A Mechanical String Model of Adiabatic Chemical Reactions

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Author:Kliesch, Wolfgang
Date of Publication: 1998
Book classification:Education,English Books,
No. of pages:140 Pages
Format:Paperback

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About this Product

The main subjects are:
- a comprehensive mathematical description of molecular systems,
- a new reaction path concept,
- an algorithm for following the reaction path.
The reaction paths tangent is determined by an excitation vector and the saddle points surrounding a minimizer can be localized without further information. A procedure appropriate to trace these reaction paths is presented.
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Specifications

SKU9783540649786
Manufacturer Number9783540649786
year published1998
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