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Fluctuation and Chemical Reaction in Low-dimensional Condensed Phase

Research Project

Project/Area Number 18066011
Research Category

Grant-in-Aid for Scientific Research on Priority Areas

Allocation TypeSingle-year Grants
Review Section Science and Engineering
Research InstitutionOkayama University

Principal Investigator

TANAKA Hideki  Okayama University, 大学院・自然科学研究科, 教授 (80197459)

Co-Investigator(Kenkyū-buntansha) KOGA Kenichiro  岡山大学, 大学院・自然科学研究科, 教授 (10315020)
MISHIMA Osamu  物質・材料研究機構, 物質研究所, 主席研究員 (10133141)
Project Period (FY) 2006 – 2009
Project Status Completed (Fiscal Year 2009)
Budget Amount *help
¥41,300,000 (Direct Cost: ¥41,300,000)
Fiscal Year 2009: ¥7,300,000 (Direct Cost: ¥7,300,000)
Fiscal Year 2008: ¥14,700,000 (Direct Cost: ¥14,700,000)
Fiscal Year 2007: ¥10,100,000 (Direct Cost: ¥10,100,000)
Fiscal Year 2006: ¥9,200,000 (Direct Cost: ¥9,200,000)
Keywords低次元 / 凝集系 / 水 / クラスレート / 水素 / 多重占有 / 熱力学的安定性 / 氷 / プラスチック相 / 制約空間 / 化学平衡
Research Abstract

Phase transitions and phase behaviors of water in confined spaces have been investigated with a statistical mechanical theory and molecular simulations. Examined are a phase behavior of water confined in quasi one dimensional spaces and the thermodynamic stability of clathrate hydrates containing hydrogen on the basis of a newly developed theory and simulation methods.

Report

(6 results)
  • 2009 Annual Research Report   Final Research Report ( PDF )
  • 2008 Annual Research Report   Self-evaluation Report ( PDF )
  • 2007 Annual Research Report
  • 2006 Annual Research Report
  • Research Products

    (32 results)

All 2010 2009 2008 2007 2006

All Journal Article (20 results) (of which Peer Reviewed: 11 results) Presentation (10 results) Book (2 results)

  • [Journal Article] Phase behavior of ices filled with hydrogen molecules2010

    • Author(s)
      L. Hakim, K. Koga, H. Tanaka
    • Journal Title

      Phys. Rev. Lett 104

    • Related Report
      2009 Final Research Report
  • [Journal Article] Phase Behavior of Different Forms of Ice Filled with Hydrogen Molecules2010

    • Author(s)
      L.Hakim, K.Koga, H.Tanaka
    • Journal Title

      Phys.Rev.Lett. 104

      Pages: 115701-115701

    • Related Report
      2009 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Augmented stability of hydrogen clathrate hydrates by weakly polar molecules2009

    • Author(s)
      T. Nakayama, K. Koga, H. Tanaka
    • Journal Title

      J. Chem. Phys. 131

    • Related Report
      2009 Final Research Report
  • [Journal Article] Augmented stability of hydrogen clathrate hydrates by weakly polar molecules2009

    • Author(s)
      T.Nakayama, K.Koga, H.Tanaka
    • Journal Title

      J.Chem.Phys. 131

      Pages: 214506-214506

    • Related Report
      2009 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Phase behavior and fluid-solid surface tension of argon in slit pores and carbon nanotubes2009

    • Author(s)
      Y.Hamada, K.Koga, H.Tanaka
    • Journal Title

      Physica A 388

      Pages: 22892298-22892298

    • Related Report
      2009 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Phase diagram of water in carbon nanotubes2008

    • Author(s)
      D. Takaiwa, I. Hatano, K. Koga, H. Tanaka
    • Journal Title

      Proc. Natl. Acad. Sci. USA 105

      Pages: 39-43

    • Related Report
      2009 Final Research Report
  • [Journal Article] A plastic phase of water from computer simulation2008

