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First principles study on liquid iron alloys in the Earth's core

Research Project

Project/Area Number 26400525
Research Category

Grant-in-Aid for Scientific Research (C)

Allocation TypeMulti-year Fund
Section一般
Research Field Geochemistry/Cosmochemistry
Research InstitutionTokyo Institute of Technology

Principal Investigator

Umemoto Koichiro  東京工業大学, 地球生命研究所, 研究員 (60726991)

Research Collaborator HIROSE Kei  
Project Period (FY) 2014-04-01 – 2017-03-31
Project Status Completed (Fiscal Year 2016)
Budget Amount *help
¥4,810,000 (Direct Cost: ¥3,700,000、Indirect Cost: ¥1,110,000)
Fiscal Year 2016: ¥1,430,000 (Direct Cost: ¥1,100,000、Indirect Cost: ¥330,000)
Fiscal Year 2015: ¥1,430,000 (Direct Cost: ¥1,100,000、Indirect Cost: ¥330,000)
Fiscal Year 2014: ¥1,950,000 (Direct Cost: ¥1,500,000、Indirect Cost: ¥450,000)
Keywords第一原理計算 / 地球外核 / 液体鉄合金 / 高圧物性 / 高圧高温条件 / 地球深部
Outline of Final Research Achievements

The outer core of the Earth consists of liquid iron alloys with light elements. However, the amounts and kinds of light elements have not been constrained yet. In this study, we performed a series of first principles calculations of density and bulk sound velocity of liquid iron alloys. By comparing them with seismic observations, we tried to constrain the amounts and kinds of light elements as much as possible. We found that hydrogen is a very potential candidate of light element since hydrogen solely can reproduce density and bulk sound velocity by seismic observations. With calculations for other light elements, we proposed combinations of light elements which are consistent with seismic observations.

Report

(4 results)
  • 2016 Annual Research Report   Final Research Report ( PDF )
  • 2015 Research-status Report
  • 2014 Research-status Report
  • Research Products

    (19 results)

All 2017 2016 2015 2014

All Journal Article (9 results) (of which Int'l Joint Research: 5 results,  Peer Reviewed: 9 results,  Acknowledgement Compliant: 3 results) Presentation (10 results) (of which Int'l Joint Research: 8 results,  Invited: 2 results)

  • [Journal Article] SiO2 crystallization and compositional evolution of the Earth’s core2017

    • Author(s)
      K. Hirose, G. Morard, R. Sinmyo, K. Umemoto, J. Hernlund, G. Helffrich, and S. Labrosse
    • Journal Title

      Nature

      Volume: 543 Issue: 7643 Pages: 99-102

    • DOI

      10.1038/nature21367

    • Related Report
      2016 Annual Research Report
    • Peer Reviewed / Int'l Joint Research
  • [Journal Article] First principles study of volume isotope effects in ices VIII and X2017

    • Author(s)
      K. Umemoto and R. M. Wentzcovitch
    • Journal Title

      JAPANESE JOURNAL OF APPLIED PHYSICS

      Volume: 56 Issue: 5S3 Pages: 05FA03-05FA03

    • DOI

      10.7567/jjap.56.05fa03

    • NAID

      210000147793

    • Related Report
      2016 Annual Research Report
    • Peer Reviewed / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] Post-stishovite transition in hydrous aluminous SiO22016

    • Author(s)
      K. Umemoto, K. Kawamura, K. Hirose, and R. M. Wentzcovitch
    • Journal Title

      Phys. Earth Planet. Inter.

      Volume: 255 Pages: 18-26

    • DOI

      10.1016/j.pepi.2016.03.008

    • Related Report
      2016 Annual Research Report 2015 Research-status Report
    • Peer Reviewed / Int'l Joint Research
  • [Journal Article] Liquid iron-hydrogen alloys at outer core conditions by first-principles calculations2015

    • Author(s)
      K. Umemoto and K. Hirose
    • Journal Title

      Geophysical Research Letters

      Volume: 42 Issue: 18 Pages: 7513-7520

    • DOI

      10.1002/2015gl065899

    • Related Report
      2015 Research-status Report
    • Peer Reviewed / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] Nature of the Volume Isotope Effect in Ice2015

    • Author(s)
      K. Umemoto, E. Sugimura, S. de Gironcoli, Y. Nakajima, K. Hirose, Y. Ohishi, and R. M. Wentzcovitch
    • Journal Title

      Physical Review Letters

      Volume: 115 Issue: 17 Pages: 173005-173005

    • DOI

      10.1103/physrevlett.115.173005

    • Related Report
      2015 Research-status Report
    • Peer Reviewed / Int'l Joint Research
  • [Journal Article] Two-stages Dissociation of NaMgF3 Post-Perovskite: A Potential Low-Pressure Analog of MgSiO3 at Multi-Mbar Pressures2015

    • Author(s)
      K. Umemoto and R. M. Wentzcovitch
    • Journal Title

      JPS Conference Proceedings

      Volume: 4 Pages: 011002-011002

    • DOI

      10.7566/jpscp.4.011002

    • Related Report
      2014 Research-status Report
    • Peer Reviewed
  • [Journal Article] Searching for high magnetization density in bulk Fe: the new metastable Fe-6 phase2015

