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The Reaction Path in Chemistry: Current Approaches and Perspectives by D. Heidri
AU $291.01
ApproximatelyS$ 245.01
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Brand New
A new, unread, unused book in perfect condition with no missing or damaged pages.
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Located in: Melbourne, Australia
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eBay item number:156980234159
Item specifics
- Condition
- Brand New: A new, unread, unused book in perfect condition with no missing or damaged pages. See all condition definitionsopens in a new window or tab
- ISBN-13
- 9789048145867
- Book Title
- The Reaction Path in Chemistry: Current Approaches and Perspectiv
- ISBN
- 9789048145867
About this product
Product Information
The reaction pathway (RP) technique is a powerful tool in theoretical chemistry and chemical reaction theory. The present book discusses the background of the concept, both mathematical and physical, and outlines new developments. Different approaches to the RP are described, with particular emphasis on gradient extremals and the treatment of zero eigenvalues of rotation in the Cartesian Hessian matrix along the RP. There is an excellent review of geometric optimization methods, together with an outline of density functional theory. Some contributions reveal the progress made in interface dynamics calculations based on RP potentials and tunnelling with electronic structure theory ('direct dynamics'). Includes the very latest results in excited-state RP calculations (H transfer) and a theoretical view of the RPs of photodissociation processes using time-resolved femtosecond spectroscopy. The passage from the RP to the reaction mechanism is described by means of fundamental groups and symmetry rules. Audience: Researchers in theoretical chemistry, molecular modeling, physical chemistry, kinetics, and the biosciences.
Product Identifiers
Publisher
Springer
ISBN-13
9789048145867
eBay Product ID (ePID)
178388270
Product Key Features
Number of Pages
300 Pages
Language
English
Publication Name
The Reaction Path in Chemistry: Current Approaches and Perspectives
Publication Year
2010
Subject
Engineering & Technology, Chemistry
Type
Textbook
Format
Paperback
Dimensions
Item Height
235 mm
Item Weight
480 g
Item Width
155 mm
Volume
16
Additional Product Features
Editor
D. Heidrich
Country/Region of Manufacture
Netherlands
Series Title
Understanding Chemical Reactivity
Item description from the seller
Seller business information
VAT number: AU 82107909133, GB 293967539
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Seller feedback (1,461,899)
- i***s (562)- Feedback left by buyer.Past monthVerified purchaseBeautiful product and great quality
- i***s (562)- Feedback left by buyer.Past monthVerified purchaseBeautiful product
- e***9 (575)- Feedback left by buyer.Past monthVerified purchaseReally pleased with this item and such quick delivery