Beyond metals: theoretical discovery of semiconducting MAX phases and their potential application in thermoelectrics

Author:

Khazaei Mohammad12ORCID,Maleki Iraj1ORCID,Koshi Namitha Anna34,Ranjbar Ahmad5ORCID,Miao Nanxi6,Wang Junjie6ORCID,Khaledialidusti Rasoul7ORCID,Kühne Thomas D.58,Lee Seung-Cheol4ORCID,Bhattacharjee Satadeep34ORCID,Hosano Hamid910ORCID,Mehdi Vaez Allaei S.111ORCID,Esfarjani Keivan12ORCID,Ohno Kaoru13ORCID

Affiliation:

1. Department of Physics, University of Tehran, North Kargar Ave., Tehran 14395-547, Iran

2. School of Nano Science, Institute for Research in Fundamental Sciences (IPM), Tehran 19395-5531, Iran

3. Indo-Korea Science and Technology Center (IKST), Jakkur, Bengaluru 560064, India

4. Korea Institute of Science and Technology (KIST), Seoul 136-791, South Korea

5. Dynamics of Condensed Matter and Center for Sustainable Systems Design, Theoretical Chemistry, University of Paderborn, Warburger Str. 100, D-33098 Paderborn, Germany

6. State Key Laboratory of Solidification Processing, Northwestern Polytechnical University, Xi’an, Shaanxi 710072, People's Republic of China

7. Department of Mechanical and Industrial Engineering, Norwegian University of Science and Technology (NTNU), Trondheim 7491, Norway

8. Center for Advanced Systems Understanding (CASUS) and Helmholtz-Zentrum Dresden-Rossendorf, D-02826 Görlitz, Germany

9. Graduate School of Science and Technology, Kumamoto University, Kumamoto 860-8555, Japan

10. Department of Biomaterials and Bioelectrics, Institute of Industrial Nanomaterials, Kumamoto University, Japan

11. New Uzbekistan University, Movarounnahr Street 1, Tashkent 100000, Uzbekistan

12. Department of Materials Science and Engineering and Department of Physics, University of Virginia, Charlottesville, VA 22904, USA

13. Department of Physics, Graduate School of Engineering Science, Yokohama National University, Yokohama 240-8501, Japan

Abstract

Some MAX phase can be narrowband semiconductor with superior thermoelectric performance.

Funder

Iran National Science Foundation

Tohoku University

Publisher

Royal Society of Chemistry (RSC)

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