct Calculation ◽

Liquid Vapor

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Fluid phase equilibria of triangle-well fluids confined inside slit pores: A transition matrix Monte Carlo simulation study

Journal of Molecular Liquids ◽

10.1016/j.molliq.2016.06.100 ◽

2016 ◽

Vol 221 ◽

pp. 1184-1196 ◽

Cited By ~ 3

Author(s):

Angan Sengupta ◽

Jhumpa Adhikari

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Phase Equilibria ◽

Simulation Study ◽

Transition Matrix ◽

Fluid Phase ◽

Monte Carlo Simulation Study ◽

Fluid Phase Equilibria ◽

Slit Pores

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Evaluating surface tension using grand-canonical transition-matrix Monte Carlo simulation and finite-size scaling

Physical Review E ◽

10.1103/physreve.67.012102 ◽

2003 ◽

Vol 67 (1) ◽

Cited By ~ 130

Author(s):

Jeffrey R. Errington

Keyword(s):

Surface Tension ◽

Monte Carlo Simulation ◽

Monte Carlo ◽

Transition Matrix ◽

Finite Size ◽

Finite Size Scaling ◽

Size Scaling ◽

Grand Canonical

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Monte Carlo Simulation of Carboxylic Acid Phase Equilibria

The Journal of Physical Chemistry B ◽

10.1021/jp0625053 ◽

2006 ◽

Vol 110 (43) ◽

pp. 21938-21943 ◽

Cited By ~ 17

Author(s):

Scott Clifford ◽

Kim Bolton ◽

Deresh Ramjugernath

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Carboxylic Acid ◽

Phase Equilibria

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Computation of interfacial properties via grand canonical transition matrix Monte Carlo simulation

The Journal of Chemical Physics ◽

10.1063/1.2812285 ◽

2008 ◽

Vol 128 (1) ◽

pp. 014710 ◽

Cited By ~ 75

Author(s):

Eric M. Grzelak ◽

Jeffrey R. Errington

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Transition Matrix ◽

Interfacial Properties ◽

Grand Canonical

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Liquid-Vapor Phase Equilibria of the Neon-Normal Hydrogen System

Advances in Cryogenic Engineering ◽

10.1007/978-1-4757-0522-5_38 ◽

1966 ◽

pp. 349-355 ◽

Cited By ~ 9

Author(s):

C. K. Heck ◽

P. L. Barrick

Keyword(s):

Phase Equilibria ◽

Vapor Phase ◽

Hydrogen System ◽

Normal Hydrogen ◽

Liquid Vapor

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Kinetic Monte Carlo simulation for homogeneous nucleation of metal nanoparticles during vapor phase synthesis

AIChE Journal ◽

10.1002/aic.15887 ◽

2017 ◽

Vol 64 (1) ◽

pp. 18-28 ◽

Cited By ~ 14

Author(s):

Seyyed Ali Davari ◽

Dibyendu Mukherjee

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Metal Nanoparticles ◽

Vapor Phase ◽

Homogeneous Nucleation ◽

Kinetic Monte Carlo ◽

Kinetic Monte Carlo Simulation ◽

Phase Synthesis ◽

Vapor Phase Synthesis

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Monte Carlo simulation of fluid phase equilibria in pore systems: square-well fluid distributed over a bulk and a slit-pore

Chemical Physics Letters ◽

10.1016/0009-2614(95)01433-0 ◽

1996 ◽

Vol 249 (5-6) ◽

pp. 470-475 ◽

Cited By ~ 11

Author(s):

William R. Smith ◽

Horst L. Vörtler

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Phase Equilibria ◽

Fluid Phase ◽

Slit Pore ◽

Square Well ◽

Fluid Phase Equilibria

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Gibbs-ensemble Monte Carlo simulation for the liquid-vapor coexistence of alkali fluids

Journal of Non-Crystalline Solids ◽

10.1016/s0022-3093(96)00386-9 ◽

1996 ◽

Vol 205-207 ◽

pp. 897-900 ◽

Cited By ~ 1

Author(s):

E. Velasco ◽

J.P. Hernandez ◽

P. Tarazona ◽

E. Chacón

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Gibbs Ensemble ◽

Ensemble Monte Carlo ◽

Ensemble Monte Carlo Simulation ◽

Gibbs Ensemble Monte Carlo ◽

Liquid Vapor

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Closed-loop phase equilibria of a symmetrical associating mixture of square-well molecules examined by Gibbs ensemble Monte Carlo simulation

Physical Review E ◽

10.1103/physreve.61.2245 ◽

2000 ◽

Vol 61 (3) ◽

pp. 2245-2256 ◽

Cited By ~ 12

Author(s):

Lowri A. Davies ◽

George Jackson ◽

Luis F. Rull

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Phase Equilibria ◽

Closed Loop ◽

Gibbs Ensemble ◽

Ensemble Monte Carlo ◽

Ensemble Monte Carlo Simulation ◽

Gibbs Ensemble Monte Carlo ◽

Square Well

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Liquid—liquid—vapor phase equilibria behavior of certain binary ethane + n-alkylbenzene mixtures

Fluid Phase Equilibria ◽

10.1016/0378-3812(88)87020-1 ◽

1988 ◽

Vol 40 (3) ◽

pp. 235-245 ◽

Cited By ~ 18

Author(s):

Adisak Jangkamolkulchai ◽

Melanie M. Arbuckle ◽

Kraemer D. Luks

Keyword(s):

Phase Equilibria ◽

Vapor Phase ◽

Liquid Vapor

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