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spin and orbital degrees of freedom of t2g^2 electrons in tetragonal crystal fields

Research Project

Project/Area Number 17K05521
Research Category

Grant-in-Aid for Scientific Research (C)

Allocation TypeMulti-year Fund
Section一般
Research Field Condensed matter physics II
Research InstitutionNational Institute for Materials Science

Principal Investigator

SAKURAI Hiroya  国立研究開発法人物質・材料研究機構, エネルギー・環境材料研究拠点, グループリーダー (60421400)

Project Period (FY) 2017-04-01 – 2021-03-31
Project Status Completed (Fiscal Year 2020)
Budget Amount *help
¥4,550,000 (Direct Cost: ¥3,500,000、Indirect Cost: ¥1,050,000)
Fiscal Year 2019: ¥1,560,000 (Direct Cost: ¥1,200,000、Indirect Cost: ¥360,000)
Fiscal Year 2018: ¥1,560,000 (Direct Cost: ¥1,200,000、Indirect Cost: ¥360,000)
Fiscal Year 2017: ¥1,430,000 (Direct Cost: ¥1,100,000、Indirect Cost: ¥330,000)
Keywordst2g軌道 / 正方対称場 / Cr酸化物 / クロム酸化物 / t2g電子系 / 正方格子 / 磁性 / 高圧物性 / 高圧合成 / t2g電子 / Mott絶縁体 / 新物質 / 蜂の巣格子 / 強相関電子系
Outline of Final Research Achievements

Sr3Cr2O7 and Sr4Cr3O10 show structural transitions. Our detailed analysis of their crystal structures revealed that, for both compounds, the dxy orbital of Cr ions is most likely lower in energy than the doubly degenerated dyz and dzx orbitals. Two 3d electrons of Cr ion occupy both the dxy orbital and the degenerated orbitals, which creates the orbital degree of freedom. So, the two compounds are expected to have orbital ordered states. The orbital ordering is also theoretically expected for alpha-Sr2CrO4 although temperature dependence of its magnetic susceptibility is largely different from that of Sr3Cr2O7 and Sr4Cr3O10. Furthermore, the similar orbital ordering is expected also for alpha-Sr2VO4 with 3d1 electronic configuration, as the degenerated orbitals are lower in energy than the dxy orbital for the V oxide. Therefore, the t2g orbitals in tetragonal crystal fields may tend to have the orbital degree of freedom.

Academic Significance and Societal Importance of the Research Achievements

eg軌道のスピンと軌道の状態はMn酸化物を中心に非常に詳しく調べられている。一方でt2g軌道が主役となる場合については立方対称場を基本とする場合は詳しく調べられているが、正方対称場中の場合は不十分であった。本研究により正方対称場でも立方対称場の場合と同様に軌道秩序状態を好むことが分かりd電子系の物理の理解が進んだ。

Report

(5 results)
  • 2020 Annual Research Report   Final Research Report ( PDF )
  • 2019 Research-status Report
  • 2018 Research-status Report
  • 2017 Research-status Report
  • Research Products

    (25 results)

All 2020 2019 2018 2017 Other

All Int'l Joint Research (4 results) Journal Article (12 results) (of which Int'l Joint Research: 3 results,  Peer Reviewed: 11 results) Presentation (9 results) (of which Int'l Joint Research: 2 results,  Invited: 1 results)

  • [Int'l Joint Research] Max Planck Institute/Universitat Freiburg(ドイツ)

    • Related Report
      2018 Research-status Report
  • [Int'l Joint Research] TRIUMF/University of British Columbia/University of Alberta(カナダ)

    • Related Report
      2018 Research-status Report
  • [Int'l Joint Research] Paul Scherrer Institut(スイス)

    • Related Report
      2018 Research-status Report
  • [Int'l Joint Research] KTH Royal Institute of Technology(スウェーデン)

    • Related Report
      2018 Research-status Report
  • [Journal Article] Magnetic Properties of Sr<sub>3</sub>V<sub>2</sub>O<sub>7</sub>2020

    • Author(s)
      SAKURAI Hiroya
    • Journal Title

      Journal of the Japan Society of Powder and Powder Metallurgy

      Volume: 67 Issue: 2 Pages: 107-109

    • DOI

      10.2497/jjspm.67.107

    • NAID

      130007798333

    • ISSN
      0532-8799, 1880-9014
    • Year and Date
      2020-02-15
    • Related Report
      2019 Research-status Report
    • Peer Reviewed
  • [Journal Article] Magnetocaloric Study of <i>Ln</i><sub>2</sub>Co<sub>12</sub>P<sub>7</sub> (<i>Ln</i> = Y, Nd, and Sm)2020

