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2009 Fiscal Year Final Research Report

Elucidation of intramolecular electron transfer reaction in supercritical water by using the ultrafast spectroscopy and theoretical analysis

Research Project

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Project/Area Number 19350010
Research Category

Grant-in-Aid for Scientific Research (B)

Allocation TypeSingle-year Grants
Section一般
Research Field Physical chemistry
Research InstitutionKyoto University

Principal Investigator

KIMURA Yoshifumi  Kyoto University, 大学院・理学研究科, 准教授 (60221925)

Co-Investigator(Kenkyū-buntansha) SATO Hirofumi  京都大学, 大学院・工学研究科, 准教授 (70290905)
Project Period (FY) 2007 – 2009
Keywords超臨界水 / 電荷移動反応 / 超高速レーザー分光 / ラマン分光 / RISM-SCF
Research Abstract

In order to clarify the specialties of water above the gas-liquid critical temperature (supercritical water), we have selected the molecules which shows the intra-molecular charge-transfer as target, and studied the electronic states, structure, and electron transfer dynamics which is induced by the photo-excitation, using various kinds of laser spectroscopy and theoretical calculations. We have clarified for the first time the hydrogen-bonding between solute and solvent in protic supercritical fluids, and the details of the electron transfer reaction and the vibrational energy relaxation.

  • Research Products

    (13 results)

All 2010 2009 2008 2007 Other

All Journal Article (6 results) (of which Peer Reviewed: 6 results) Presentation (6 results) Remarks (1 results)

  • [Journal Article] Aqueous Solvation of p-aminobenzonitrile in the Excited States: A Molecular Level Theory on Density Dependence2010

    • Author(s)
      D. Yokogawa, H. Sato, S. Sakaki, Y. Kimura
    • Journal Title

      J. Phys. Chem. B. 114(2)

      Pages: 910-914

    • Peer Reviewed
  • [Journal Article] The spectroscopic study on solvation of charge transfer molecules in supercritical water2010

    • Author(s)
      K. Osawa, T. Fujisawa, M. Terazima, Y. Kimura
    • Journal Title

      J. Phys. Conf. Ser. 215(1)

      Pages: 012089(1-5)

    • Peer Reviewed
  • [Journal Article] Vibrational energy relaxation of perylene in supercritical alcohols2010

    • Author(s)
      I. Kobayashi, S. Nagao, M. Terazima, Y. Kimura
    • Journal Title

      J. Phys. Conf. Ser. 215(1)

      Pages: 012092(1-4)

    • Peer Reviewed
  • [Journal Article] ラマンスペクトルからみたイオン液体・超臨界水の溶媒和2009

    • Author(s)
      木村佳文
    • Journal Title

      分子シミュレーション研究会会誌アンサンブル 11(2)

      Pages: 8-13

    • Peer Reviewed
  • [Journal Article] Raman spectroscopic study on the solvation of p-aminobenzonitrile in supercritical water and alcohols2009

    • Author(s)
      K. Osawa, T. Hamamoto, T. Fujisawa, M. Terazima, H, Sato, Y. Kimura
    • Journal Title

      J. Phys. Chem. A 113(13)

      Pages: 3143-3154

    • Peer Reviewed
  • [Journal Article] Solvent effects on the local structure of p-nitroaniline in supercritical water and supercritical alcohols2008

    • Author(s)
      T. Fujisawa, M. Terazima, Y. Kimura
    • Journal Title

      J. Phys. Chem. A 112(24)

      Pages: 5515-5526

    • Peer Reviewed
  • [Presentation] 超臨界水中での超高速逆電子移動反応過程の観測2009

    • Author(s)
      大澤浩二, 寺嶋正秀, 木村佳文
    • Organizer
      第32回溶液化学シンポジウム
    • Place of Presentation
      朱鷺メッセ、新潟
    • Year and Date
      20091118-20091120
  • [Presentation] Coronene-Transition Metal complex: view from quantum chemistry and statistical mechanics for solvation effect2009

    • Author(s)
      H. Sato, C. Kikumori, S. Sakaki
    • Organizer
      International Conference of Computational Methods in Sciences and Engineering
    • Place of Presentation
      Rhodes, Greece(Invited)
    • Year and Date
      20090929-20091004
  • [Presentation] Spectroscopic Study of Solvation in Supercritical Water and Supercritical Methanol2009

    • Author(s)
      K. Osawa, T. Fujisawa, M. Terazima, Y. Kimura
    • Organizer
      Joint AIRAPT-22 & HPCJ-50, International Conference on High Pressure Science and Technology
    • Place of Presentation
      Odaiba, Tokyo
    • Year and Date
      20090726-20090731
  • [Presentation] 超臨界水中におけるp-アミノベンゾニトリルの溶媒和2008

    • Author(s)
      大澤浩二, 濱本拓也, 藤澤知績, 寺嶋正秀, 木村佳文
    • Organizer
      第2回分子科学討論会
    • Place of Presentation
      福岡国際会議場, 福岡
    • Year and Date
      20080924-20080927
  • [Presentation] Raman Spectroscopic Study on the solvation in supercritical water and supercritical alcohols2008

    • Author(s)
      Y. Kimura, K. Osawa, T. Fujisawa, M. Terazima
    • Organizer
      EMLG/JMLG Annual Meeting 2008
    • Place of Presentation
      Lisboa, Portugal
    • Year and Date
      20080831-20080904
  • [Presentation] Spectroscopic Study on Solvation, Reaction and Molecular Dynamics in Supercritical Fluids2007

    • Author(s)
      Y. Kimura
    • Organizer
      Joint Conference of JMLG/EMLG Meeting 2007 and 30th Symposium on Solution Chemistry of Japan
    • Place of Presentation
      Fukuoka, Japan(Invited)
    • Year and Date
      20071121-20071125
  • [Remarks]

    • URL

      http://kuchem.kyoto-u.ac.jp/hikari/Kimra0806/index.htm

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Published: 2011-06-18   Modified: 2016-04-21  

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