monteswitch : A package for evaluating solid–solid free energy differences via lattice-switch Monte Carlo
Author:
Funder
Engineering and Physical Sciences Research Council
Publisher
Elsevier BV
Subject
General Physics and Astronomy,Hardware and Architecture
Reference40 articles.
1. Understanding Molecular Simulation;Frenkel,2001
2. Free Energy of Crystalline Solids: A Lattice-Switch Monte Carlo Method
3. Lattice-switch Monte Carlo method
4. Lattice-switch Monte Carlo method: Application to soft potentials
5. Can stacking faults in hard-sphere crystals anneal out spontaneously?
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2. Comparison of Different Methods of Atomistic Simulation To Calculate the Temperature of Phase Transition Using the Example of Zirconium;Journal of Experimental and Theoretical Physics;2019-05
3. DL_MONTE: a multipurpose code for Monte Carlo simulation;Molecular Simulation;2019-02-01
4. Gibbs free-energy differences between polymorphs via a diabat approach;The Journal of Chemical Physics;2018-12-07
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