An ab initio method for the prediction of the lattice thermal transport properties of oxide systems: Case study of Li2O and K2O-Reference-Cited by-同舟云学术

An ab initio method for the prediction of the lattice thermal transport properties of oxide systems: Case study of Li2O and K2O

Published:2015-10-14 Issue:14 Volume:118 Page:145101
ISSN:0021-8979
Container-title:Journal of Applied Physics
language:en
Short-container-title:Journal of Applied Physics

Author:

Gheribi Aïmen E.¹,Seifitokaldani Ali¹²^ORCID,Wu Pearson³,Chartrand Patrice¹

Affiliation:

1. CRCT - Center for Research in Computational Thermochemistry, Polytechnique Montreal, Box 6079, Station Downtown, Montréal, Québec H3C 3A7, Canada

2. LCES—Université de Montréal, P.O. 6128, Downtown Branch, Montréal, Quebec, Canada

3. Department of Engineering Science, Faculty of Applied Science and Engineering, University of Toronto, 35 St. George Street Toronto, Ontario M5S 1A4, Canada

Funder

Natural Sciences and Engineering Research Council of Canada (NSERC)

Publisher

AIP Publishing

Subject

General Physics and Astronomy

Link

http://aip.scitation.org/doi/pdf/10.1063/1.4932643

Reference37 articles.

1. Lattice thermal conductivity of UO2usingab-initioand classical molecular dynamics

2. Ab initiotheory of the lattice thermal conductivity in diamond

3. Thermal transport properties of halide solid solutions: Experiments vs equilibrium molecular dynamics

5. Prediction of the thermophysical properties of molten salt fast reactor fuel from first-principles

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