Erratum: “Solid–liquid equilibria and triple points of n-6 Lennard-Jones fluids” [J. Chem. Phys. 131, 174504 (2009)]

2010 ◽  
Vol 133 (22) ◽  
pp. 229902 ◽  
Author(s):  
Alauddin Ahmed ◽  
Richard J. Sadus
Keyword(s):  
Chem Phys ◽  
Lennard Jones ◽  
Triple Points ◽  
Solid Liquid

Solid-liquid equilibria and triple points of n-6 Lennard-Jones fluids

2009 ◽  
Vol 131 (17) ◽  
pp. 174504 ◽  
Author(s):  
Alauddin Ahmed ◽  
Richard J. Sadus
Keyword(s):  
Lennard Jones ◽  
Triple Points ◽  
Solid Liquid

Weeks−Chandler−Andersen Model for Solid−Liquid Equilibria in Lennard-Jones Systems

2002 ◽  
Vol 106 (32) ◽  
pp. 7878-7881 ◽  
Author(s):  
Sugata Pikatan Tan ◽  
Hertanto Adidharma ◽  
Maciej Radosz
Keyword(s):  
Lennard Jones ◽  
Andersen Model ◽  
Solid Liquid

scholarly journals Representation of Solid, Liquid, and Vapor phases of Binary Lennard Jones Mixtures using the SLV-EoS

2013 ◽  
Vol 3 ◽  
pp. 01082
Author(s):  
P. Stringari ◽  
M. Campestrini ◽  
C. Coquelet ◽  
P. Arpentinier
Keyword(s):  
Lennard Jones ◽  
Solid Liquid ◽  
Liquid And Vapor Phases

Density-Functional Thermodynamic Perturbation Theory of Lennard-Jones Solids

1992 ◽  
Vol 278 ◽  
Author(s):  
Agathagelos Kyrlidis ◽  
Robert A. Brown
Keyword(s):  
Density Functional ◽  
Interatomic Potential ◽  
Structural Information ◽  
Hard Spheres ◽  
Energy Functional ◽  
Thermodynamic Perturbation Theory ◽  
Lennard Jones ◽  
Dependent Potential ◽  
Solid Liquid ◽  
Thermodynamic Perturbation

AbstractThe thermodynamics of a fcc hard spheres solid is accurately described by recent density-functional approximations. This state is used as a reference in a thermodynamic perturbation analysis for a density-functional theory of Lennard-Jones solids. The free energy functional incorporates liquid state structural information and a density dependent potential decomposition for the Lennard-Jones interatomic potential. The computed free energies of the solids compare very well with the predictions of atonlistic simulations. Solid-liquid coexistence is predicted consistently to within 15% of results of Monte Carlo simulations, over the temperature range 0.75 ≤ kT/c ε ≤ 10.

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