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First principles investigation on the structure and vibrational properties of high pressure phase of olivine

Research Project

Project/Area Number 21740380
Research Category

Grant-in-Aid for Young Scientists (B)

Allocation TypeSingle-year Grants
Research Field Petrology/Mineralogy/Science of ore deposit
Research InstitutionEhime University

Principal Investigator

TSUCHIYA Jun  Ehime University, 上級研究員センター, 講師 (00527608)

Project Period (FY) 2009 – 2010
Project Status Completed (Fiscal Year 2010)
Budget Amount *help
¥4,550,000 (Direct Cost: ¥3,500,000、Indirect Cost: ¥1,050,000)
Fiscal Year 2010: ¥1,690,000 (Direct Cost: ¥1,300,000、Indirect Cost: ¥390,000)
Fiscal Year 2009: ¥2,860,000 (Direct Cost: ¥2,200,000、Indirect Cost: ¥660,000)
Keywords第一原理計算 / 振動特性 / カンラン石高圧相 / マントル遷移層 / 含水量 / 高圧 / 含水相
Research Abstract

From high pressure experiments, it has been reported that high pressure phases of olivine, which are main mineral component of mantle transition zone (from 410 to 660 km depth), can retain plenty of hydrogen in their crystal structures. Therefore, there is a possibility that significant amount of water is transported and stored in these phases in the mantle transition zone by mantle convection. In order to investigate and clarify the structure and bonding state of hydrogen in the high pressure phases of olivine, we conducted first principles electronic structure calculation and calculated vibrational properties of these phases using high performance computers.

Report

(3 results)
  • 2010 Annual Research Report   Final Research Report ( PDF )
  • 2009 Annual Research Report
  • Research Products

    (20 results)

All 2011 2010 2009

All Journal Article (8 results) (of which Peer Reviewed: 8 results) Presentation (12 results)

  • [Journal Article] Prediction of a hexagonal SiO2 phase affecting stabilities of MgSiO3 and CaSiO3 at multimegabar pressures2011

    • Author(s)
      T.Tsuchiya, J.Tsuchiya
    • Journal Title

      Proceedings of the National Academy of Science of the United States of America 108

      Pages: 1252-1255

    • Related Report
      2010 Final Research Report
    • Peer Reviewed
  • [Journal Article] First-principles prediction of a high-pressure hydrous phase of AlOOH2011

    • Author(s)
      J.Tsuchiya, T.Tsuchiya
    • Journal Title

      Physical Review B 83

      Pages: 541153-541153

    • Related Report
      2010 Final Research Report
    • Peer Reviewed
  • [Journal Article] First-principles prediction of a high-pressure hydrous phase of AlOOH2011

    • Author(s)
      J.Tsuchiya, T.Tsuchiya
    • Journal Title

      Physical Review B

      Volume: 83 Pages: 54115-54115

    • Related Report
      2010 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Prediction of a hexagonal SiO2 phase affecting stabilities of MgSiO3 and CaSiO3 at multimegabar pressures2011

    • Author(s)
      T.Tsuchiya, J.Tsuchiya
    • Journal Title

      Proceedings of the National Academy of Science of the United States of America

      Volume: 108 Pages: 1252-1255

    • Related Report
      2010 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Elastic, vibrational and thermodynamic properties of MgGeO3 post-perovskite investigated by first principles simulation2010

    • Author(s)
      Y.Usui, J.Tsuchiya, T.Tsuchiya
    • Journal Title

      Journal of Geophysical Research 115

    • Related Report
      2010 Final Research Report
    • Peer Reviewed
  • [Journal Article] Elastic, vibrational, and thermodynamic properties of MgGeO3 postperovskite investigated by first principles simulation2010

    • Author(s)
      Yusuke Usui, Jun Tsuchiya, Taku Tsuchiya
    • Journal Title

      Journal of Geophysical Research 115

    • Related Report
      2009 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Elastic properties of δ-ALOOH under pressure : First principles investigation2009

    • Author(s)
      Jun Tsuchiya, Taku Tsuchiya
    • Journal Title

      Physics of the Earth and Planetary Interiors 174

      Pages: 122-127

    • Related Report
      2009 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Lost primordial continents2009

    • Author(s)
      K.Kawai, T.Tsuchiya, J.Tsuchiya S.Maruyama
    • Journal Title

      Gondwana Research 16

      Pages: 581-586

    • Related Report
      2009 Annual Research Report
    • Peer Reviewed
  • [Presentation] Elasticity of serpentine: first principles investigation2010

