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Development of Mechanical Nano-ferroelectrics induced by nanoscale strain field of lattice defects

Research Project

Project/Area Number 18K18806
Research Category

Grant-in-Aid for Challenging Research (Exploratory)

Allocation TypeMulti-year Fund
Review Section Medium-sized Section 18:Mechanics of materials, production engineering, design engineering, and related fields
Research InstitutionKyoto University

Principal Investigator

Kitamura Takayuki  京都大学, 工学研究科, 教授 (20169882)

Co-Investigator(Kenkyū-buntansha) 澄川 貴志  京都大学, 工学研究科, 准教授 (80403989)
嶋田 隆広  京都大学, 工学研究科, 准教授 (20534259)
Project Period (FY) 2018-06-29 – 2020-03-31
Project Status Completed (Fiscal Year 2019)
Budget Amount *help
¥6,370,000 (Direct Cost: ¥4,900,000、Indirect Cost: ¥1,470,000)
Fiscal Year 2019: ¥1,950,000 (Direct Cost: ¥1,500,000、Indirect Cost: ¥450,000)
Fiscal Year 2018: ¥4,420,000 (Direct Cost: ¥3,400,000、Indirect Cost: ¥1,020,000)
Keywords格子欠陥 / ナノひずみ場 / 強誘電性 / マルチフィジックス特性 / 第一原理解析
Outline of Final Research Achievements

To overcome the critical nano-dimensions where ferroelectricity disappears and to mechanically design ultra-small ferroelectrics with atomic and lattice scales, we have performed in-situ mechanical tests and first-principles analysis based on quantum mechanics for dislocation cores in SrTiO3. We find that a spontaneous intrinsic strain field is formed at the dislocation core, and this strain field induced the ferroelectricity with a few crystal lattice sizes. Therefore, the dislocation core itself can be regarded as a atomic (or lattice)-scale ferroelectric material. In addition, mechanical testing and analyses for nano-ferroelectrics have been carried out and then we clarify the coupling effect between strain and ferroelectricity (multiphysics properties).

Academic Significance and Societal Importance of the Research Achievements

本研究は、臨界寸法以下の強誘電性は存在し難いという前例を覆し、格子欠陥が有する固有のひずみ場によって力学的に原子スケールの強誘電体をつくり出す点や、機能と力学的変形の相互作用であるマルチフィジックス原理を解明し、力学-強誘電性間の異種物理特性が作用する新しい力学を提案する点に学術的意義がある。特に、マルチフィジックス特性は、ひずみシリコンなどの応用例のように電子デバイスへの利用が始まっていることから、本研究成果によってより高度なナノデバイス設計や全く新しい技術・製品開発に繋がると考えられる。

Report

(3 results)
  • 2019 Annual Research Report   Final Research Report ( PDF )
  • 2018 Research-status Report
  • Research Products

    (29 results)

All 2020 2019 2018 2017 Other

All Int'l Joint Research (4 results) Journal Article (18 results) (of which Int'l Joint Research: 17 results,  Peer Reviewed: 18 results,  Open Access: 2 results) Presentation (7 results) (of which Int'l Joint Research: 7 results,  Invited: 2 results)

  • [Int'l Joint Research] Zhejiang University/Shanghai University(中国)

    • Related Report
      2019 Annual Research Report
  • [Int'l Joint Research] HIST(ベトナム)

    • Related Report
      2019 Annual Research Report
  • [Int'l Joint Research] Shanghai University/Zhejiang University/China Academy of Engineering(中国)

    • Related Report
      2018 Research-status Report
  • [Int'l Joint Research] Hanoi University of Sci. & Tech.(ベトナム)

    • Related Report
      2018 Research-status Report
  • [Journal Article] Ab initio study of ferroelectric critical size of SnTe low-dimensional nanostructures2020

    • Author(s)
      Takahiro Shimada*, Koichiro Minaguro, Tao Xu, Jie Wang, and Takayuki Kitamura
    • Journal Title

