Reaction Rate Theory and Rare Events

Book Reaction Rate Theory and Rare Events Cover

Download or read online Reaction Rate Theory and Rare Events PDF book by Baron Peters in ePUB, PDF or Kindle eBooks. Published by Elsevier in 22 March 2017 the book become immediate popular and critical acclaim in Technology & Engineering books with total hardcover page 634. Click Download Book button to get book file. Read some info about this book below.

  • Author : Baron Peters
  • Publisher : Elsevier
  • Release : 22 March 2017
  • ISBN : 9780444594709
  • Page : 634 pages
  • Language : English
  • Total View : 5644 Views
  • File Size : 48,9 Mb

Reaction Rate Theory and Rare Events Book PDF summary

Reaction Rate Theory and Rare Events bridges the historical gap between these subjects because the increasingly multidisciplinary nature of scientific research often requires an understanding of both reaction rate theory and the theory of other rare events. The book discusses collision theory, transition state theory, RRKM theory, catalysis, diffusion limited kinetics, mean first passage times, Kramers theory, Grote-Hynes theory, transition path theory, non-adiabatic reactions, electron transfer, and topics from reaction network analysis. It is an essential reference for students, professors and scientists who use reaction rate theory or the theory of rare events. In addition, the book discusses transition state search algorithms, tunneling corrections, transmission coefficients, microkinetic models, kinetic Monte Carlo, transition path sampling, and importance sampling methods. The unified treatment in this book explains why chemical reactions and other rare events, while having many common theoretical foundations, often require very different computational modeling strategies. Offers an integrated approach to all simulation theories and reaction network analysis, a unique approach not found elsewhere Gives algorithms in pseudocode for using molecular simulation and computational chemistry methods in studies of rare events Uses graphics and explicit examples to explain concepts Includes problem sets developed and tested in a course range from pen-and-paper theoretical problems, to computational exercises

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