Auto-calibration strategy for the equilibration phase of Gibbs ensemble Monte Carlo simulations-Reference-Cited by-同舟云学术

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Auto-calibration strategy for the equilibration phase of Gibbs ensemble Monte Carlo simulations

Published:2023-06-14 Issue:11 Volume:49 Page:1143-1156
ISSN:0892-7022
Container-title:Molecular Simulation
language:en
Short-container-title:Molecular Simulation

Author:

Mayr Niklas¹,Haring Michael¹,Wallek Thomas¹

Affiliation:

1. Institute of Chemical Engineering and Environmental Technology, Graz University of Technology, Graz, Austria

Publisher

Informa UK Limited

Subject

Condensed Matter Physics,General Materials Science,General Chemical Engineering,Modeling and Simulation,Information Systems,General Chemistry

Link

https://www.tandfonline.com/doi/pdf/10.1080/08927022.2023.2221355

Reference37 articles.

1. Monte Carlo methods for phase equilibria of fluids

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

3. Some Topics in the Theory of Fluids

4. Brick-CFCMC: Open Source Software for Monte Carlo Simulations of Phase and Reaction Equilibria Using the Continuous Fractional Component Method

5. Cassandra: An open source Monte Carlo package for molecular simulation

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