• Search Research Projects
  • Search Researchers
  • How to Use
  1. Back to project page

2010 Fiscal Year Final Research Report

Accurate Structure Analysis using multiple synchrotron radiation diffraction data.

Research Project

  • PDF
Project/Area Number 20360006
Research Category

Grant-in-Aid for Scientific Research (B)

Allocation TypeSingle-year Grants
Section一般
Research Field Applied materials science/Crystal engineering
Research InstitutionNagoya University

Principal Investigator

NISHIBORI Eiji  Nagoya University, 工学研究科, 准教授 (10293672)

Co-Investigator(Kenkyū-buntansha) AOYAGI Shinobu  名古屋大学, 大学院・工学研究科, 助教 (40360838)
Project Period (FY) 2008 – 2010
Keywords放射光 / X線回折 / 計算科学
Research Abstract

In this study, we developed the method of diffraction data analysis using multiple dataset for determination of detailed structure such as disordered status. The structure of Li endohedral C_<60> fullerene, an anharmonic thermal vibration and hybridized orbital of the diamond, and the bonding nature of CoSb_3 thermoelectics have been experimentally determined by a combination of single crystal and powder crystal diffraction and multi powder data analysis.

  • Research Products

    (7 results)

All 2010 2009 2008 Other

All Journal Article (2 results) (of which Peer Reviewed: 2 results) Presentation (3 results) Book (1 results) Remarks (1 results)

  • [Journal Article] A layered ionic crystal of polar Li@C_<60> superatoms.2010

    • Author(s)
      Aoyagi S, Nishibori E, Sawa H, Sugimoto K, Takata M, Miyata Y, Kitaura R, Shinohara H, Okada H, Sakai T, Ono Y, Kawachi K, Yokoo K, Ono S, Omote K, Kasama Y, Ishikawa S, Komuro T, Tobita H.
    • Journal Title

      Nature Chemistry 2

      Pages: 678-683

    • Peer Reviewed
  • [Journal Article] Multipole electron-density modelling of synchrotron powder diffraction data : the case of diamond.2010

    • Author(s)
      H.Svendsen, J.Overgaard, R.Busselez, B.Arnaud, P.Rabiller, A.Kurita, E.Nishibori, M.Sakata, M.Takata, B.B.Iversena.
    • Journal Title

      Acta Cryst. A66

      Pages: 458-469

    • Peer Reviewed
  • [Presentation] Ultra-high Resolution Charge Density Study from Powder Diffraction Data.2010

    • Author(s)
      西堀英治
    • Organizer
      Gordon Research Conference 2010 on Electron Distributions and Chemical Bonding
    • Place of Presentation
      Mount Holyoke College, Massachusetts, USA.(Invited talk)
    • Year and Date
      20100711-20100716
  • [Presentation] ccurate Powder Structural Study of Pharmaceuticals Using Maximum Entropy Method.2010

    • Author(s)
      西堀英治
    • Organizer
      The 9th Pharmaceutical Powder X-ray Diffraction Symposium
    • Place of Presentation
      Hilton Head Island, South Carolina, USA.(Invited talk)
    • Year and Date
      20100222-20100225
  • [Presentation] 遺伝的アルゴリズムによる放射光X線回折データを用いた未知構造決定2009

    • Author(s)
      西堀英治
    • Organizer
      日本物理学会第64回年次大会
    • Place of Presentation
      立教大学/日本、(シンポジウム)(依頼講演)
    • Year and Date
      2009-03-07
  • [Book] 熱電変換技術ハンドブック(2章、2節、2.亜鉛アンチモン化合物、2.1結晶構造)(梶川武信監修)(分担執筆)2008

    • Author(s)
      西堀英治
    • Total Pages
      46-52
    • Publisher
      株式会社エヌティーエス
  • [Remarks] ホームページ等

    • URL

      http://www.mcr.nuap.nagoya-u.ac.jp

URL: 

Published: 2012-01-26   Modified: 2016-04-21  

Information User Guide FAQ News Terms of Use Attribution of KAKENHI

Powered by NII kakenhi