First-Principles Calculations of Thermoelectric Transport Properties of Quaternary and Ternary Bulk Chalcogenide Crystals

First-Principles Calculations of Thermoelectric Transport Properties of Quaternary and Ternary Bulk Chalcogenide Crystals

Chalcogenide crystals have a wide range of applications, especially as thermoelectric materials for energy conversion. Thermoelectric materials can be used to generate an electric current from a temperature gradient based on the Seebeck effect and based on the Peltier effect, and they can be used in...

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Bibliographic Details
Main Authors: Sahib Hasan, Saro San, Khagendra Baral, Neng Li, Paul Rulis, Wai-Yim Ching
Format: Article
Language:English
Published: MDPI AG 2022-04-01
Series:Materials
Subjects:
chalcogenide crystals
Boltzmann theory
Seebeck coefficient
thermoelectric properties
total bond order density
density functional theory
Online Access:https://www.mdpi.com/1996-1944/15/8/2843

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https://www.mdpi.com/1996-1944/15/8/2843

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