Skip navigation
Skip navigation

Thermal conductivity of ethanol

Petravic, Janka


We present a factorization of the Ewald sum permitting efficient computation of the reciprocal space part of the molecular representation for the heat flux vector. We use the derived expression to evaluate thermal conductivity of a model of ethanol at several near-ambient state points.

CollectionsANU Research Publications
Date published: 2005
Type: Journal article
Source: Journal of Chemical Physics
DOI: 10.1063/1.2102867


File Description SizeFormat Image
01_Petravic_Thermal_conductivity_of_2005.pdf371.35 kBAdobe PDF    Request a copy

Items in Open Research are protected by copyright, with all rights reserved, unless otherwise indicated.

Updated:  19 May 2020/ Responsible Officer:  University Librarian/ Page Contact:  Library Systems & Web Coordinator