• Search Research Projects
  • Search Researchers
  • How to Use
  1. Back to previous page

Molecular flow dynamics model of adsorption and desorption processes via charge transfer

Research Project

Project/Area Number 26630056
Research Category

Grant-in-Aid for Challenging Exploratory Research

Allocation TypeMulti-year Fund
Research Field Fluid engineering
Research InstitutionOsaka University

Principal Investigator

Doi Kentaro  大阪大学, 基礎工学研究科, 准教授 (20378798)

Co-Investigator(Kenkyū-buntansha) KAWANO SATOYUKI  大阪大学, 基礎工学研究科, 教授 (00250837)
Project Period (FY) 2014-04-01 – 2016-03-31
Project Status Completed (Fiscal Year 2015)
Budget Amount *help
¥3,900,000 (Direct Cost: ¥3,000,000、Indirect Cost: ¥900,000)
Fiscal Year 2015: ¥650,000 (Direct Cost: ¥500,000、Indirect Cost: ¥150,000)
Fiscal Year 2014: ¥3,250,000 (Direct Cost: ¥2,500,000、Indirect Cost: ¥750,000)
Keywords流体工学 / 分子流体力学 / 量子力学 / 電荷移動 / 電気化学反応
Outline of Final Research Achievements

In this study, focusing on molecule and ion transport phenomena and charge transfer at electrode surfaces, a novel theoretical model and simulation technique have been developed to treat dynamics via redox reactions and solvation structures. As a result of molecular dynamics simulations based on the theoretical model, focusing on a relationship between the diffusion coefficient of solvation structures of lithium ions in an organic polar solution, it was found that interactions between solvation structures caused to change the fluidity. Furthermore, we developed another model to evaluate current-voltage characteristics in electron transport phenomena. Focusing on the oxygen reduction reaction near platinum surfaces, we analyzed the current-voltage characteristics in terms of the quantum uncertainty principle.

Report

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

    (11 results)

All 2015 2014 Other

All Journal Article (5 results) (of which Peer Reviewed: 5 results,  Open Access: 2 results) Presentation (5 results) (of which Int'l Joint Research: 1 results,  Invited: 1 results) Remarks (1 results)

  • [Journal Article] Theoretical Study on Current-Voltage Characteristics of Oxygen Reduction Reaction near Platinum Surfaces2015

    • Author(s)
      Sawanya SUWANNAWONG, Kentaro DOI, and Satoyuki KAWANO
    • Journal Title

      International Journal of Chemical Engineering and Applications

      Volume: 6 Pages: 237-242

    • Related Report
      2015 Annual Research Report
    • Peer Reviewed / Open Access
  • [Journal Article] A Theoretical Model of Overpotential at Interfaces in Polymer Electrolyte Fuel Cells2015

    • Author(s)
      Kentaro DOI, Hiroki HASHIZUME, and Satoyuki KAWANO
    • Journal Title

      International Journal of Chemical Engineering and Applications

      Volume: 6 Pages: 243-249

    • Related Report
      2015 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Theoretical Study of Solvation Effect on Diffusion Coefficient of Li Ion in Propylene Carbonate2015

    • Author(s)
      Kentaro DOI, Yuzuru CHIKASAKO, and Satoyuki KAWANO
    • Journal Title

      Fluid Dynamics & Materials Processing

      Volume: -

    • Related Report
      2014 Research-status Report
    • Peer Reviewed
  • [Journal Article] Langevin Dynamics Study on Electrokinetic Transport of Long-Chained DNA through Nanogap Embedded in Nanochannel2015

    • Author(s)
      Kentaro DOI, Weixin QIAN, Satoshi UEHARA, Makusu TSUTSUI, Masateru TANIGUCHI, Tomoji KAWAI, and Satoyuki KAWANO
    • Journal Title

      International Journal of Emerging Multidisciplinary Fluid Sciences

      Volume: -

    • Related Report
      2014 Research-status Report
    • Peer Reviewed
  • [Journal Article] Theoretical Study of the Transpore Velocity Control of Single-Stranded DNA2014

    • Author(s)
      Weixin QIAN, Kentaro DOI, Satoshi UEHARA, Kaito MORITA, and Satoyuki KAWANO
    • Journal Title

      International Journal of Molecular Sciences

      Volume: 15 Issue: 8 Pages: 13817-13832

    • DOI

      10.3390/ijms150813817

    • Related Report
      2014 Research-status Report
    • Peer Reviewed / Open Access
  • [Presentation] Ionic and Quantum Sensing of Single Molecules in Liquids2015

    • Author(s)
      Kentaro DOI, Sawanya SUWANNAWONG, Weixin QIAN, Ayako YANO, Ryo NAGURA, and Satoyuki KAWANO
    • Organizer
      Twelfth International Conference on Flow Dynamics
    • Place of Presentation
      仙台国際センター(宮城県仙台市)
    • Year and Date
      2015-10-27
    • Related Report
      2015 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] イオン濃度によって遷移する荷電粒子周りの流動現象2015

    • Author(s)
      名倉諒,川嶋寛次,土井謙太郎,川野聡恭
    • Organizer
      日本機械学会 2015年度年次大会
    • Place of Presentation
      北海道大学(北海道札幌市)
    • Year and Date
      2015-09-13
    • Related Report
      2015 Annual Research Report
  • [Presentation] 細孔に誘起されるEHD流の定量的評価2015

    • Author(s)
      矢野絢子,土井謙太郎,川野聡恭
    • Organizer
      日本機械学会 2015年度年次大会
    • Place of Presentation
      北海道大学(北海道札幌市)
    • Year and Date
      2015-09-13
    • Related Report
      2015 Annual Research Report
  • [Presentation] Theoretical Study on Current-Voltage Characteristics of Oxygen Reduction Reaction near Platinum Surfaces2014

    • Author(s)
      Sawanya SUWANNAWONG, Kentaro DOI, and Satoyuki KAWANO
    • Organizer
      2014 3rd International Conference on Chemical Science and Engineering (ICCSE2014)
    • Place of Presentation
      Phuket, Thailand
    • Year and Date
      2014-12-27 – 2014-12-28
    • Related Report
      2014 Research-status Report
  • [Presentation] A Theoretical Model of Overpotential at Interfaces in Polymer Electrolyte Fuel Cells2014

    • Author(s)
      Kentaro DOI, Hiroki HASHIZUME, and Satoyuki KAWANO
    • Organizer
      2014 3rd International Conference on Chemical Science and Engineering (ICCSE2014)
    • Place of Presentation
      Phuket, Thailand
    • Year and Date
      2014-12-27 – 2014-12-28
    • Related Report
      2014 Research-status Report
  • [Remarks] 大阪大学 基礎工学研究科 機能創成専攻 川野研究室

    • URL

      http://bnf.me.es.osaka-u.ac.jp/

    • Related Report
      2015 Annual Research Report 2014 Research-status Report

URL: 

Published: 2014-04-04   Modified: 2017-05-10  

Information User Guide FAQ News Terms of Use Attribution of KAKENHI

Powered by NII kakenhi