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Study on the mechanism of solid solution strengthening in steel based on first principles calculation of dislocation

Research Project

Project/Area Number 15K17939
Research Category

Grant-in-Aid for Young Scientists (B)

Allocation TypeMulti-year Fund
Research Field Materials/Mechanics of materials
Research InstitutionNational Institute for Materials Science (2017)
Osaka University (2015-2016)

Principal Investigator

Wakeda Masato  国立研究開発法人物質・材料研究機構, 構造材料研究拠点, 主任研究員 (00550203)

Project Period (FY) 2015-04-01 – 2018-03-31
Project Status Completed (Fiscal Year 2017)
Budget Amount *help
¥2,990,000 (Direct Cost: ¥2,300,000、Indirect Cost: ¥690,000)
Fiscal Year 2016: ¥1,170,000 (Direct Cost: ¥900,000、Indirect Cost: ¥270,000)
Fiscal Year 2015: ¥1,820,000 (Direct Cost: ¥1,400,000、Indirect Cost: ¥420,000)
Keywords転位 / 第一原理計算 / 固溶強化 / 鉄 / 時間粗視化モデル
Outline of Final Research Achievements

In this research, I investigated effects of solute atoms on strength of iron based on first principles calculation of dislocation. I focused on the effect of solute atoms on screw dislocation motion. The quantitative interactions between a screw dislocation and a solute atom were evaluated based on first principles calculation. Moreover, a theoretical framework and a simulation model to predict the effects of solute species on the macroscopic mechanical properties were constructed and discussed based on the obtained interaction. These results should be fundamental knowledge to understand the solid solution strengthening of steel based on the atomistic theory.

Report

(4 results)
  • 2017 Annual Research Report   Final Research Report ( PDF )
  • 2016 Research-status Report
  • 2015 Research-status Report
  • Research Products

    (17 results)

All 2018 2017 2016 2015

All Journal Article (2 results) (of which Peer Reviewed: 2 results,  Open Access: 1 results,  Acknowledgement Compliant: 1 results) Presentation (15 results) (of which Int'l Joint Research: 3 results,  Invited: 2 results)

  • [Journal Article] Chemical misfit origin of solute strengthening in iron alloys2017

    • Author(s)
      M. Wakeda, T. Tsuru, M. Kohyama, T. Ozaki, H. Sawada, M. Itakura and S. Ogata
    • Journal Title

      Acta Materialia

      Volume: 131 Pages: 445-445

    • DOI

      10.1016/j.actamat.2017.04.017

    • Related Report
      2017 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Theoretical Prediction of Macroscopic Yield Strength for Fe Alloy Based on Atomistic Study2016

    • Author(s)
      新里 秀平, 譯田 真人, 尾方 成信
    • Journal Title

      Journal of the Japan Institute of Metals and Materials

      Volume: 80 Issue: 3 Pages: 197-205

    • DOI

      10.2320/jinstmet.J2015061

    • NAID

      130005127243

    • ISSN
      0021-4876, 1880-6880, 2433-7501
    • Related Report
      2015 Research-status Report
    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Presentation] 階層的モデリングによる鉄合金中の転位解析2018

    • Author(s)
      譯田真人,新里秀平,尾方成信
    • Organizer
      日本金属学会2018年春季(第162回)講演大会
    • Related Report
      2017 Annual Research Report
    • Invited
  • [Presentation] 原子論的解析に基づくkinetic Monte Carlo法を用いた鉄基合金中の転位運動の解析2017

    • Author(s)
      新里秀平,譯田真人,尾方成信
    • Organizer
      日本金属学会第160回春期講演大会
    • Place of Presentation
      首都大東京(東京都・八王子市)
    • Year and Date
      2017-03-14
    • Related Report
      2016 Research-status Report
  • [Presentation] 鉄の転位芯近傍における置換型固溶元素と炭素の相互作用解析2017

    • Author(s)
      譯田真人,尾方成信
    • Organizer
      日本機械学会第30回計算力学講演会
    • Related Report
      2017 Annual Research Report
  • [Presentation] 格子欠陥の第一原理計算に基づく構造材料の力学特性予測2017

    • Author(s)
      譯田真人,尾方成信
    • Organizer
      第27回日本MRS年次大会
    • Related Report
      2017 Annual Research Report
    • Invited
  • [Presentation] 離散転位動力学法を用いた転位の集団挙動の統計的性質に関する研究2017