    • Author(s)
      K. Umemoto, B. Himmetoglu, J. P. Wang, R. M. Wentzcovitch, M. Cococcioni
    • Journal Title

      JOURNAL OF PHYSICS-CONDENSED MATTER

      Volume: 27 Issue: 1 Pages: 016001-016001

    • DOI

      10.1088/0953-8984/27/1/016001

    • Related Report
      2014 Research-status Report
    • Peer Reviewed
  • [Journal Article] Liquid iron-sulfur alloys at outer core conditions by first-principles calculations2014

    • Author(s)
      Koichiro Umemoto, Kei Hirose, Saori Imada, Yoichi Nakajima, Tetsuya Komabayashi, Satoshi Tsutsui, Alfred Q.R. Baron
    • Journal Title

      Geophysical Research Letters

      Volume: 41 Issue: 19 Pages: 6712-6717

    • DOI

      10.1002/2014gl061233

    • Related Report
      2014 Research-status Report
    • Peer Reviewed / Acknowledgement Compliant
  • [Journal Article] An adaptive genetic algorithm for crystal structure prediction2014

    • Author(s)
      S. Q. Wu, M. Ji, C. Z. Wang, M. C. Nguyen, X. Zhao, K. Umemoto, R. M. Wentzcovitch
    • Journal Title

      JOURNAL OF PHYSICS-CONDENSED MATTER

      Volume: 26 Issue: 3 Pages: 035402-035402

    • DOI

      10.1088/0953-8984/26/3/035402

    • Related Report
      2014 Research-status Report
    • Peer Reviewed
  • [Presentation] Solid iron-hydrogen alloys under high pressure by first principles2016

    • Author(s)
      K. Umemoto
    • Organizer
      AGU Fall Meeting 2016
    • Place of Presentation
      San Francisco, USA
    • Year and Date
      2016-12-13
    • Related Report
      2016 Annual Research Report
    • Int'l Joint Research
  • [Presentation] Solid iron-hydrogen alloys under high pressure by first principles2016

    • Author(s)
      K. Umemoto
    • Organizer
      Goldschmidt 2016
    • Place of Presentation
      横浜
    • Year and Date
      2016-06-30
    • Related Report
      2016 Annual Research Report
    • Int'l Joint Research
  • [Presentation] Liquid Iron Alloys with Light Elements at Outer Core Conditions by First Principles2016

    • Author(s)
      K. Umemoto
    • Organizer
      99th Canadian Chemistry Conference and Exhibition
    • Place of Presentation
      Halifax, Canada
    • Year and Date
      2016-06-09
    • Related Report
      2016 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] Liquid Iron Alloys with Light Elements at Outer Core Conditions by First Principles2016

    • Author(s)
      K. Umemoto
    • Organizer
      99th Canadian Chemistry Conference
    • Place of Presentation
      HALIFAX, NS, Canada
    • Year and Date
      2016-06-05
    • Related Report
      2015 Research-status Report
    • Int'l Joint Research / Invited
  • [Presentation] Solid iron-hydrogen alloys under high pressure by first principles2016

    • Author(s)
      K. Umemoto
    • Organizer
      Japan Geoscience Union Meeting 2016
    • Place of Presentation
      幕張メッセ 千葉
    • Year and Date
      2016-05-22
    • Related Report
      2016 Annual Research Report
    • Int'l Joint Research
  • [Presentation] Liquid Iron Alloys with Hydrogen at Outer Core Conditions by First Principles2015

    • Author(s)
      K. Umemoto and K. Hirose
    • Organizer
      American Geophysical Union Fall meeting 2015
    • Place of Presentation
      San Francisco, USA
    • Year and Date
      2015-12-14
    • Related Report
      2015 Research-status Report
    • Int'l Joint Research
  • [Presentation] 第一原理計算による地球外核条件下における液体鉄水素合金の研究2015

    • Author(s)
      梅本幸一郎、廣瀬敬
    • Organizer
      第56回高圧討論会
    • Place of Presentation
      JMSアステールプラザ(広島)
    • Year and Date
      2015-11-11
    • Related Report
      2015 Research-status Report
  • [Presentation] Liquid iron alloys with hydrogen at outer core conditions by first-principles2015

    • Author(s)
      K. Umemoto and K. Hirose
    • Organizer
      Workshop: The Earth's Mantle and Core: Structure, Composition, Evolution
    • Place of Presentation
      道後プリンスホテル(松山、愛媛)
    • Year and Date
      2015-11-04
    • Related Report
      2015 Research-status Report
    • Int'l Joint Research
  • [Presentation] Liquid iron alloys with light elements at outer core conditions by first-principles calculation2015

    • Author(s)
      K. Umemoto and K. Hirose
    • Organizer
      日本地球惑星科学連合大会2015
    • Place of Presentation
      幕張メッセ
    • Year and Date
      2015-05-26
    • Related Report
      2015 Research-status Report
    • Int'l Joint Research
  • [Presentation] Liquid iron alloys at outer core conditions by first-principles calculation2014

    • Author(s)
      K. Umemoto and K. Hirose
    • Organizer
      American Geophysical Union, Fall Meeting 2014
    • Place of Presentation
      サンフランシスコ、アメリカ
    • Year and Date
      2014-12-15
    • Related Report
      2014 Research-status Report

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Published: 2014-04-04   Modified: 2018-03-22  

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