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結晶構造と磁気構造の同時最適化:トポロジカル磁性エレクトライドへの応用

研究課題

研究課題/領域番号 22KJ1151
補助金の研究課題番号 22J23068 (2022)
研究種目

特別研究員奨励費

配分区分基金 (2023)
補助金 (2022)
応募区分国内
審査区分 小区分13030:磁性、超伝導および強相関系関連
研究機関東京大学

研究代表者

YU Tonghua  東京大学, 工学系研究科, 特別研究員(DC1)

研究期間 (年度) 2023-03-08 – 2025-03-31
研究課題ステータス 交付 (2023年度)
配分額 *注記
2,500千円 (直接経費: 2,500千円)
2024年度: 800千円 (直接経費: 800千円)
2023年度: 800千円 (直接経費: 800千円)
2022年度: 900千円 (直接経費: 900千円)
キーワードElectrides / Topological phases / Majorana Fermions / Half-Heuslers / Weyl semimetals / Topological materials / Magnetism / Molecular crystals / Ab initio calculations
研究開始時の研究の概要

This research aims to deepen our fundamental understanding of unique properties of electrides, a distinct family of materials where some electrons reside at interstitial space, and meanwhile implement electrides as a testbed for novel theories and methods, through which we hope to advance our predictive capability of this kind of notable materials.

研究実績の概要

We mainly worked on the topological electronic properties of half-Heuslers with first-principles calculations, as well as in collaboration with experiments. Half-Heuslers go under the family of electrides owing to the vacancy site per unit cell.
1. We investigated the topological boundary states at the half-Heusler interfaces. In contrast to bare surface, we uncovered that the topological interfacial states are free from dangling bonds, and show higher flexibility of tuning. We found a quantum anomalous Hall state at the GdNiSb/LuPtBi interface, which was shown to support chiral Majorana modes due to the superconductivity of LuPtBi. This work paves the avenue for topological superconductivity at the half-Heusler interfaces.
2. We studied the colossal magnetoresistance (CMR) in half-Heuslers RAuSn (R, rare earth) in collaboration with experimentalists. For the experimentally observed CMR, we calculated the electronic band structure, revealing the Lifshitz transition (emergence of Weyl points) in RAuSn as the external magnetic field is applied. On top of that, we found that the CMR could be attributed to the spin-momentum locking generated by these field-induced Weyl points, as shown by the calculated Berry curvature and spin-resolved Fermi surfaces.

現在までの達成度 (区分)
現在までの達成度 (区分)

2: おおむね順調に進展している

理由

The research on the topological and magnetic properties of electrides has advanced as expected, with a primary focus on half-Heusler systems. We have identified the potential of topological half-Heuslers as platforms for chiral Majorana modes, which could be instrumental in the development of topological quantum computations. A manuscript on these findings is under preparation. In addition, we have studied the field-induced Weyl points in the half-Heusler compound HoAuSn and their role in the phenomenon of giant negative magnetoresistance. Our work on additional half-Heusler compounds in this series is ongoing, in collaboration with experimental research teams. We look forward to obtaining more significant results in the near future.

今後の研究の推進方策

We will investigate the superconductivity of electrides, specifically focusing on the role of interstitial electrons. Some electrides exhibit superconductivity, particularly under pressure, yet the contribution of interstitial electrons to this phenomenon remains unclear. We aim to explore this using first-principles calculations.
Additionally, we will study the colossal negative magnetoresistance in half-Heuslers RAuSn (R: rare earth), expanding our research beyond R=Ho to uncover the universal mechanisms at play. This investigation will be conducted in collaboration with experimentalists.