    • Author(s)
      OHTA Hiroto、KATO Yusuke、WATANABE Yusuke、Aruga KATORI Hiroko、TSUJII Naohito、KIKUGAWA Naoki、SAKURAI Hiroya
    • Journal Title

      Journal of the Japan Society of Powder and Powder Metallurgy

      Volume: 67 Issue: 2 Pages: 97-99

    • DOI

      10.2497/jjspm.67.97

    • NAID

      130007798307

    • ISSN
      0532-8799, 1880-9014
    • Year and Date
      2020-02-15
    • Related Report
      2019 Research-status Report
  • [Journal Article] Metamagnetic Transition and Magnetocaloric Effect of PrMnGe2020

    • Author(s)
      TSUJII Naohito、SAKURAI Hiroya
    • Journal Title

      Journal of the Japan Society of Powder and Powder Metallurgy

      Volume: 67 Issue: 2 Pages: 103-106

    • DOI

      10.2497/jjspm.67.103

    • NAID

      130007798334

    • ISSN
      0532-8799, 1880-9014
    • Year and Date
      2020-02-15
    • Related Report
      2019 Research-status Report
    • Peer Reviewed
  • [Journal Article] Contrasting Pressure-Induced Metallization Processes in Layered Perovskites, α-Sr2MO4 (M=V, Cr)2019

    • Author(s)
      Yamauchi Touru、Shimazu Taku、Nishio-Hamane Daisuke、Sakurai Hiroya
    • Journal Title

      Physical Review Letters

      Volume: 123 Issue: 15 Pages: 156601-156601

    • DOI

      10.1103/physrevlett.123.156601

    • Related Report
      2019 Research-status Report
    • Peer Reviewed
  • [Journal Article] Ordinary and extraordinary structural phase transitions in the perovskite-related layered compound Sr3W2O92019

    • Author(s)
      Urushihara Daisuke、Asaka Toru、Fukuda Koichiro、Sakurai Hiroya
    • Journal Title

      Physical Review B

      Volume: 99 Issue: 9 Pages: 094104-094104

    • DOI

      10.1103/physrevb.99.094104

    • Related Report
      2018 Research-status Report
    • Peer Reviewed
  • [Journal Article] Charge disproportionation of mixed-valent Cr triggered by Bi lone-pair effect in the A-site-ordered perovskite BiCu3Cr4O122018

    • Author(s)
      Etter Martin、Isobe Masahiko、Sakurai Hiroya、Yaresko Alexander、Dinnebier Robert E.、Takagi Hidenori
    • Journal Title

      Physical Review B

      Volume: 97 Issue: 19 Pages: 195111-195111

    • DOI

      10.1103/physrevb.97.195111

    • Related Report
      2018 Research-status Report
    • Peer Reviewed / Int'l Joint Research
  • [Journal Article] Giant magnetocapacitance in cerium sesquioxide2018

    • Author(s)
      Kolodiazhnyi T.、Sakurai H.、Avdeev M.、Charoonsuk T.、Lamonova K. V.、Pashkevich Yu. G.、Kennedy B. J.
    • Journal Title

      Physical Review B

      Volume: 98 Issue: 5 Pages: 054423-054423

    • DOI

      10.1103/physrevb.98.054423

    • Related Report
      2018 Research-status Report
    • Peer Reviewed
  • [Journal Article] Magnetic structure for NaCr2O4 analyzed by neutron diffraction and muon spin-rotation2018

    • Author(s)
      Nozaki Hiroshi、Sakurai Hiroya、Ofer Oren、Ansaldo Eduardo J.、Brewer Jess H.、Chow Kim H.、Pomjakushin Vladimir、Keller Lukas、Prsa Krunoslav、Miwa Kazutoshi、Mansson Martin、Sugiyama Jun
    • Journal Title

      Physica B: Condensed Matter

      Volume: 551 Pages: 137-141

    • DOI

      10.1016/j.physb.2017.11.011

    • Related Report
      2018 Research-status Report
    • Peer Reviewed
  • [Journal Article] High-pressure synthesis and crystal structure of the strontium tungstate Sr3W2O92018

    • Author(s)
      D. Urushihara, T. Asaka, K. Fukuda, H.Sakurai
    • Journal Title

      Acta Crystallograhica C

      Volume: 74 Issue: 2 Pages: 120-124

    • DOI

      10.1107/s2053229617017879

    • Related Report
      2017 Research-status Report
    • Peer Reviewed
  • [Journal Article] Discovery of the High-Pressure Phase of Ba3W2O9 and Determination of Its Crystal Structure2017