      Nanomaterials

      Volume: 10 Issue: 4 Pages: 732-732

    • DOI

      10.3390/nano10040732

    • Related Report
      2019 Annual Research Report
    • Peer Reviewed / Open Access / Int'l Joint Research
  • [Journal Article] In situ TEM observation of nanodomain mechanics in barium titanate uunder external loads2020

    • Author(s)
      Takashi Sumigawa, Ken Ho Kusunosikasa, Akihire, Hiroaki Unno, Kairi Masuda, Takahiro Shimada, and Takayuki Kitamura
    • Journal Title

      Physical Review Materials

      Volume: -

    • Related Report
      2019 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Effect of the oxygen vacancy on the ferroelectricity of 90° domain wall structure in PbTiO3: A density functional theory study2019

    • Author(s)
      Xiaoyuan Wang*, Tao Xu, Fuzhen Xuan*, Chang Qing Chen, Takahiro Shimada, and Takayuki Kitamura
    • Journal Title

      Journal of Applied Physics

      Volume: 126 Issue: 17 Pages: 174107-174107

    • DOI

      10.1063/1.5125306

    • Related Report
      2019 Annual Research Report
    • Peer Reviewed / Int'l Joint Research
  • [Journal Article] Intrinsic and extrinsic effects on the electrotoroidic switching in a ferroelectric notched nanodot by a homogeneous electric field2019

    • Author(s)
      Van-Hai Dinh, Le Van Lich, Tinh Quoc Bui, Le Van Tuan, Trong-Giang Nguyen, Takahiro Shimada, and Takayuki Kitamura
    • Journal Title

      Physical Chemistry Chemical Physics

      Volume: 21 Issue: 45 Pages: 25011-25022

    • DOI

      10.1039/c9cp04676c

    • Related Report
      2019 Annual Research Report
    • Peer Reviewed / Int'l Joint Research
  • [Journal Article] Periodically-arrayed ferroelectric nanostructures induced by dislocation structures in strontium titanate2019

    • Author(s)
      Kairi Masuda*, Le Van Lich, Takahiro Shimada, and Takayuki Kitamura
    • Journal Title

      Physical Chemistry Chemical Physics

      Volume: 21 Issue: 41 Pages: 22756-22762

    • DOI

      10.1039/c9cp04147h

    • Related Report
      2019 Annual Research Report
    • Peer Reviewed / Int'l Joint Research
  • [Journal Article] Topological ferroelectric nanostructures induced by mechanical strain in strontium titanate2019

    • Author(s)
      Kairi Masuda*, Le Van Lich, Takahiro Shimada, and Takayuki Kitamura
    • Journal Title

      Physical Chemistry Chemical Physics

      Volume: 21 Issue: 40 Pages: 22420-22428

    • DOI

      10.1039/c9cp03802g

    • Related Report
      2019 Annual Research Report
    • Peer Reviewed / Int'l Joint Research
  • [Journal Article] Asymmetric flux-closure domains in compositionally graded nanoscale ferroelectrics and unusual switching of toroidal ordering by an irrotational electric field2019

    • Author(s)
      Le Van Lich*, Minh-Tien Le, Tinh Quoc Bui, Thanh-Tung Nguyen, Takahiro Shimada, Takayuki Kitamura, Trong-Giang Nguyen, and Van-Hai Dinh
    • Journal Title

      Acta Materialia

      Volume: 179 Pages: 215-223

    • DOI

      10.1016/j.actamat.2019.08.025

    • Related Report
      2019 Annual Research Report
    • Peer Reviewed / Int'l Joint Research
  • [Journal Article] Periodically-arrayed ferroelectric nanostructures induced by strain concentration in SrTiO<sub>3</sub>2019

    • Author(s)
      益田 快理*, Le Van Lich, 嶋田 隆広, 北村 隆行
    • Journal Title

      Transactions of the JSME (in Japanese)

