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2010 Fiscal Year Final Research Report

Molecular modeling of dynamics of entangled branch polymers

Research Project

  • PDF
Project/Area Number 20340111
Research Category

Grant-in-Aid for Scientific Research (B)

Allocation TypeSingle-year Grants
Section一般
Research Field Biophysics/Chemical physics
Research InstitutionKyoto University

Principal Investigator

MASUBUCHI Yuichi  Kyoto University, 化学研究所, 准教授 (40291281)

Co-Investigator(Kenkyū-buntansha) WATANABE Hiroshi  京都大学, 化学研究所, 教授 (90167164)
MATSUMIYA Yumi  京都大学, 化学研究所, 助教 (00378853)
Project Period (FY) 2008 – 2010
Keywordsソフトマターの物理 / シミュレーション / 高分子
Research Abstract

Dynamics of branch polymers is an important subject not only in polymer science but also in industry to design processability of materials. In this study we applied our coarse-grained molecular simulation to branch polymers to evaluate the model and to investigate the dynamics around branch point. The simulation realized quantitative predictions on linear and non-linear viscoelasticity of branch polymers and showed significance of dynamic tube dilation around branch point.

  • Research Products

    (24 results)

All 2011 2010 2009 2008

All Journal Article (8 results) (of which Peer Reviewed: 8 results) Presentation (15 results) Book (1 results)

  • [Journal Article] Primitive Chain Network Simulations for Asymmetric Star Polymers2011

    • Author(s)
      Y.Masubuchi, T.Yaoita, Y.Matsumiya, H.Watanabe
    • Journal Title

      J.Chem. Phys in print

    • Peer Reviewed
  • [Journal Article] Primitive Chain Network Simulations for Comb-Branched Polymer under Step Shear Deformations2011

    • Author(s)
      Y.Masubuchi, Y.Matsumiya, H.Watanabe, S.Shiromoto, M.Tsutsubuchi, Y.Togawa
    • Journal Title

      Rheo.Acta in print

    • Peer Reviewed
  • [Journal Article] Chain contraction and nonlinear stress damping in primitive chain network simulations2010

    • Author(s)
      K.Furuichi, C.Nonomura, Y.Masubuchi, H.Watanabe
    • Journal Title

      J Chem Phys 133

      Pages: [174902]1-10

    • Peer Reviewed
  • [Journal Article] Primitive chain network simulations for entangled DNA solutions2009

    • Author(s)
      Y.Masubuchi, K.Furuichi, K.Horio, T.Uneyama, H.Watanabe, G.Ianniruberto, F.Greco, G.Marrucci
    • Journal Title

      J.Chem.Phys. 131

      Pages: 114906

    • URL

      http://hdl.handle.net/2433/109329

    • Peer Reviewed
  • [Journal Article] Quantitative comparison of primitive chain network simulations with literature data of linear viscoelasticity for polymer melts2008

    • Author(s)
      Y.Masubuchi, G.Ianniruberto, F.Greco, G.Marrucci
    • Journal Title

      J.Non-Newtonian FluidMech. 149(1-3)

      Pages: 87-92

    • Peer Reviewed
  • [Journal Article] Comparison among Slip-Link Simulations of Bidisperse Linear Polymer Melts2008

    • Author(s)
      Y.Masubuchi, H.Watanabe, G.Ianniruberto, F.Greco, G.Marrucci
    • Journal Title

      Macromolecules 41(21)

      Pages: 8275-8280

    • Peer Reviewed
  • [Journal Article] Viscoelastic and Dielectric Relaxation of a Cayley-Tree-Type Polyisoprene : Test of Molecular Picture of Dynamic Tube Dilation2008

    • Author(s)
      H.Watanabe, Y.Matsumiya, E.van, Ruymbeke, D.Vlassopoulos, N.Hadjichristidis
    • Journal Title

      Macromolecules 41

      Pages: 6110-6124

    • Peer Reviewed
  • [Journal Article] Primitive Chain Network Simulations for Bidisperse Linear Polymers Int.2008

    • Author(s)
      Y.Masubuchi, G.Ianniruberto, F.Greco, G.Marrucci
    • Journal Title

      J.Nano Adv.Eng.Mat. Part A.1(1)

      Pages: 35-40

    • Peer Reviewed
  • [Presentation] 粗視化シミュレーションにおける分岐高分子の緩和と分岐点の運動2011

    • Author(s)
      増渕雄一
    • Organizer
      第59回高分子討論会
    • Place of Presentation
      北海道大学(札幌)
    • Year and Date
      2011-09-15
  • [Presentation] 分子シミュレーションによる高分子の溶融物性予測2011

