A non-additive repulsive contribution in an equation of state: The development for homonuclear square well chains equation of state validated against Monte Carlo simulation

Thi-Kim-Hoang Trinh; Jean-Philippe Passarello; Jean-Charles de Hemptinne; Rafael Lugo; Veronique Lachet

doi:10.1063/1.4944068

A non-additive repulsive contribution in an equation of state: The development for homonuclear square well chains equation of state validated against Monte Carlo simulation

The Journal of Chemical Physics ◽

10.1063/1.4944068 ◽

2016 ◽

Vol 144 (12) ◽

pp. 124902 ◽

Cited By ~ 5

Author(s):

Thi-Kim-Hoang Trinh ◽

Jean-Philippe Passarello ◽

Jean-Charles de Hemptinne ◽

Rafael Lugo ◽

Veronique Lachet

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Equation Of State ◽

Square Well

Download Full-text

Square-well chain molecules: a semi-empirical equation of state and Monte Carlo simulation data

Fluid Phase Equilibria ◽

10.1016/j.fluid.2004.03.008 ◽

2004 ◽

Vol 221 (1-2) ◽

pp. 63-72 ◽

Cited By ~ 10

Author(s):

Ming-Jer Lee ◽

Clare McCabe ◽

Peter T. Cummings

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Equation Of State ◽

Empirical Equation ◽

Simulation Data ◽

Chain Molecules ◽

Square Well ◽

Semi Empirical

Download Full-text

Square-well chain mixture: analytic equation of state and Monte Carlo simulation data

Fluid Phase Equilibria ◽

10.1016/s0378-3812(00)00505-7 ◽

2001 ◽

Vol 179 (1-2) ◽

pp. 245-267 ◽

Cited By ~ 12

Author(s):

Márcio L.L. Paredes ◽

Ronaldo Nobrega ◽

Frederico W. Tavares

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Equation Of State ◽

Simulation Data ◽

Analytic Equation ◽

Square Well

Download Full-text

An equation of state for the hard-sphere chain fluid: theory and Monte Carlo simulation

Chemical Engineering Science ◽

10.1016/0009-2509(94)e0097-a ◽

1994 ◽

Vol 49 (17) ◽

pp. 2777-2791 ◽

Cited By ~ 114

Author(s):

Jaeeon Chang ◽

Stanley I. Sandler

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Equation Of State ◽

Hard Sphere ◽

Fluid Theory

Download Full-text

Monte–Carlo simulation of crystallization in single‐chain square‐well homopolymers

Polymer Crystallization ◽

10.1002/pcr2.10146 ◽

2020 ◽

Author(s):

Thomas J. Wicks ◽

Jonathan A. D. Wattis ◽

Richard S. Graham

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Single Chain ◽

Square Well

Download Full-text

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

Download Full-text

Coordination number models and equations of state for square-well pure and mixture fluids, Part I: Coordination number models and Monte Carlo simulation at high density

Chemical Engineering Science ◽

10.1016/s0009-2509(99)00483-2 ◽

2000 ◽

Vol 55 (11) ◽

pp. 2099-2109 ◽

Cited By ~ 10

Author(s):

Dapeng Cao ◽

Wenchuan Wang

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Coordination Number ◽

Equations Of State ◽

High Density ◽

Square Well

Download Full-text

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

Download Full-text

Monte Carlo simulation of ternary square-well fluid mixtures

Fluid Phase Equilibria ◽

10.1016/0378-3812(90)85040-h ◽

1990 ◽

Vol 60 (1-2) ◽

pp. 11-36 ◽

Cited By ~ 9

Author(s):

Hong Wang ◽

Wenchuan Wang

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Fluid Mixtures ◽

Square Well

Download Full-text

Vapor-liquid coexistence in 2D square-well fluid with variable range of attraction: Monte Carlo simulation study

The Journal of Chemical Physics ◽

10.1063/1.4769983 ◽

2012 ◽

Vol 137 (22) ◽

pp. 224505 ◽

Cited By ~ 6

Author(s):

Wojciech Rżysko ◽

Andrij Trokhymchuk

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Simulation Study ◽

Monte Carlo Simulation Study ◽

Variable Range ◽

Square Well ◽

Vapor Liquid

Download Full-text

Phase equilibria and critical behavior of square‐well fluids of variable width by Gibbs ensemble Monte Carlo simulation

The Journal of Chemical Physics ◽

10.1063/1.462080 ◽

1992 ◽

Vol 96 (3) ◽

pp. 2296-2305 ◽

Cited By ~ 258

Author(s):

Lourdes Vega ◽

Enrique de Miguel ◽

Luis F. Rull ◽

George Jackson ◽

Ian A. McLure

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Phase Equilibria ◽

Critical Behavior ◽

Gibbs Ensemble ◽

Ensemble Monte Carlo ◽

Ensemble Monte Carlo Simulation ◽

Gibbs Ensemble Monte Carlo ◽

Square Well

Download Full-text