    • Author(s)
      D. Urushihara, T. Asaka, K. Fukuda, H.Sakurai
    • Journal Title

      Inorganic Chemistry

      Volume: 56 Issue: 21 Pages: 13007-13013

    • DOI

      10.1021/acs.inorgchem.7b01755

    • Related Report
      2017 Research-status Report
    • Peer Reviewed
  • [Journal Article] Electronic phase transition between localized and itinerant states in the solid-solution system CaCu3Ti(4-x)RuxO122017

    • Author(s)
      Ting-Hui Kao Hiroya Sakurai, Shan Yu, Harukazu Kato, Naohito Tsujii, and Hung-Duen Yang
    • Journal Title

      Physical Review B

      Volume: 95 Issue: 19

    • DOI

      10.1103/physrevb.95.195141

    • Related Report
      2017 Research-status Report
    • Peer Reviewed / Int'l Joint Research
  • [Journal Article] Origin of the magnetic susceptibility maximum in CaCu3Ru4O12 and electronic states in the A-site substituted compounds2017

    • Author(s)
      Ting-Hui Kao, Hiroya Sakurai,Shan Yu, Harukazu Kato, Naohito Tsujii, and Hung-Duen Yang
    • Journal Title

      Physical Review B

      Volume: 96 Issue: 2

    • DOI

      10.1103/physrevb.96.024402

    • Related Report
      2017 Research-status Report
    • Peer Reviewed / Int'l Joint Research
  • [Presentation] 希土類マンガン酸化物の磁気エントロピー変化2020

    • Author(s)
      桜井裕也、菊川直樹、辻井直人
    • Organizer
      第36回希土類討論会
    • Related Report
      2020 Annual Research Report
  • [Presentation] (La,Sr)n+1MnO3n+1 (n = 1, 2, 3; M = V)の合成と電子物性 ~M = Crの場合との比較~2019

    • Author(s)
      桜井裕也
    • Organizer
      一般社団法人粉体粉末冶金協会2019年度春季大会
    • Related Report
      2019 Research-status Report
  • [Presentation] Srn+1CrnO3n+1 (n = 1, 2, 3)の構造相転移と電子状態2019

    • Author(s)
      桜井裕也
    • Organizer
      一般社団法人粉体粉末冶金協会2019年度秋季大会
    • Related Report
      2019 Research-status Report
  • [Presentation] Electronic properties of Ruddlesden-Popper phase V and Cr oxides2019

    • Author(s)
      Sakurai Hiroya
    • Organizer
      International Conference on Strongly Correlated Electron Systems 2019
    • Related Report
      2019 Research-status Report
    • Int'l Joint Research
  • [Presentation] A3M2O9 (A = Sr, Ba; M = W, Re)の結晶構造と電子物性2018

    • Author(s)
      桜井裕也、漆原大典、浅香透、福田功一郎
    • Organizer
      粉体粉末冶金協会春季大会
    • Related Report
      2018 Research-status Report
  • [Presentation] (La,Sr)n+1CrnO3n+1 (n = 1, 2, 3) の合成と電子物性2018

    • Author(s)
      桜井裕也
    • Organizer
      粉体粉末冶金協会秋季大会
    • Related Report
      2018 Research-status Report
  • [Presentation] CaCu3Ti4-xRuxO12 (A = La, Na, Sr)のモット転移2017

    • Author(s)
      桜井裕也、Ting-Hui Kao、余珊、加藤治一、辻井直人、Hung-Duen Yang
    • Organizer
      一般社団法人粉体粉末冶金協会平成29 年度春季大会
    • Related Report
      2017 Research-status Report
  • [Presentation] Ca1-xAxCu3Ru4O12 (A = La, Na, Sr)の磁性と電子状態2017

    • Author(s)
      桜井裕也、Ting-Hui Kao、余珊、加藤治一、辻井直人、Hung-Duen Yang
    • Organizer
      一般社団法人粉体粉末冶金協会平成29 年度春季大会
    • Related Report
      2017 Research-status Report
  • [Presentation] Ferromagnetic interactions in rutile-related Cr(IV) oxides2017

    • Author(s)
      Hiroya Sakurai
    • Organizer
      JSPM International Conference on Powder and Powder Metallurgy
    • Related Report
      2017 Research-status Report
    • Int'l Joint Research / Invited

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Published: 2017-04-28   Modified: 2022-01-27  

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