Temperature-and-density-scaling Monte Carlo: methodology and the canonical thermodynamics of Lennard-Jonesium

DOI10.1080/08927020500035937zbMath1071.80006OpenAlexW2114871233MaRDI QIDQ4680765

John P. Valleau

Publication date: 7 June 2005

Published in: Molecular Simulation (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1080/08927020500035937

zbMATH Keywords

canonical ensembleequation of statecoexistenceLennard-JonesMonte Carlo runthermodynamic scaling

Mathematics Subject Classification ID

Related Items (1)

Accelerating Monte Carlo molecular simulations by reweighting and reconstructing Markov chains: extrapolation of canonical ensemble averages and second derivatives to different temperature and density conditions

Cites Work

• Unnamed Item
• A Thermodynamic-scaling Study of Gibbs-ensemble Monte Carlo
• Temperature-and-density-scaling Monte Carlo: isothermal–isobaric thermodynamics of Lennard-Jonesium

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