An edition of Beyond Born-Oppenheimer (2006)

Beyond Born-Oppenheimer

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Last edited by MARC Bot
July 22, 2019 | History
An edition of Beyond Born-Oppenheimer (2006)

Beyond Born-Oppenheimer

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INTRODUCING A POWERFUL APPROACH TO DEVELOPING RELIABLE QUANTUM MECHANICAL TREATMENTS OF A LARGE VARIETY OF PROCESSES IN MOLECULAR SYSTEMS. The Born-Oppenheimer approximation has been fundamental to calculation in molecular spectroscopy and molecular dynamics since the early days of quantum mechanics. This is despite well-established fact that it is often not valid due to conical intersections that give rise to strong nonadiabatic effects caused by singular nonadiabatic coupling terms (NACTs). In Beyond Born-Oppenheimer, Michael Baer, a leading authority on molecular scattering theory and electronic nonadiabatic processes, addresses this deficiency and introduces a rigorous approach--diabatization--for eliminating troublesome NACTs and deriving well-converged equations to treat the interactions within and between molecules. Concentrating on both the practical and theoretical aspects of electronic nonadiabatic transitions in molecules, Professor Baer uses a simple mathematical language to rigorously eliminate the singular NACTs and enable reliable calculations of spectroscopic and dynamical cross sections. He presents models of varying complexity to illustrate the validity of the theory and explores the significance of the study of NACTs and the relationship between molecular physics and other fields in physics, particularly electrodynamics. The first book of its king Beyond Born-Oppenheimer: Presents a detailed mathematical framework to treat electronic NACTs and their conical intersections Describes the Born-Oppenheimer treatment, including the concepts of adiabatic and diabatic frameworks Introduces a field-theoretical approach to calculating NACTs, which offers an alternative to time-consuming ab initio procedures Discusses various approximations for treating a large system of diabatic Schr?dinger equations Presents numerous exercises with solutions to further clarify the material being discussed Beyond Born-Oppenheimer is required reading for physicists, physical chemists, and all researchers involved in the quantum mechanical study of molecular systems.

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Cover of: Beyond Born-Oppenheimer
Cover of: Beyond Born-Oppenheimer
Beyond Born-Oppenheimer
2006, John Wiley & Sons, Ltd.
Electronic resource in English
Cover of: Beyond Born-Oppenheimer

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Edition Notes

Published in
New York

Classifications

Library of Congress
QD96.M65B34 2006

The Physical Object

Format
Electronic resource

ID Numbers

Open Library
OL24246223M
Internet Archive
beyondbornoppenh00baer
ISBN 13
9780471780076
OverDrive
B5B62E71-989B-4C6E-9F90-0187BF1AC907

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July 22, 2019 Edited by MARC Bot remove fake subjects
December 5, 2010 Edited by Open Library Bot Added subjects from MARC records.
June 16, 2010 Edited by ImportBot add missing OverDrive subject
June 16, 2010 Edited by ImportBot add details from OverDrive
December 10, 2009 Created by WorkBot add works page