Theoretical analysis of the thermoelectric properties of penta-PdX2 (X = Se, Te) monolayer

Theoretical analysis of the thermoelectric properties of penta-PdX2 (X = Se, Te) monolayer

Based on the successful fabrication of PdSe2 monolayers, the electronic and thermoelectric properties of pentagonal PdX2 (X = Se, Te) monolayers were investigated via first-principles calculations and the Boltzmann transport theory. The results showed that the PdX2 monolayer exhibits an indirect ban...

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Hlavní autoři: Lei Li, Zhuqin Huang, Jinqi Xu, Haihua Huang
Médium: Článek
Jazyk:English
Vydáno: Frontiers Media S.A. 2022-11-01
Edice:Frontiers in Chemistry
Témata:
two-dimensional material
thermoelectric material
transport property
first-principles calculation
electronic structure
On-line přístup:https://www.frontiersin.org/articles/10.3389/fchem.2022.1061703/full

Internet

https://www.frontiersin.org/articles/10.3389/fchem.2022.1061703/full

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