Discovery of TaFeSb-based half-Heuslers with high thermoelectric performance View Full Text


Ontology type: schema:ScholarlyArticle      Open Access: True


Article Info

DATE

2019-12

AUTHORS

Hangtian Zhu, Jun Mao, Yuwei Li, Jifeng Sun, Yumei Wang, Qing Zhu, Guannan Li, Qichen Song, Jiawei Zhou, Yuhao Fu, Ran He, Tian Tong, Zihang Liu, Wuyang Ren, Li You, Zhiming Wang, Jun Luo, Andrei Sotnikov, Jiming Bao, Kornelius Nielsch, Gang Chen, David J. Singh, Zhifeng Ren

ABSTRACT

Discovery of thermoelectric materials has long been realized by the Edisonian trial and error approach. However, recent progress in theoretical calculations, including the ability to predict structures of unknown phases along with their thermodynamic stability and functional properties, has enabled the so-called inverse design approach. Compared to the traditional materials discovery, the inverse design approach has the potential to substantially reduce the experimental efforts needed to identify promising compounds with target functionalities. By adopting this approach, here we have discovered several unreported half-Heusler compounds. Among them, the p-type TaFeSb-based half-Heusler demonstrates a record high ZT of ~1.52 at 973 K. Additionally, an ultrahigh average ZT of ~0.93 between 300 and 973 K is achieved. Such an extraordinary thermoelectric performance is further verified by the heat-to-electricity conversion efficiency measurement and a high efficiency of ~11.4% is obtained. Our work demonstrates that the TaFeSb-based half-Heuslers are highly promising for thermoelectric power generation. More... »

PAGES

270

Identifiers

URI

http://scigraph.springernature.com/pub.10.1038/s41467-018-08223-5

DOI

http://dx.doi.org/10.1038/s41467-018-08223-5

DIMENSIONS

https://app.dimensions.ai/details/publication/pub.1111375474

PUBMED

https://www.ncbi.nlm.nih.gov/pubmed/30655512


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