Thermoelectric Properties of Mg<sub>3</sub>(Bi,Sb)<sub>2</sub> under Finite Temperatures and Pressures: A First-Principles Study

Thermoelectric Properties of Mg<sub>3</sub>(Bi,Sb)<sub>2</sub> under Finite Temperatures and Pressures: A First-Principles Study

Mg<sub>3</sub>Bi<sub>2−v</sub>Sb<sub>v</sub> (0 ≤ v ≤ 2) is a class of promising thermoelectric materials that have a high thermoelectric performance around room temperatures, whereas their thermoelectric properties under pressures and temperatures are still illus...

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Bibliographic Details
Main Authors: Qing Peng, Xinjie Ma, Xiaoyu Yang, Xiaoze Yuan, Xiao-Jia Chen
Format: Article
Language:English
Published: MDPI AG 2023-12-01
Series:Nanomaterials
Subjects:
thermoelectric materials
PBE-D3
vdW-DFq
first-principles calculation
Mg<sub>3</sub>Bi<sub>2−v</sub>Sb<sub>v</sub>
MatCloud
Online Access:https://www.mdpi.com/2079-4991/14/1/84

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https://www.mdpi.com/2079-4991/14/1/84

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