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Temperature dependence of the electron-density and nuclear-density distributions in materials for solid oxide fuel cells

Research Project

Project/Area Number 15360340
Research Category

Grant-in-Aid for Scientific Research (B)

Allocation TypeSingle-year Grants
Section一般
Research Field Inorganic materials/Physical properties
Research InstitutionTOKYO INSTITUTE OF TECHNOLOGY

Principal Investigator

YASHIMA Masatomo  Tokyo Institute of Technology, Interdisciplinary Graduate School of Science and Engineering, Associate Professor, 大学院・総合理工学研究科, 助教授 (00239740)

Co-Investigator(Kenkyū-buntansha) IZUMI Fujio  Tokyo Institute of Technology, Materials and Structures Laboratory, Professor, 物質研究所, 主席研究員 (70354397)
SASAKI Satoshi  National Institute for Materials Science, Advanced Material Institute, Senior Researcher, 応用セラミックス研究所, 教授 (10162364)
KAMIYAMA Takeshi  High Energy Accelerator Research Organization, Institute for Materials Structure Science, Associate Professor, 物質構造科学研究所, 助教授 (60194982)
TANAKA Masahiko  High Energy Accelerator Research Organization, Institute for Materials Structure Science, Research Associate, 物質構造科学研究所, 助手 (60249901)
Project Period (FY) 2003 – 2004
Project Status Completed (Fiscal Year 2004)
Budget Amount *help
¥13,400,000 (Direct Cost: ¥13,400,000)
Fiscal Year 2004: ¥5,300,000 (Direct Cost: ¥5,300,000)
Fiscal Year 2003: ¥8,100,000 (Direct Cost: ¥8,100,000)
Keywordspositional disorder / diffusion path / oxide-ion conductors / Rietveld refinement / maximum-entropy method / perovskite / fluorite-type structure / synchrotron / 中性子回折 / イオン伝導経路 / 放射光粉末回折 / 電子密度分布
Research Abstract

We have investigated the positional disorder and diffusion path of oxide ions in Bi_2O_3,CeO_2, and (La_<0.8>Sr_<0.2>)(Ga_<0.8>Mg_<0.15>Co_<0.05>)O_<3-δ・>. These were studied through the nuclear density distribution obtained by a combined technique including a Rietveld refinement, a maximum-entropy method(MEM) and MEM-based pattern fitting of the neutron powder diffraction data measured at high temperatures. Oxide ions in fluorite-type structured δ-Bi_2O_3 and CeO_2 have a complicated disorder spreading over a wide area and shift to the <111> directions from the ideal fluorite site at higher temperatures. Diffusion path of oxide ions in (La_<0.8>Sr_<0.2>)(Ga_<0.8>Mg_<0.05>Co_<0.05>)O_<3-δ> perovskite is not along the straight line between the ideal positions, but exhibits an arc shape away from the B-site cation (Ga_<0.8>Mg_<0.5>Co_<0.05>).

Report

(3 results)
  • 2004 Annual Research Report   Final Research Report Summary
  • 2003 Annual Research Report
  • Research Products

    (28 results)

All 2004 2003 Other

All Journal Article (19 results) Book (2 results) Publications (7 results)

  • [Journal Article] Positional Disorder of Oxygen Ions in Ceria at High Temperatures2004

    • Author(s)
      M.Yashima, S.Kobayashi
    • Journal Title

      Applied Physics.Letters 84・4

      Pages: 526-528

    • Description
      「研究成果報告書概要(和文)」より
    • Related Report
      2004 Final Research Report Summary
  • [Journal Article] Performance of a new furnace for high-resolution synchrotron powder diffraction up to 1900 K : application to determine electron density distribution of the cubic CaTiO_3 perovskite at 1674 K2004

    • Author(s)
      M.Yashima, M.Tanaka
    • Journal Title

      Journal of the Applied Crystallography 37・5

      Pages: 786-790

    • Description
      「研究成果報告書概要(和文)」より
    • Related Report
      2004 Final Research Report Summary
  • [Journal Article] Positional Disorder of Oxygen Ions in Ceria at High Temperatures2004

