Methods of Single-Step and Multistep Particle Switching in Simulations of Mixtures
Author:
Affiliation:
1. Department of Chemistry, University of Cincinnati, Cincinnati, Ohio 45221-0172
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,General Engineering
Link
https://pubs.acs.org/doi/pdf/10.1021/jp9616324
Reference20 articles.
1. Partial enthalpies and related quantities in mixtures from computer simulation
2. Calculation of thermodynamic derivatives from NPT computer simulation in combination with the Kirkwood-Buff theory
3. Prediction of liquid–liquid phase equilibria of He+H2 mixtures by NpT molecular dynamics simulations
4. Conformality in the Kirkwood–Buff solution theory of statistical mechanics
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1. Computing the starting state for Gibbs-Duhem integration;The Journal of Chemical Physics;2006-02-07
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