材料科学技术(英文版)2022,Vol.127Issue(32) :108-114.

Enhanced thermoelectric performance in n-type Mg3.2Sb1.5Bi0.5 doping with lanthanides at the Mg site

Lu Yu Zipei Zhang Juan Li Wenhao Li Shikai Wei Sitong Wei Guiwu Lu Weiyu Song Shuqi Zheng
材料科学技术(英文版)2022,Vol.127Issue(32) :108-114.

Enhanced thermoelectric performance in n-type Mg3.2Sb1.5Bi0.5 doping with lanthanides at the Mg site

Lu Yu 1Zipei Zhang 1Juan Li 1Wenhao Li 1Shikai Wei 1Sitong Wei 1Guiwu Lu 2Weiyu Song 2Shuqi Zheng1
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作者信息

  • 1. State Key Laboratory of Heavy Oil Processing,College of New Energy and Materials,China University of Petroleum,Beijing 102249,China
  • 2. College of Science,China University of Petroleum,Beijing 102249,China
  • 折叠

Abstract

Mg-based thermoelectric materials have attracted more and more attention because of their rich com-position elements,green environmental protection,and lower price.In recent years,the thermoelectric properties of n-type Mg3Sb2 materials have been optimized by doping chalcogenide elements(S,Se,and Te)at the anionic position.In this work,n-type Mg3.2AxSb1.5Bi0.5(A=Gd,Ho;x=0.01,0.02,0.03,and 0.4)samples were prepared by the cation site doping of lanthanide elements(Gd and Ho).The research re-sults show that Gd and Ho doped n-type Mg3.2Sb1.5Bio.5 samples are entirely comparable to the S,Se,and Te doped n-type Mg3.2Sb1.5Bi0.5 samples,demonstrating more excellent thermoelectric properties.Dop-ing with lanthanides(Gd and Ho)at the Mg site increases the carrier concentration of the material to 8.161 x 1019 cm-3.Doping induces the contribution of more electron,thus obtaining higher conductiv-ity.The maximum zT value of the Mg3.2Gd0.02Sb1.5Bi0.5 and the Mg3.2HO0.02Sb1.5Bi0.5 samples reaches 1.61 and 1.55,respectively.This work theoretically and experimentally demonstrates Gd and Ho are efficient n-type dopants for Mg3.2Sb1.5Bi0.5 thermoelectric material.

Key words

Thermoelectric material/First-principles calculation/Mg3.2Sb1.5Bi0.5

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基金项目

国家自然科学基金(51871240)

calculations were carried out at the National Supercomputing Center in Shenzhen(Shenzhen Cloud Computing Center)()

出版年

2022
材料科学技术(英文版)
中国金属学会 中国材料研究学会 中国科学院金属研究所

材料科学技术(英文版)

CSTPCDCSCDSCI
影响因子:0.657
ISSN:1005-0302
参考文献量34
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