    • Author(s)
      M.Yashima, S.Kobayashi
    • Journal Title

      Appl.Phys.Lett. 84[4]

      Pages: 526-528

    • Description
      「研究成果報告書概要(欧文)」より
    • Related Report
      2004 Final Research Report Summary
  • [Journal Article] Performance of a new furnace for high-resolution synchrotron powder diffraction up to 1900 K : application to determine electron density distribution of the cubic CaTiO_3 perovskite at 1674 K2004

    • Author(s)
      M.Yashima, M.Tanaka
    • Journal Title

      J.Appl.Cryst 37,[5]

      Pages: 786-790

    • Description
      「研究成果報告書概要(欧文)」より
    • Related Report
      2004 Final Research Report Summary
  • [Journal Article] A new furnace for high-temperature synchrotron X-ray powder diffraction experiments-Election density analysis by powder X-ray diffraction at 1300℃2004

    • Author(s)
      M.Tanaka, M.Yashima, T.Mori
    • Journal Title

      AIP conference Proceeding # 705 Synchrotron Radiation Instrumentation : Eighth International Conference on Synchrotron Radiation Instrumentation(edited by T.Warwick, J.Arthur, H.A.Padmore and J.Stohr)(Springer Pub.Co., Secaucus, NJ, USA)

      Pages: 1055-1058

    • Description
      「研究成果報告書概要(欧文)」より
    • Related Report
      2004 Final Research Report Summary
  • [Journal Article] Study of Crystal Structure and Phase Transition by Neutron Diffraction2004

    • Author(s)
      M.Yashima, Lecture Note
    • Journal Title

      Lecture Notes for Young Scientists in Neutron Science(Edited by S.Ito)(Published by Japanese Society for Neutron Science, Tokai, Japan)

      Pages: 113-130

    • Description
      「研究成果報告書概要(欧文)」より
    • Related Report
      2004 Final Research Report Summary
  • [Journal Article] Positional Disorder of Oxygen Ions in Ceria at High Temperatures2004

    • Author(s)
      M.Yashima, S.Kobayashi
    • Journal Title

      Applied Physics Letters 84・4

      Pages: 526-528

    • Related Report
      2004 Annual Research Report
  • [Journal Article] Performance of a new furnace for high-resolution synchrotron powder diffraction up to 1900 K : application to determine electron density distribution of the cubic CaTiO_3 perovskite at 1674 K2004

    • Author(s)
      M.Yashima, M.Tanaka
    • Journal Title

      Journal of Applied Crystallography 37・5

      Pages: 786-790

    • Related Report
      2004 Annual Research Report
  • [Journal Article] Crystal structure analysis of β-tricalcium phosphate Ca_3(PO_4)_2 by neutron powder diffraction2003

    • Author(s)
      M.Yashima, A.Sakai, T.Kamiyama, A.Hoshikawa
    • Journal Title

      Journal of Solid State Chemistry 175・2

      Pages: 272-277

    • Description
      「研究成果報告書概要(和文)」より
    • Related Report
      2004 Annual Research Report 2004 Final Research Report Summary
  • [Journal Article] Crystal structure and disorder of the fast oxide-ion conductor cubic Bi_2O_32003

    • Author(s)
      M.Yashima, D.Ishimura
    • Journal Title

      Chemical Physics Letters 378・3-4

      Pages: 395-399

    • Description
      「研究成果報告書概要(和文)」より
    • Related Report
      2004 Annual Research Report 2004 Final Research Report Summary
  • [Journal Article] Conduction path and disorder in the fast oxide-ion conductor (La_<0.8>Sr_<0.2>)(Ga_<0.8>Mg_<0.15>Co_<0.05>)O_<2.8>2003

    • Author(s)
      M.Yashima, K.Nomura, H.Kageyama, Y.Miyazaki, N.Chitose, K.Adachi
    • Journal Title

