E-Book, Englisch, Band 14, 560 Seiten, E-Book
Lipkowitz / Boyd Reviews in Computational Chemistry / Reviews in Computational Chemistry, Volume 14
1. Auflage 2009
ISBN: 978-0-470-12618-9
Verlag: John Wiley & Sons
Format: PDF
Kopierschutz: 0 - No protection
E-Book, Englisch, Band 14, 560 Seiten, E-Book
Reihe: Reviews in Computational Chemistry
ISBN: 978-0-470-12618-9
Verlag: John Wiley & Sons
Format: PDF
Kopierschutz: 0 - No protection
THIS VOLUME, WHICH IS DESIGNED FOR STAND-ALONE USE IN TEACHING ANDRESEARCH, FOCUSES ON QUANTUM CHEMISTRY, AN AREA OF SCIENCE THATMANY CONSIDER TO BE THE CENTRAL CORE OF COMPUTATIONAL CHEMISTRY.TUTORIALS AND REVIEWS COVER
* HOW TO OBTAIN SIMPLE CHEMICAL INSIGHT AND CONCEPTS FROM DENSITYFUNCTIONAL THEORY CALCULATIONS,
* HOW TO MODEL PHOTOCHEMICAL REACTIONS AND EXCITED STATES,AND
* HOW TO COMPUTE ENTHALPIES OF FORMATION OF MOLECULES.
* A FOURTH CHAPTER TRACES CANADIAN RESEARCH IN THE EVOLUTION OFCOMPUTATIONAL CHEMISTRY.
* ALSO INCLUDED WITH THIS VOLUME IS A SPECIAL TRIBUTE TO QCPE. FROMREVIEWS OF THE SERIES
"Reviews in Computational Chemistry proves itself an invaluableresource to the computational chemist. This series has a place inevery computational chemist's library."-JOURNAL OF THE AMERICANCHEMICAL SOCIETY
Autoren/Hrsg.
Weitere Infos & Material
The Pluses and Minuses of Mapping Atomic Charges to ElectrostaticPotentials (M. Francl & L. Chirlian).
An Introduction to Coupled Cluster Theory for ComputationalChemists (T. Crawford & H. Schaefer).
Introduction to Zeolite Modeling (B. van de Graaf, et al.).
Towards More Accurate Model Intermolecular Potentials for OrganicMolecules (S. Price).
Nonequilibrium Molecular Dynamics (C. Mundy, et al.).
History of the Gordon Research Conferences on ComputationalChemistry (D. Boyd & K. Lipkowitz).
Appendix.
Indexes.
