Direct Gibbs Ensemble Monte Carlo Simulations for Solid−Vapor Phase Equilibria: Applications to Lennard−Jonesium and Carbon Dioxide-Reference-Cited by-同舟云学术

Direct Gibbs Ensemble Monte Carlo Simulations for Solid−Vapor Phase Equilibria: Applications to Lennard−Jonesium and Carbon Dioxide

Published:2001-09-07 Issue:40 Volume:105 Page:9840-9848
ISSN:1520-6106
Container-title:The Journal of Physical Chemistry B
language:en
Short-container-title:J. Phys. Chem. B

Author:

Chen Bin¹,Siepmann J. Ilja¹,Klein Michael L.¹

Affiliation:

1. Department of Chemistry and Department of Chemical Engineering and Materials Science, University of Minnesota, 207 Pleasant Street SE, Minneapolis, Minnesota 55455-0431, Laboratory for Research on the Structure of Matter and Center for Molecular Modeling, University of Pennsylvania, 3231 Walnut Street, Philadelphia, Pennsylvania 19104-6202

Publisher

American Chemical Society (ACS)

Subject

Materials Chemistry,Surfaces, Coatings and Films,Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp011950p

Reference46 articles.

1. Direct determination of phase coexistence properties of fluids by Monte Carlo simulation in a new ensemble

2. Phase equilibria by simulation in the Gibbs ensemble

3. Computer simulations in the Gibbs ensemble

4. Simulating the critical behaviour of complex fluids

Cited by 99 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Adsorption Mechanism and Characteristic Temperatures of the Monolayer Adsorption of CO₂ on Graphite: The Role of Graphene Dimensions;Langmuir;2024-07-04

2. A simple and accurate method to determine fluid–crystal phase boundaries from direct coexistence simulations;The Journal of Chemical Physics;2024-06-13

3. Understanding and Predicting the Spatially Resolved Adsorption Properties of Nanoporous Materials;Journal of Chemical Theory and Computation;2024-04-19

4. A Hybrid Monte Carlo study of argon solidification;Zeitschrift für Naturforschung B;2024-04-01

5. Theoretical investigation on the solid–liquid phase transition of gallium through free energy analysis;Journal of Molecular Modeling;2024-03-27