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The Reaction Path Method for Chemical Reactions

Conference paper
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Part of the Lecture Notes in Chemistry book series (LNC, volume 77)

Summary

The reaction path method is a selfcontained approximate theory which allows an analysis of complex chemical reactions and the calculation of state resolved reaction rate-constants using information on gradients and hessians of the nuclear potential energy surface.

Keywords

Saddle Point Reaction Path Coupling Term Transition State Theory Reference Vector 
These keywords were added by machine and not by the authors. This process is experimental and the keywords may be updated as the learning algorithm improves.

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Copyright information

© Springer-Verlag Berlin Heidelberg 2001

Authors and Affiliations

  1. 1.H. C. Ørsted InstituteUniversity of CopenhagenCopenhagen ØDenmark

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