      Volume: 85 Issue: 876 Pages: 19-00175-19-00175

    • DOI

      10.1299/transjsme.19-00175

    • NAID

      130007695500

    • ISSN
      2187-9761
    • Related Report
      2019 Annual Research Report
    • Peer Reviewed / Int'l Joint Research
  • [Journal Article] Deterministic switching of polarization vortices in compositionally graded ferroelectrics using a mechanical field2019

    • Author(s)
      Le Van Lich, Tinh Quoc Bui, Takahiro Shimada, Takayuki Kitamura, Trong-Giang Nguyen, and Van-Hai Dinh
    • Journal Title

      Physical Review Applied

      Volume: 印刷中

    • Related Report
      2018 Research-status Report
    • Peer Reviewed / Int'l Joint Research
  • [Journal Article] Continuum thermodynamics of unusual domain evolution-induced toughening effect in nanocracked strontium titanate2018

    • Author(s)
      Le Van Lich, Takahiro Shimada, Jie Wang, Kairi Masuda, Tinh Quoc Bui, Van-Hai Dinh, Takayuki Kitamura
    • Journal Title

      Engineering Fracture Mechanics

      Volume: 190 Pages: 232-244

    • DOI

      10.1016/j.engfracmech.2017.12.030

    • Related Report
      2018 Research-status Report
    • Peer Reviewed / Open Access / Int'l Joint Research
  • [Journal Article] Effect of geometric configuration on the electrocaloric properties of nanoscale ferroelectric materials2018

    • Author(s)
      Xu Hou, Huiyu Li, Takahiro Shimada, Takayuki Kitamura, Jie Wang
    • Journal Title

      Journal of Applied Physics

      Volume: 123 Issue: 12 Pages: 124103-124103

    • DOI

      10.1063/1.5020584

    • Related Report
      2018 Research-status Report
    • Peer Reviewed / Int'l Joint Research
  • [Journal Article] Ferroelectric critical size and vortex domain structures of PbTiO_3 nanodots : A density functional theory study2018

    • Author(s)
      Xiaoyuan Wang, Yabin Yan, Takahiro Shimada, Jie Wang, Takayuki Kitamura
    • Journal Title

      Journal of Applied Physics

      Volume: 123 Issue: 11 Pages: 114101-114101

    • DOI

      10.1063/1.5013049

    • Related Report
      2018 Research-status Report
    • Peer Reviewed / Int'l Joint Research
  • [Journal Article] Unstable cracking behavior in nanoscale single crystal silicon: Initiation, unstable propagation and arrest2018

    • Author(s)
      Li-cheng Guo, Kai Huang, Takashi Sumigawa, Yabin Yan, Takayuki Kitamura
    • Journal Title

      Engineering Fracture Mechanics

      Volume: 196 Pages: 113-122

    • DOI

      10.1016/j.engfracmech.2018.04.014

    • Related Report
      2018 Research-status Report
    • Peer Reviewed / Int'l Joint Research
  • [Journal Article] Deformation and fracture of micron-sized metal-coated polymer spheres : an in-situ study2018

    • Author(s)
      Molly Bazilchuk, Takashi Sumigawa, Takayuki Kitamura, Zhiliang Zhang, Helge Kristiansen and Jianying He
    • Journal Title

      Advanced Engineering Materials

      Volume: - Issue: 7

    • DOI

      10.1002/adem.201800049

    • Description
      印刷中
    • Related Report
      2018 Research-status Report
    • Peer Reviewed / Int'l Joint Research
  • [Journal Article] In situ observation on formation process of nanoscale cracking during tension-compression fatigue of single crystal copper micron-scale specimen2018

    • Author(s)
      Takashi Sumigawa, Kim Byungwoon, Yuki Mizuno, Takuma Morimura, and Takayuki Kitamura
    • Journal Title

