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Machine learning prediction of the optimal carrier concentration and band gap of quaternary thermoelectric materials via element feature descriptors

Wan, ZY; Wang, QD; Liu, DC; Liang, JH

Wan, ZY; Wang, QD (corresponding author), China Univ Min & Technol, Low Carbon Energy Inst, Xuzhou 221008, Jiangsu, Peoples R China.; Wan, ZY; Wang, QD (corresponding author), China Univ Min & Technol, Sch Chem Engn, Xuzhou 221008, Jiangsu, Peoples R China.

INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2021; 121 (18):

Abstract

While the thermoelectric (TE) materials have attracted significant attention in recent years, the design and discovery of new TE materials with optima......

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