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Bücher Englische Bücher Wissen & Bildung Naturwissenschaft, Medizin, Informatik, Technik Chemie Theoretische Chemie Collision Theory and Statistical Theory of Chemical Reactions
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Collision Theory and Statistical Theory of Chemical Reactions
S. G. Christov (Broschiert, Englisch)
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Beschreibung
Since the discovery of quantum mechanics,more than fifty years ago,the theory of chemical reactivity has taken the first steps of its development. The knowledge of the electronic structure and the properties of atoms and molecules is the basis for an un derstanding of their interactions in the elementary act of any chemical process. The increasing information in this field during the last decades… has stimulated the elaboration of the methods for evaluating the potential energy of the reacting systems as well as the creation of new methods for calculation of reaction probabili ties (or cross sections) and rate constants. An exact solution to these fundamental problems of theoretical chemistry based on quan tum mechanics and statistical physics, however, is still impossible even for the simplest chemical reactions. Therefore,different ap proximations have to be used in order to simplify one or the other side of the problem. At present, the basic approach in the theory of chemical reactivity consists in separating the motions of electrons and nu clei by making use of the Born-Oppenheimer adiabatic approximation to obtain electronic energy as an effective potential for nuclear motion. If the potential energy surface is known, one can calculate, in principle, the reaction probability for any given initial state of the system. The reaction rate is then obtained as an average of the reaction probabilities over all possible initial states of the reacting ~artic1es. In the different stages of this calculational scheme additional approximations are usually introduced. Dieses Produkt haben wir gerade leider nicht auf Lager.
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Technische Daten
Erscheinungsdatum
01.07.1980
Sprache
Englisch
EAN
9783540100126
Herausgeber
Springer Berlin
Serien- oder Bandtitel
Lecture Notes in Chemistry
Sonderedition
Nein
Autor
S. G. Christov
Seitenanzahl
322
Einbandart
Broschiert
Schlagwörter
Activation energy, Chemische Reaktion, Cross section, Quantenchemie, Reactions, chemistry, energy, heat, information, mechanics, molecule, physics, statistical physics, structure, theoretical chemistry
Thema-Inhalt
PNRP - Quanten- und theoretische Chemie
Höhe
244 mm
Breite
17 cm
Hersteller: Springer, Europaplatz 3, Heidelberg, Deutschland, 69115, ProductSafety@springernature.com, Springer Nature Customer Service Center GmbH
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