      Chemical Physics Letters 380・3-4

      Pages: 391-396

    • Description
      「研究成果報告書概要(和文)」より
    • Related Report
      2004 Final Research Report Summary
  • [Journal Article] High-temperature phase transition in lanthanum titanate perovskite La_<0.64>(Ti_<0.92,Nb_<0.08>)O_32003

    • Author(s)
      M.Yashima, M.Mori, T.Kamiyama, K.Oikawa, A.Hoshikawa, S.Torii, K.Saitoh, K.Tsuda
    • Journal Title

      Chemical Physics Letters 375・1-2

      Pages: 240-246

    • Description
      「研究成果報告書概要(和文)」より
    • Related Report
      2004 Final Research Report Summary
  • [Journal Article] High-temperature neutron powder diffraction study of the structural phase transition between α andα' phases in tricalcium phosphate Ca_3(PO_4)_22003

    • Author(s)
      Masatomo Yashima, Atsushi Sakai
    • Journal Title

      Chemical Physics Letters 372[5-6]

      Pages: 779-783

    • Description
      「研究成果報告書概要(欧文)」より
    • Related Report
      2004 Final Research Report Summary
  • [Journal Article] High-temperature neutron powder diffraction study of cerium dioxide CeO_2 up to 1770 K2003

    • Author(s)
      Masatomo Yashima, Daiju Ishimura, Yasuo Yamaguchi, Kenji Ohoyama, Katsuhiro Kawachi
    • Journal Title

      Chemical Physics Letters 372[5-6]

      Pages: 784-787

    • Description
      「研究成果報告書概要(欧文)」より
    • Related Report
      2004 Final Research Report Summary
  • [Journal Article] High-temperature phase transition in lanthanum titanate perovskite La_<0.64>(Ti_<0.92>,Nb_<0.08>)O_32003

    • Author(s)
      Masatomo Yashima, Mizuki Mori, Takashi Kamiyama, Ken-ichi Oikawa, Akinori Hoshikawa, Shuki Torii, Koh Saitoh, Kenji Tsuda
    • Journal Title

      Chemical Physics Letters 375,[1-2]

      Pages: 240-246

    • Description
      「研究成果報告書概要(欧文)」より
    • Related Report
      2004 Final Research Report Summary
  • [Journal Article] Crystal structure analysis of β-tricalcium phosphate Ca_3(PO_4)_2 by neutron powder diffraction2003

    • Author(s)
      M.Yashima, A.Sakai, T.Kamiyama, A.Hoshikawa
    • Journal Title

      J.Solid State Chem. 175,[2]

      Pages: 272-277

    • Description
      「研究成果報告書概要(欧文)」より
    • Related Report
      2004 Final Research Report Summary
  • [Journal Article] (Invited review with a referee, Highlight) How Does the Accuracy of a Continuous Phase Transition Temperature Depend on the Angular Resolution of Powder Diffractometer?2003

    • Author(s)
      M.Yashima, M.Mori, M.Tanaka
    • Journal Title

      Photon Factory Activity Report 2002, Part A Highlights and Facility Reports, No.20(edited by K.Ito et al.)(High Energy Accelerator Research Organization (KEK), Tsukuba, Japan)

      Pages: 23-24

    • Description
      「研究成果報告書概要(欧文)」より
    • Related Report
      2004 Final Research Report Summary
  • [Journal Article] Conduction path and disorder in the fast oxide-ion conductor(La_<0.8>Sr_<0.2>)(Ga_<0.8>Mg_<0.15>Co_<0.05>)O_<2.8>2003

    • Author(s)
      M.Yashima, K.Nomura, H.Kageyama, Y.Miyazaki, N.Chitose, K.Adachi
    • Journal Title

      Chemical Physics Letters 380・3-4

      Pages: 391-396

    • Related Report
      2004 Annual Research Report
  • [Journal Article] High-temperature phase transition in lanthanum titanate perovskite La_<0.64>(Ti_<0.92>,Nb_<0.08>)O_32003

