Liquid–vapor coexistence by molecular dynamics simulation
- 22 February 2000
- journal article
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 112 (8) , 3516-3522
- https://doi.org/10.1063/1.480506
Abstract
No abstract availableThis publication has 13 references indexed in Scilit:
- Number-dependence concerns in Gibbs-ensemble Monte CarloThe Journal of Chemical Physics, 1998
- Quantitative comparison and optimization of methods for evaluating the chemical potential by molecular simulationMolecular Physics, 1997
- On the Molecular Dynamics Algorithm for Gibbs Ensemble SimulationMolecular Simulation, 1996
- Avoiding singularities and numerical instabilities in free energy calculations based on molecular simulationsChemical Physics Letters, 1994
- Gibbs-Duhem integration: a new method for direct evaluation of phase coexistence by molecular simulationMolecular Physics, 1993
- Hoover NPT dynamics for systems varying in shape and sizeMolecular Physics, 1993
- Phase equilibria by simulation in the Gibbs ensembleMolecular Physics, 1988
- Direct determination of phase coexistence properties of fluids by Monte Carlo simulation in a new ensembleMolecular Physics, 1987
- Canonical dynamics: Equilibrium phase-space distributionsPhysical Review A, 1985
- Nonequilibrium molecular dynamics via Gauss's principle of least constraintPhysical Review A, 1983