| Literature DB >> 30646717 |
Lorenzo Costigliola1, David M Heyes2, Thomas B Schrøder1, Jeppe C Dyre1.
Abstract
We present diffusion coefficient and shear viscosity data for the Lennard-Jones fluid along nine isochores above the critical density, each involving a temperature variation of roughly two orders of magnitude. The data are analyzed with respect to the Stokes-Einstein (SE) relation, which breaks down gradually at high temperatures. This is rationalized in terms of the fact that the reduced diffusion coefficient D ̃ and the reduced viscosity η ̃ are both constant along the system's lines of constant excess entropy (the isomorphs). As a consequence, D ̃ η ̃ is a function of T/T Ref(ρ) in which T is the temperature, ρ is the density, and T Ref(ρ) is the temperature as a function of the density along a reference isomorph. This allows one to successfully predict the viscosity from the diffusion coefficient in the studied region of the thermodynamic phase diagram.Entities:
Year: 2019 PMID: 30646717 DOI: 10.1063/1.5080662
Source DB: PubMed Journal: J Chem Phys ISSN: 0021-9606 Impact factor: 3.488