    • Author(s)
      Y. Takii, K. Koga, H. Tanaka
    • Journal Title

      J. Chem. Phys. 128

    • Related Report
      2009 Final Research Report
  • [Journal Article] Phase diagram of water in carbon nanotubes2008

    • Author(s)
      D.Takaiwa, I.Hatano, K.Koga, H.Tanaka
    • Journal Title

      Proc.Natl.Acad.Sci.USA 105

    • Related Report
      2008 Self-evaluation Report
    • Peer Reviewed
  • [Journal Article] Aplastic phase of water from computer simulation2008

    • Author(s)
      Y.Takii, K.Koga, H.Tanaka
    • Journal Title

      J.Chem.Phys. 128

    • Related Report
      2008 Self-evaluation Report
    • Peer Reviewed
  • [Journal Article] Phase diagram of water in carbon nanotubes2008

    • Author(s)
      D. Takaiwa, I. Hatano, K. Koga, and H.
    • Journal Title

      Proc. Natl. Acad. Sci. USA 105

      Pages: 39-43

    • Related Report
      2008 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Mean-field density-functional model of a second-order wetting transition2008

    • Author(s)
      K. Koga and B. Widom
    • Journal Title

      J. Chem. Phys. 128

      Pages: 114716-114716

    • Related Report
      2008 Annual Research Report
    • Peer Reviewed
  • [Journal Article] A plastic phase of water from computer simulation2008

    • Author(s)
      Y. Takii, K. Koga, and H. Tanaka
    • Journal Title

      J. Chem. Phys. 128

      Pages: 204501-204501

    • Related Report
      2008 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Phase diagram of water in carbon nanotubes2008

    • Author(s)
      D. Takaiwa, I. Hatario, K. Koga,
    • Journal Title

      Proc. Natl. Acad. Sci. USA 105

      Pages: 3943-3943

    • Related Report
      2007 Annual Research Report
    • Peer Reviewed
  • [Journal Article] On the thermodynamic stability of hydrogen clathrate hydrates2007

    • Author(s)
      K. Katsumasa, K. Koga, H. Tanaka
    • Journal Title

      J. Chem. Phys. 127

    • NAID

      120002307046

    • Related Report
      2009 Final Research Report
  • [Journal Article] structures of filled ice nanotubes inside carbon nanotubes2007

    • Author(s)
      D. Takaiwa, K. Koga, H. Tanaka
    • Journal Title

      Mol. Simulat. 33

      Pages: 127132-127132

    • Related Report
      2007 Annual Research Report
    • Peer Reviewed
  • [Journal Article] On the thermodynamic stability of hydrogen clathrate hydrates2007

    • Author(s)
      K. Katsumasa, K. Koga, H. Tana
    • Journal Title

      J. Chem. Phys. 127,08490

      Pages: 19-19

    • NAID

      120002307046

    • Related Report
      2007 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Theoretical Studies on the Structure and Dynamics of Water, Ice, and Clathrate Hydrate2006

    • Author(s)
      H. Tanaka, K. Koga
    • Journal Title

      Bull. Chem. Soc. Jpn. 79(Award Accounts)

      Pages: 1621-1644

    • NAID

      10019372693

    • Related Report
      2009 Final Research Report
  • [Journal Article] Theoretical studies on the structure and dynamics of water, ice, and clathrate hydrate2006

    • Author(s)
      Hideki Tanaka
    • Journal Title

      Bull.Chem.Soc.Jpn. 79

      Pages: 1621-1644

    • NAID

      10019372693

    • Related Report
      2006 Annual Research Report
  • [Journal Article] Close-Packed structures and phase diagram of soft spheres in cylindrical pores2006

    • Author(s)
      Kenichiro Koga
    • Journal Title

      J.Chem.Phys. 124

    • Related Report
      2006 Annual Research Report
  • [Journal Article] 微小空間内の水のふるまい2006

