Conical Intersections: Theory, Computation And Experiment

Conical Intersections: Theory, Computation And Experiment
Author :
Publisher : World Scientific
Total Pages : 769
Release :
ISBN-10 : 9789814397933
ISBN-13 : 9814397938
Rating : 4/5 (938 Downloads)

Book Synopsis Conical Intersections: Theory, Computation And Experiment by : Michael S Schuurman

Download or read book Conical Intersections: Theory, Computation And Experiment written by Michael S Schuurman and published by World Scientific. This book was released on 2011-11-04 with total page 769 pages. Available in PDF, EPUB and Kindle. Book excerpt: The concept of adiabatic electronic potential-energy surfaces, defined by the Born-Oppenheimer approximation, is fundamental to our thinking about chemical processes. Recent computational as well as experimental studies have produced ample evidence that the so-called conical intersections of electronic energy surfaces, predicted by von Neumann and Wigner in 1929, are the rule rather than the exception in polyatomic molecules. It is nowadays increasingly recognized that conical intersections play a key mechanistic role in chemical reaction dynamics. This volume provides an up-to-date overview of the multi-faceted research on the role of conical intersections in photochemistry and photobiology, including basic theoretical concepts, novel computational strategies as well as innovative experiments. The contents and discussions will be of value to advanced students and researchers in photochemistry, molecular spectroscopy and related areas.


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