Thermal conductivity of half-Heusler compounds from first-principles calculations

Thermal conductivity of half-Heusler compounds from first-principles calculations

We demonstrate successful application of first-principles-based thermal conductivity calculation on half-Heusler compounds that are promising, environmentally friendly thermoelectric materials. Taking the case of a p-type half-Heusler structure, the harmonic and anharmonic interatomic force constant...

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Bibliographic Details
Main Authors:	Shiomi, Junichiro, Esfarjani, Keivan, Chen, Gang
Other Authors:	Massachusetts Institute of Technology. Department of Mechanical Engineering
Format:	Article
Language:	en_US
Published:	American Physical Society (APS) 2012
Online Access:	http://hdl.handle.net/1721.1/68672 https://orcid.org/0000-0002-3968-8530

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