    • Author(s)
      J.Tsuchiya, T.Tsuchiya, Y.Usui, I.Katayama
    • Organizer
      The 20th general meeting of the international mineralogical association (IMA2010)
    • Place of Presentation
      Budapest, HUNGARY.
    • Related Report
      2010 Final Research Report
  • [Presentation] Elasticity of serpentine : first principles investigation2010

    • Author(s)
      J.Tsuchiya, T.Tsuchiya, Y.Usui, I Katayama
    • Organizer
      The 20th general meeting of the international mineralogical association (IMA2010)
    • Place of Presentation
      Budapest, HUNGARY
    • Related Report
      2010 Annual Research Report
  • [Presentation] Elasticity of serpentine: first principls investigation2009

    • Author(s)
      J.Tsuchiya, T.Tsuchiya, I.Katayama, Y.Usui
    • Organizer
      American Geophysical Union fall meeting
    • Place of Presentation
      San Francisco, USA.
    • Year and Date
      2009-12-15
    • Related Report
      2010 Final Research Report
  • [Presentation] Ab initio assessment of high-P,T postperovskite phase equilibria in the MgSiO3-Al2O3 pseudo binary system2009

    • Author(s)
      Jun Tsuchiya, Taku Tsuchiya
    • Organizer
      American Geophysical Union, Fall Meeting
    • Place of Presentation
      San Francisco, USA
    • Year and Date
      2009-12-15
    • Related Report
      2009 Annual Research Report
  • [Presentation] First principles exploration for hydrogen in the deep Earth's mantle2009

    • Author(s)
      J.Tsuchiya, T.Tsuchiya
    • Organizer
      Hydrogen and water in condensed matter physics (HORIBA-ISSP11)
    • Place of Presentation
      Chiba, JAPAN
    • Year and Date
      2009-10-13
    • Related Report
      2010 Final Research Report 2009 Annual Research Report
  • [Presentation] First-principles investigations on the elastic properties of hydrous minerals under pressure2009

    • Author(s)
      J.Tsuchiya, T.Tsuchiya
    • Organizer
      AIRAPT-22 HPCJ-50
    • Place of Presentation
      Tokyo,JAPAN.
    • Year and Date
      2009-07-28
    • Related Report
      2010 Final Research Report
  • [Presentation] First-principles investigations on the elastic and vibrational properties of hydrous wadsleyite under pressure2009

    • Author(s)
      J.Tsuchiya, T.Tsuchiya
    • Organizer
      Goldschmidt 2009
    • Place of Presentation
      Davos, SWITZERLAND.
    • Year and Date
      2009-06-24
    • Related Report
      2010 Final Research Report
  • [Presentation] First-principles investigaion on the elastic and vibrational properties of hydrous wadsleyite under pressure2009

    • Author(s)
      Jun Tsuchiya, Taku Tsuchiya
    • Organizer
      Goldschmidt 2009
    • Place of Presentation
      Davos, SWITZERLAND
    • Year and Date
      2009-06-24
    • Related Report
      2009 Annual Research Report
  • [Presentation] First principles invertigantion on hydrous wadsleyite under pressure2009

    • Author(s)
      Jun Tsuchiya, Taku Tsuchiya
    • Organizer
      GRC-BGI Workship on Deep Earth Mineralogy
    • Place of Presentation
      Bayreuth, GERMANY
    • Year and Date
      2009-06-18
    • Related Report
      2009 Annual Research Report
  • [Presentation] First principles investigation on hydrogen diffusivity in hydrous wadsleyite under high pressure2009

    • Author(s)
      土屋旬, 土屋卓久
    • Organizer
      日本地球惑星科学連合大会
    • Place of Presentation
      千葉
    • Year and Date
      2009-05-18
    • Related Report
      2010 Final Research Report
  • [Presentation] First principles investigaion on hydrogen diffusivity in hydrous wadsleyite under high pressure2009

    • Author(s)
      土屋旬, 土屋卓久
    • Organizer
      日本地球惑星科学連合大会
    • Place of Presentation
      千葉,幕張
    • Year and Date
      2009-05-18
    • Related Report
      2009 Annual Research Report
  • [Presentation] Perovskite and post perovskite phase relation in the MgSiO3-Al2O3 system2009

    • Author(s)
      土屋旬, 土屋卓久
    • Organizer
      日本地球惑星科学連合大会
    • Place of Presentation
      千葉,幕張
    • Year and Date
      2009-05-17
    • Related Report
      2009 Annual Research Report

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Published: 2009-04-01   Modified: 2016-04-21  

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