Theoretical Models in High Pressure Reaction Kinetics:from Empirical Correlations to Molecular Dynamics (特集 有機反応と高圧力) Theoretical Models in High Pressure Reaction Kinetics : from Empirical Correlations to Molecular Dynamics

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抄録

A variety of theoretical methods is currently available for the analysis of the effects of high pressures on reaction kinetics, ranging from simple empirical correlations to sophisticated molecular dynamics simulations. Most of them operate within the framework of the transition state theory where the concept of activation volume naturally emerges as the pressure derivative of the activation Gibbs energy. Different models of activation volumes are discussed, as well as the effects of high pressures on reaction profiles, temperature-dependent effects of high pressures, and effects of equilibrium and nonequilibrium solvation.

収録刊行物

  • 高圧力の科学と技術 = The Review of high pressure science and technology  

    高圧力の科学と技術 = The Review of high pressure science and technology 8(2), 86-95, 1998-05-20 

    The Japan Society of High Pressure Science and Technology

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各種コード

  • NII論文ID(NAID)
    10002849007
  • NII書誌ID(NCID)
    AN10452913
  • 本文言語コード
    ENG
  • 資料種別
    ART
  • ISSN
    0917639X
  • NDL 記事登録ID
    4482033
  • NDL 雑誌分類
    ZP1(科学技術--化学・化学工業)
  • NDL 請求記号
    Z17-1589
  • データ提供元
    CJP書誌  NDL  J-STAGE 
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