    • Author(s)
      M.Yashima, M.Mori, T.Kamiyama, K.Oikawa, A.Hoshikawa, S.Torii, K.Saitoh, K.Tsuda
    • Journal Title

      Chemical Physics Letters 375・1-2

      Pages: 240-246

    • Related Report
      2004 Annual Research Report
  • [Book] Photon Factory Activity Report 2002, Part A Highlights and Facility Reports, No.20(edited by K.Ito et al.)(KEK, Tsukuba, Japan)2003

    • Author(s)
      M.Yashima, M.Mori, M.Tanaka
    • Total Pages
      2
    • Publisher
      (Invited review, Highlight) How Does the Accuracy of a Continuous Phase Transition
    • Description
      「研究成果報告書概要(和文)」より
    • Related Report
      2004 Final Research Report Summary
  • [Book] Photon Factory Activity Report 2002, Part A Highlights and Facility Reports, No.20, edited by K. Ito et al., KEK, Tsukuba, Japan2003

    • Author(s)
      M.Yashima, M.Mori, M.Tanaka
    • Total Pages
      2
    • Publisher
      (Invited review, Highlight) How Does the Accuracy of a Continuous Phase Transition Temperature Depend on the Angular Resolution of Powder Diffractometer?
    • Related Report
      2004 Annual Research Report
  • [Publications] M.Yashima, A.Sakai, T.Kamiyama, A.Hoshikawa: "Crystal structure analysis of β-tricalcium phosphate Ca_3(PO_4)_2 by neutron powder diffraction"Journal of Solid State Chemistry. 175・2. 272-277 (2003)

    • Related Report
      2003 Annual Research Report
  • [Publications] M.Yashima, D.Ishimura: "Crystal structure and disorder of the fast oxide-ion conductor cubic Bi_2O_3"Chemical Physics Letters. 378・3-4. 395-399 (2003)

    • Related Report
      2003 Annual Research Report
  • [Publications] M.Yashima, K.Nomura, H.Kageyama Y.Miyazaki, N.Chitose, K.Adachi: "Conduction path and disorder in the fast oxide-ion conductor (La_<0.8>Sr_<0.2>)(Ga_<0.8>Mg_<0.15>Co_<0.05>)O_<2.8>"Chemical Physics Letters. 380・3-4. 391-396 (2003)

    • Related Report
      2003 Annual Research Report
  • [Publications] M.Yashima, M.Mori, T.Kamiyama, K.Okikawa, A.Hoshikawa, S.Torii, K.Saitoh, K.Tsuda: "High-temperature phase transition in lanthanum titanate perovskite La_<0.64>(Ti_<0.92>,Nb_<0.08>)O_3"Chemical Physics Letters. 385・1-2. 240-246 (2003)

    • Related Report
      2003 Annual Research Report
  • [Publications] R.Ali, M.Yashima: "Lattice parameters and structural phase transition of lanthanum titanate perovskite La_<0.68>(Ti_<0.95>,Al_<0.05>)O_3"Journal of Synchrotron Radiation. 10・3. 228-232 (2003)

    • Related Report
      2003 Annual Research Report
  • [Publications] M.Yashima, S.Kobayashi: "Positional Disorder of Oxygen Ions in Ceria at High Temperatures"Applied Physics Letters. 84・4. 526-528 (2004)

    • Related Report
      2003 Annual Research Report
  • [Publications] A.Yashima, M.Mori, M.Tanaka: "How Does the Accuracy of a Continuous Phase Transition Temperature Depend on the Angular Resolution of Powder Diffractometer?(Invited review, Highlight)"Photon Factory Activity Report 2002, Part A Highlights and Facility Reports, edited by K.Ito et al., KEK, Tsukuba, Japan. No.20. (2003)

    • Related Report
      2003 Annual Research Report

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Published: 2003-04-01   Modified: 2021-09-24  

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