論文 Modulating phonon dynamics: tailoring lattice vibrations to enhance thermoelectric efficiency in Mg3(Sb, Bi)2 alloy

Gang Wu (National Institute for Materials Science) ; Airan Li SAMURAI ORCID (National Institute for Materials Science) ; Longquan Wang SAMURAI ORCID (National Institute for Materials Science) ; Xinzhi Wu (National Institute for Materials Science) ; Xinyuan Wang (National Institute for Materials Science) ; Takao Mori SAMURAI ORCID (National Institute for Materials Science)

コレクション

引用
Gang Wu, Airan Li, Longquan Wang, Xinzhi Wu, Xinyuan Wang, Takao Mori. Modulating phonon dynamics: tailoring lattice vibrations to enhance thermoelectric efficiency in Mg3(Sb, Bi)2 alloy. Nature Communications. 2025, 16 (1), 10366. https://doi.org/10.1038/s41467-025-65325-7

説明:

(abstract)

Heat in crystalline materials is transported by phonons from lattice vibrations, and lattice thermal conductivity critically determines thermoelectric performance. Different from conventional approach that reduce thermal conductivity via extrinsic additives sacrificing electrical transport, here, we demonstrate a notable advancement in the n-type Mg3Sb1.5Bi0.5 by modulating phonon dynamics through lattice softening and simultaneously suppressing the phonon mean free path in a more localized manner while remaining compositionally invariant. Originating from Mg vacancies and derivative defects, elevated internal strain degrades bonding rigidity and localize phonons at the lattice-constant level, yielding an ultra-low thermal conductivity of 0.3 W m⁻¹ K⁻¹, close to the theoretical minimum. This intrinsic strategy, combined with electron concentration optimization, yields a ZTmax of 2.06 and an extraordinary ZTave of 1.58, exceeding state-of-the-art n-type materials. Furthermore, a single-leg generator and two-pair module deliver conversion efficiencies of 12.5% (ΔT = 440 K) and 7.4% (ΔT = 300 K), respectively, highlighting exceptional potential for waste heat recovery.

権利情報:

キーワード: thermoelectric

刊行年月日: 2025-11-24

出版者: Springer Science and Business Media LLC

掲載誌:

  • Nature Communications (ISSN: 20411723) vol. 16 issue. 1 10366

研究助成金:

  • MEXT | Japan Science and Technology Agency JPMJMI19A1

原稿種別: 出版者版 (Version of record)

MDR DOI:

公開URL: https://doi.org/10.1038/s41467-025-65325-7

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更新時刻: 2025-12-15 10:24:14 +0900

MDRでの公開時刻: 2025-12-18 19:08:19 +0900