      Acta Materialia

      Volume: 153 Pages: 270-278

    • DOI

      10.1016/j.actamat.2018.04.061

    • Related Report
      2018 Research-status Report
    • Peer Reviewed / Int'l Joint Research
  • [Journal Article] Static assessment of nanoscale notched silicon beams using the averaged strain energy density method2018

    • Author(s)
      Pasquale Gallo, Takashi Sumigawa, Takayuki Kitamura, Filippo Berto
    • Journal Title

      Theoretical and Applied Fracture Mechanics

      Volume: 95 Pages: 261-269

    • DOI

      10.1016/j.tafmec.2018.03.007

    • Related Report
      2018 Research-status Report
    • Peer Reviewed / Int'l Joint Research
  • [Journal Article] Challenge toward nanometer scale fracture mechanics2018

    • Author(s)
      Takayuki Kitamura, Takashi Sumigawa, Takahiro Shimada
    • Journal Title

      Engineering Fracture Mechanics

      Volume: 187 Pages: 33-44

    • DOI

      10.1016/j.engfracmech.2017.10.009

    • Related Report
      2018 Research-status Report
    • Peer Reviewed / Int'l Joint Research
  • [Journal Article] Fracture criterion of mixed-mode crack propagation along the interface in nanoscale components2017

    • Author(s)
      Yabin Yan, Kai Huang, Takashi Sumigawa, Takayuki Kitamura
    • Journal Title

      Engineering Fracture Mechanics

      Volume: 193 Pages: 137-150

    • DOI

      10.1016/j.engfracmech.2018.02.014

    • Related Report
      2018 Research-status Report
    • Peer Reviewed / Int'l Joint Research
  • [Presentation] Nontrivial Topological Polarization Field Self-Ordered in Nanoporous Ferroelectrics - A Phase-Field Modeling2019

    • Author(s)
      Takahiro Shimada, Le Van Lich, Takayuki Kitamura, Hiroyuki Hirakata
    • Organizer
      2019 MRS Fall Meeting & Exhibit
    • Related Report
      2019 Annual Research Report
    • Int'l Joint Research
  • [Presentation] Fracture criteria for nanoscale stress singularity in brittle materials2019

    • Author(s)
      Takahiro Shimada, Takashi Sumigawa, Takayuki Kitamura, Hiroyuki Hirakata
    • Organizer
      Materials Structures & Micromechanics of Fracture (MSMF9)
    • Related Report
      2019 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] QM/MM modeling of brittle fracture from a dislocation core in SrTiO32018

    • Author(s)
      Takahiro Shimada
    • Organizer
      15th Asia-Pacific Conference on Fracture and Strength
    • Related Report
      2018 Research-status Report
    • Int'l Joint Research
  • [Presentation] Multiferroic polarons in doped perovskite oxides2018

    • Author(s)
      Takahiro Shimada
    • Organizer
      2018 MRS Fall Meeting & Exhibit
    • Related Report
      2018 Research-status Report
    • Int'l Joint Research
  • [Presentation] Formation of Slip Bands in Nano-polycrystalline Copper sandwiched between Brittle Materials2018

    • Author(s)
      Takashi Sumigawa
    • Organizer
      European conference on fracture
    • Related Report
      2018 Research-status Report
    • Int'l Joint Research
  • [Presentation] Fatigue of single-crystal gold micro-specimen by resonant vibration2018

    • Author(s)
      Takashi Sumigawa
    • Organizer
      1st International Conference on Theoretical, Applied, Experimental Mechanics
    • Related Report
      2018 Research-status Report
    • Int'l Joint Research
  • [Presentation] Challenge toward Fracture Mechanics in Atomic Scale2018

    • Author(s)
      Takayuki Kitamura
    • Organizer
      European conference on fracture
    • Related Report
      2018 Research-status Report
    • Int'l Joint Research / Invited

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Published: 2018-07-25   Modified: 2021-02-19  

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