An EOS for the Lennard-Jones fluid: A virial expansion approach

A large number (>30 000) of Monte Carlo simulations in range of 0.002–1.41 ρ* and T* ≤ 25 (* for reduced, dimensionless) was performed, producing a dense grid of state points for the internal energy U* and pressure p*. The dense grid in ρ* allows the direct integration to obtain the Helmholtz fre...

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Bibliographic Details
Main Author: Matthias Gottschalk
Format: Article
Language:English
Published: AIP Publishing LLC 2019-12-01
Series:AIP Advances
Online Access:http://dx.doi.org/10.1063/1.5119761