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Configurational temperature profile in confined fluids. II. Molecular fluids

Delhommelle, Jerome; Evans, Denis J.


In an earlier paper, we applied configurational expressions of the temperature to the calculation of temperature profiles within a confined atomic fluid. This paper focuses on the application of these expressions to confined molecular fluids using ethane and hexane as examples. We first give configurational expressions for the temperature for these constrained systems. The configurational temperature profiles so obtained are compared to the kinetic temperature calculated using the equipartition...[Show more]

CollectionsANU Research Publications
Date published: 2001-04-08
Type: Journal article
Source: The Journal of Chemical Physics
DOI: 10.1063/1.1356000


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