Theories of Molecular Reaction Dynamics

- The Microscopic Foundation of Chemical Kinetics

af

indgår i serie Oxford Graduate Texts


Studiebog
Theories of Molecular Reaction Dynamics
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Format:
Bog, hardback
Udgivelsesdato:
15-11-2018
Sprog:
Engelsk
Udgave:
2nd Revised edition.
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This book deals with a central topic at the interface of chemistry and physics-the understanding of how the transformation of matter takes place at the atomic level. Building on the laws of physics, the book focuses on the theoretical framework for predicting the outcome of chemical reactions. The style is highly systematic with attention to basic concepts and clarity of presentation. The emphasis is on concepts and insights obtained via analytical theories ratherthan computational and numerical aspects.Molecular reaction dynamics is about the detailed atomic-level description of chemical reactions. Based on quantum mechanics and statistical mechanics, the dynamics of uni- and bi-molecular elementary reactions are described. The book features a comprehensive presentation of transition-state theory which plays an important role in practice, and a detailed discussion of basic theories of reaction dynamics in condensed phases. Examples and end-of-chapter problems are included in order toillustrate the theory and its connection to chemical problems.The second edition includes updated descriptions of adiabatic and non-adiabatic electron-nuclear dynamics, an expanded discussion of classical two-body models of chemical reactions, including the Langevin model, additional material on quantum tunnelling and its implementation in Transition-State Theory, and a more thorough description of the Born and Onsager models for solvation.

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Udgivelsesdato:
15-11-2018
ISBN13:
9780198805014
Vægt:
1033 g
Dybde:
28 mm
Bredde:
178 mm
Højde:
249 mm
Format:
Hardback
Forfattere
Bibliotekernes beskrivelse This book describes how chemical reactions take place at the atomic level and how one can calculate the rate of such reactions. The book features a systematic and comprehensive presentation of the subject with a wide range of examples and end-of-chapter problems.

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