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Properties of Chemically Interesting Potential Energy Surfaces by Wolfgang Kliesch
Properties of Chemically Interesting Potential Energy Surfaces by Wolfgang Kliesch
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Properties of Chemically Interesting Potential Energy Surfaces

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Description

Contemporary chemical reaction theory is the characterization of Potential Energy Hypersurfaces (PES). The authors critically analyze chemically and mathematically suitable reaction path definitions. The book presents a simple mathematical analysis of stationary and critical points of the PES. It provides tools for studying chemical reactions by calculating reaction paths and related curves. A further aspect of the book is the dependence of PES properties on approximations used for the analysis. Recent quantum chemical calculations, particularly of single proton transfer processes, and experimental data are compared. The book addresses students and researchers in Theoretical Chemistry, Chemical Kinetics and related fields.
Release date Australia
August 7th, 1991
Audiences
  • Postgraduate, Research & Scholarly
  • Professional & Vocational
Edition
Softcover reprint of the original 1st ed. 1991
Illustrations
45 Illustrations, black and white; VIII, 183 p. 45 illus.
Pages
183
Dimensions
170x242x11
ISBN-13
9783540542865
Product ID
14261786

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