    • Author(s)
      甲賀 研一郎
    • Journal Title

      現代化学 426

      Pages: 24-30

    • Related Report
      2006 Annual Research Report
  • [Presentation] Augmented stability of hydrogen clathrate hydrates by weakly polar molecules2010

    • Author(s)
      H. Tanaka, T. Nakayama, K. Koga
    • Organizer
      Symposium for Chemistry Between Okayama University and National Taipei University of Technology
    • Place of Presentation
      Taipei Taiwan
    • Year and Date
      2010-03-15
    • Related Report
      2009 Final Research Report
  • [Presentation] A plastic phase of water from computer simulation2010

    • Author(s)
      H. Tanaka, Y. Takii, K. Koga
    • Organizer
      Symposium for Chemistry Between Okayama University and National Taiwan University.
    • Place of Presentation
      Taipei Taiwan
    • Year and Date
      2010-03-12
    • Related Report
      2009 Final Research Report
  • [Presentation] Thermodynamic stability of hydrogen clathrate hydrates(invited)2009

    • Author(s)
      H.Tanaka
    • Organizer
      ACS national meeting
    • Place of Presentation
      Salt Lake City USA
    • Year and Date
      2009-03-25
    • Related Report
      2008 Self-evaluation Report
  • [Presentation] Thermodynamic stability of hydrogen clathrate hydrates2009

    • Author(s)
      H. Tanaka
    • Organizer
      237th ACS National Meeting
    • Place of Presentation
      Salt Lake City UT USA.
    • Related Report
      2009 Final Research Report
  • [Presentation] Plastic phase of water under high pressure2009

    • Author(s)
      H. Tanaka, Y. Takii, K. Koga
    • Organizer
      international symposium on Reaction Dynamics in Many-body Chemical Systems
    • Place of Presentation
      Kyoto Japan
    • Related Report
      2009 Final Research Report
  • [Presentation] Thermodynamic stability of hydrogen clathrate hydrates2009

    • Author(s)
      H.Tanaka
    • Organizer
      237th ACS National Meeting
    • Place of Presentation
      Salt Lake City UT USA
    • Related Report
      2009 Annual Research Report
  • [Presentation] 極端条件下の水、氷、クラスレートの計算機シミュレーション(招待講演)2008

    • Author(s)
      田中秀樹
    • Organizer
      第8回九州溶液化学懇談会
    • Place of Presentation
      福岡
    • Year and Date
      2008-08-19
    • Related Report
      2008 Self-evaluation Report
  • [Presentation] 極端条件下の水、氷、クラスレートの計算機シミュレーション2008

    • Author(s)
      田中秀樹
    • Organizer
      第8回九州溶液化学懇談会
    • Place of Presentation
      福岡
    • Year and Date
      2008-08-19
    • Related Report
      2008 Annual Research Report
  • [Presentation] Structure and stability of hydrogen clathrate hydrates2007

    • Author(s)
      H. Tanaka
    • Organizer
      The 3rd Asian Pacific Conference on Theoretical and Computational Chemistry
    • Place of Presentation
      Beijing, China
    • Related Report
      2009 Final Research Report
  • [Presentation] Formation of Ice Nanotubes with Hydrophobic Guests2006

    • Author(s)
      H. Tanaka
    • Organizer
      THERMO INT'L '06
    • Place of Presentation
      Boulder, USA
    • Related Report
      2009 Final Research Report
  • [Book] 化学のブレークスルー2010

    • Author(s)
      田中秀樹
    • Total Pages
      31
    • Publisher
      化学同人
    • Related Report
      2009 Final Research Report
  • [Book] 物理化学の基礎の基礎2009

    • Author(s)
      田中秀樹
    • Publisher
      化学同人
    • Related Report
      2009 Annual Research Report 2009 Final Research Report

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Published: 2006-04-01   Modified: 2018-03-28  

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