Volume 18, Issue 2 2104592
Research Article

Realizing Enhanced Thermoelectric Performance and Hardness in Icosahedral Cu5FeS4−xSex with High-Density Twin Boundaries

Huan Wang

Huan Wang

College of Physics, Chongqing University, Chongqing, 401331 P. R. China

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Sikang Zheng

Sikang Zheng

College of Physics, Chongqing University, Chongqing, 401331 P. R. China

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Hong Wu

Hong Wu

College of Physics, Chongqing University, Chongqing, 401331 P. R. China

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Xin Xiong

Xin Xiong

College of Physics, Chongqing University, Chongqing, 401331 P. R. China

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Qihong Xiong

Qihong Xiong

College of Physics, Chongqing University, Chongqing, 401331 P. R. China

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Hengyang Wang

Hengyang Wang

College of Materials Science and Engineering, Chongqing University, Chongqing, 400044 P. R. China

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Yang Wang

Yang Wang

College of Physics, Chongqing University, Chongqing, 401331 P. R. China

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Bin Zhang

Bin Zhang

Analytical and Testing Center, Chongqing University, Chongqing, 401331 P. R. China

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Xu Lu

Xu Lu

College of Physics, Chongqing University, Chongqing, 401331 P. R. China

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Guang Han

Corresponding Author

Guang Han

College of Materials Science and Engineering, Chongqing University, Chongqing, 400044 P. R. China

E-mail: [email protected], [email protected], [email protected]

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Guoyu Wang

Corresponding Author

Guoyu Wang

Chongqing Institute of Green and Intelligent Technology, Chinese Academy of Sciences, Chongqing, 400714 P. R. China

University of Chinese Academy of Sciences, Beijing, 100044 P. R. China

E-mail: [email protected], [email protected], [email protected]

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Xiaoyuan Zhou

Corresponding Author

Xiaoyuan Zhou

College of Physics, Chongqing University, Chongqing, 401331 P. R. China

Analytical and Testing Center, Chongqing University, Chongqing, 401331 P. R. China

E-mail: [email protected], [email protected], [email protected]

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First published: 05 November 2021
Citations: 12

Abstract

Bornite (Cu5FeS4) is an Earth-abundant, nontoxic thermoelectric material. Herein, twin engineering and Se alloying are combined in order to further improve its thermoelectric performance. Cu5FeS4−xSex (0 x  0.4) icosahedral nanoparticles, containing high-density twin boundaries, have been synthesized by a colloidal method. Spark plasma sintering retains twin boundaries in the pellets sintered from Cu5FeS4−xSex colloidal powders. Thermoelectric property measurement demonstrates that alloying Se increases the carrier concentration, leading to much-improved power factor in Se-substituted Cu5FeS4, for example, 0.84 mW m−1 K−2 at 726 K for Cu5FeS3.6Se0.4; low lattice thermal conductivity is also achieved, due to intrinsic structural complexity, distorted crystal structure, and existing twin boundaries and point defects. As a result, a maximum zT of 0.75 is attained for Cu5FeS3.6Se0.4 at 726 K, which is about 23% higher than that of Cu5FeS4 and compares favorably to that of reported Cu5FeS4-based materials. In addition, the Cu5FeS4−xSex samples containing twin boundaries also obtain improved hardness compared to the ones fabricated by melting-annealing or ball milling. This work demonstrates an effective twin engineering-composition tuning strategy toward enhanced thermoelectric and mechanical properties of Cu5FeS4-based materials.

Conflict of Interest

The authors declare no conflict of interest.

Data Availability Statement

Research data are not shared.

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