    • Author(s)
      世良悟,堀裕多,石井明男, 譯田真人, 君塚肇, 尾方成信
    • Organizer
      日本機械学会 関西学生会平成28年度学生員卒業研究発表講演会
    • Place of Presentation
      大阪大学(大阪府・吹田市)
    • Related Report
      2016 Research-status Report
  • [Presentation] Atomistically informed kinetic Monte Carlo simulation of dislocation motion in solid solution strengthened bcc alloys2016

    • Author(s)
      Shuhei Shinzato, Masato Wakeda and Shigenobu Ogata
    • Organizer
      Materials Research Society (MRS) 2016 Fall Meeting
    • Place of Presentation
      ボストン(アメリカ)
    • Year and Date
      2016-11-27
    • Related Report
      2016 Research-status Report
    • Int'l Joint Research
  • [Presentation] 第一原理計算に基づく鉄中のらせん転位運動に対する炭素原子の影響解析2016

    • Author(s)
      譯田真人, 尾方成信
    • Organizer
      日本機械学会第29回計算力学講演会(CMD2016)
    • Place of Presentation
      名古屋大学(愛知県・名古屋市)
    • Year and Date
      2016-09-22
    • Related Report
      2016 Research-status Report
  • [Presentation] Kinetic Monte Carlo study on effect of solute atoms on dislocation motion in Fe-based alloys2016

    • Author(s)
      Shuhei Shinzato, Masato Wakeda and Shigenobu Ogata
    • Organizer
      The 9th Pacific Rim International Conference on Advanced Materials and Processing (PRICM9)
    • Place of Presentation
      国立京都国際会館(京都府・京都市)
    • Year and Date
      2016-08-01
    • Related Report
      2016 Research-status Report
    • Int'l Joint Research
  • [Presentation] 第一原理計算に基づく鉄中のらせん転位と置換型固体元素の相互作用解析2016

    • Author(s)
      譯田真人, 尾方成信
    • Organizer
      日本金属学会第158回春期講演大会
    • Place of Presentation
      東京理科大学葛飾キャンパス(東京都葛飾区)
    • Year and Date
      2016-03-23
    • Related Report
      2015 Research-status Report
  • [Presentation] 原子論的解析に基づくbcc-Fe中のらせん転位のジョグ形成に与える添加元素の影響評価2016

    • Author(s)
      譯田真人, 田中柾伎, 新里秀平, 尾方成信
    • Organizer
      日本機械学会 関西支部第91期定時総会講演会
    • Place of Presentation
      大阪電気通信大学(大阪府寝屋川市)
    • Year and Date
      2016-03-11
    • Related Report
      2015 Research-status Report
  • [Presentation] 電子論に基づく鉄の固溶強化の研究2016

    • Author(s)
      譯田真人, 尾方成信
    • Organizer
      マルチスケール材料力学シンポジウム(第21回分子動力学シンポジウム)
    • Place of Presentation
      富山大学 (富山県・富山市)
    • Related Report
      2016 Research-status Report
  • [Presentation] 鉄合金中のらせん転位ダイナミクスのkinetic Monte Carlo解析2015

    • Author(s)
      譯田真人, 田中柾伎, 新里秀平, 尾方成信
    • Organizer
      日本機械学会 第28回計算力学講演会(CMD2015)
    • Place of Presentation
      横浜国立大学(神奈川県横浜市)
    • Year and Date
      2015-10-10
    • Related Report
      2015 Research-status Report
  • [Presentation] 鉄基合金の固溶体強化メカニズムの原子論的解明2015

    • Author(s)
      新里秀平,譯田真人,君塚肇,尾方成信
    • Organizer
      日本機械学会 材料力学部門若手シンポジウム2015
    • Place of Presentation
      神宮会館(三重県伊勢市)
    • Year and Date
      2015-08-10
    • Related Report
      2015 Research-status Report
  • [Presentation] 第一原理計算によるFeのパイエルス・ポテンシャルに対する固溶元素の影響評価2015

    • Author(s)
      譯田真人,尾方成信
    • Organizer
      第20回分子動力学シンポジウム
    • Place of Presentation
      山形大学(山形県米沢市)
    • Year and Date
      2015-05-22
    • Related Report
      2015 Research-status Report
  • [Presentation] Multiscale modeling of solute atom effect on critical resolved shear stress of Fe2015

    • Author(s)
      Masato Wakeda, Shigenobu Ogata
    • Organizer
      12th International Conference on the Mechanical Behavior of Materials (ICM12)
    • Place of Presentation
      Karlsruhe, Germany
    • Year and Date
      2015-05-10
    • Related Report
      2015 Research-status Report
    • Int'l Joint Research

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Published: 2015-04-16   Modified: 2019-03-29  

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