    • Author(s)
      増渕雄一
    • Organizer
      化学工学会第42回秋季大会
    • Place of Presentation
      同志社大学(京都)(招待講演)
    • Year and Date
      2011-09-07
  • [Presentation] 高分子の溶融状態におけるからみあいと粘弾性物性2010

    • Author(s)
      増渕雄一
    • Organizer
      第18回日本ポリイミド・芳香族系高分子研究会
    • Place of Presentation
      東京工科大学(東京)(招待講演)
    • Year and Date
      2010-11-26
  • [Presentation] Chain Dynamics in a Modified Primitive Chain Network Model with Uncoupled Sliplinks2010

    • Author(s)
      Y.Masubuchi, T.Uneyama, H.Watanabe
    • Organizer
      5th Pacific Rim Conference on Rheology
    • Place of Presentation
      Sapporo, Japan.
    • Year and Date
      2010-08-03
  • [Presentation] Multi-scale simulations for entangled polymers utilizing primitive chain network simulations2010

    • Author(s)
      増渕雄一
    • Organizer
      MACRO2010 43rd IUPAC World Polymer Congress, July 15
    • Place of Presentation
      Grasgow, UK.
    • Year and Date
      2010-07-15
  • [Presentation] Multi-scale simulations with primitive chain network model for entangled polymers2009

    • Author(s)
      増渕雄一
    • Organizer
      SCHOOL AND CONFERENCE ON MULTISCALE MODELING AND SIMULATIONS OF HARD AND SOFT MATERIALS
    • Place of Presentation
      Bangalore, India.(招待講演)
    • Year and Date
      2009-12-17
  • [Presentation] 高分子液体の高速分子シミュレーション法2009

    • Author(s)
      増渕雄一
    • Organizer
      第23回分子シミュレーション討論会
    • Place of Presentation
      吹上ホール(名古屋)(招待講演)
    • Year and Date
      2009-12-01
  • [Presentation] からみあい高分子ダイナミクスのシミュレーション2009

    • Author(s)
      増渕雄一
    • Organizer
      第24回中国四国地区高分子若手研究会
    • Place of Presentation
      あわぎんホール(徳島)(招待講演)
    • Year and Date
      2009-11-13
  • [Presentation] Primitive Chain Network Simulations for Entangled Polymer Dynamics2009

    • Author(s)
      増渕雄一
    • Organizer
      3rd NU-UM Joint Symposiumon on Supramacromolecular Material Science and Engineering in the 21st Century
    • Place of Presentation
      Nagoya, Japan(招待講演)
    • Year and Date
      2009-11-12
  • [Presentation] 粗視化分子シミュレーションによる高分子の長時間ダイナミクスの可視化2009

    • Author(s)
      増渕雄一
    • Organizer
      化学工学会第41回秋季大会
    • Place of Presentation
      広島大学(東広島)(招待講演)
    • Year and Date
      2009-09-18
  • [Presentation] 高分子の運動とレオロジー2009

    • Author(s)
      増渕雄一
    • Organizer
      第19回東海ミニシンポジウム
    • Place of Presentation
      豊田中央研究所(長久手町)(招待講演)
    • Year and Date
      2009-09-07
  • [Presentation] からみあい高分子のシミュレーション2009

    • Author(s)
      増渕雄一
    • Organizer
      第47回高分子材料自由討論会
    • Place of Presentation
      ホテル竹島(蒲郡)(招待講演)
    • Year and Date
      2009-07-06
  • [Presentation] Molecular Simulations for Entangled Polymer Dynamics2008

    • Author(s)
      増渕雄一
    • Organizer
      The 3rd International Symposium on Polymer Science, Nagoya Univ.
    • Place of Presentation
      Nagoya, Japan(招待講演)
    • Year and Date
      2008-11-10
  • [Presentation] Molecular simulations of polymers with primitive chain network model2008

    • Author(s)
      増渕雄一
    • Organizer
      MSSMBS2008
    • Place of Presentation
      Dubna, Russia(招待講演)
    • Year and Date
      2008-09-12
  • [Presentation] A Model for Molecular Simulations of Entangled Polymer Systems2008

    • Author(s)
      増渕雄一
    • Organizer
      ATEMA-AES 2008
    • Place of Presentation
      Cesena, Italy(招待講演)
    • Year and Date
      2008-09-02
  • [Book] おもしろレオロジー2010

    • Author(s)
      増渕雄一
    • Total Pages
      239
    • Publisher
      技術評論社

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Published: 2012-01-26   Modified: 2016-04-21  

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