報告書

(2件)
  • 2023 実施状況報告書
  • 2022 実績報告書
  • 研究成果

    (10件)

すべて 2024 2023 2022

すべて 雑誌論文 (4件) (うち国際共著 3件、 査読あり 4件、 オープンアクセス 2件) 学会発表 (6件) (うち国際学会 6件)

  • [雑誌論文] Colossal negative magnetoresistance in field-induced Weyl semimetal of magnetic half-Heusler compound2023

    • 著者名/発表者名
      Ueda Kentaro、Yu Tonghua、Hirayama Motoaki、Kurokawa Ryo、Nakajima Taro、Saito Hiraku、Kriener Markus、Hoshino Manabu、Hashizume Daisuke、Arima Taka-hisa、Arita Ryotaro、Tokura Yoshinori
    • 雑誌名

      Nature Communications

      巻: 14 号: 1 ページ: 1-8

    • DOI

      10.1038/s41467-023-41982-4

    • URL

      https://pure.teikyo.jp/en/publications/f676b5f1-a613-4477-9a88-5892320cf403

    • 関連する報告書
      2023 実施状況報告書
    • 査読あり / オープンアクセス
  • [雑誌論文] Real-Space Observation of Ripple-Induced Symmetry Crossover in Ultrathin MnPS<sub>3</sub>2023

    • 著者名/発表者名
      Wang Ziqian、Gao Meng、Yu Tonghua、Zhou Siyuan、Xu Mingquan、Hirayama Motoaki、Arita Ryotaro、Shiomi Yuki、Zhou Wu、Ogawa Naoki
    • 雑誌名

      ACS Nano

      巻: 17 号: 3 ページ: 1916-1924

    • DOI

      10.1021/acsnano.2c04995

    • 関連する報告書
      2022 実績報告書
    • 査読あり / 国際共著
  • [雑誌論文] Interstitial‐Electron‐Induced Topological Molecular Crystals2022

    • 著者名/発表者名
      Yu Tonghua、Arita Ryotaro、Hirayama Motoaki
    • 雑誌名

      Advanced Physics Research

      巻: 2 号: 3 ページ: 2200041-2200041

    • DOI

      10.1002/apxr.202200041

    • 関連する報告書
      2022 実績報告書
    • 査読あり / オープンアクセス / 国際共著
  • [雑誌論文] Efficient hydrogen evolution reaction due to topological polarization2022

    • 著者名/発表者名
      Jiang Ming-Chun、Guo Guang-Yu、Hirayama Motoaki、Yu Tonghua、Nomoto Takuya、Arita Ryotaro
    • 雑誌名

      Physical Review B

      巻: 106 号: 16 ページ: 165120-165120

    • DOI

      10.1103/physrevb.106.165120

    • 関連する報告書
      2022 実績報告書
    • 査読あり / 国際共著
  • [学会発表] Topological interface states of magnetic half-Heusler materials2024

    • 著者名/発表者名
      T. Yu, R. Arita, M. Hirayama
    • 学会等名
      International Symposium on Quantum Electronics
    • 関連する報告書
      2023 実施状況報告書
    • 国際学会
  • [学会発表] Topological interface states of magnetic half-Heusler materials2024

    • 著者名/発表者名
      T. Yu, R. Arita, M. Hirayama
    • 学会等名
      CEMS Symposium on Emergent Quantum Materials 2024
    • 関連する報告書
      2023 実施状況報告書
    • 国際学会
  • [学会発表] Interstitial-electron-induced topological molecular crystals: Topological Zintl compounds K4Ba2[SnBi4] and the related family2023

    • 著者名/発表者名
      T. Yu, R. Arita, M. Hirayama
    • 学会等名
      Conference of Condensed Matter Physics 2023
    • 関連する報告書
      2023 実施状況報告書
    • 国際学会
  • [学会発表] Interstitial anionic electrons in correlated transition metal compounds2023

    • 著者名/発表者名
      TY, R. Arita, M. Hirayama
    • 学会等名
      APS March Meeting 2023
    • 関連する報告書
      2022 実績報告書
    • 国際学会
  • [学会発表] Relativistic topological molecular crystals2022

    • 著者名/発表者名
      TY, R. Arita, M. Hirayama
    • 学会等名
      29th International Conference on Low Temperature Physics
    • 関連する報告書
      2022 実績報告書
    • 国際学会
  • [学会発表] Interstitial-electron-induced topological molecular crystals2022

    • 著者名/発表者名
      TY, R. Arita, M. Hirayama
    • 学会等名
      Novel Quantum States in Condensed Matter 2022
    • 関連する報告書
      2022 実績報告書
    • 国際学会

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公開日: 2022-04-28   更新日: 2024-12-25  

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