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Title Conical intersections : electronic structure, dynamics & spectroscopy / editors : Wolfgang Domcke, David R. Yarkony, Horst Köppel
Published River Edge, N.J. ; London : World Scientific, 2004

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Description 1 online resource (xvii, 838 pages) : illustrations
Series Advanced series in physical chemistry ; v. 15
Advanced series in physical chemistry ; v. 15.
Contents pt. I. Fundamental concepts and electronic structure theory. Born-Oppenheimer approximation and beyond / L.S. Cederbaum -- Conical intersections : their description and consequences / D.R. Yarkony -- Determination of potential energy surface intersections and derivative couplings in the adiabatic representation / D.R. Yarkony -- Diabatic representation : methods for the construction of diabatic electronic states / H. Koppel -- Modeling and interpolation of global multi-sheeted potential energy surfaces / A.J.C. Varandas
pt. II. Conical intersections in photoinduced and collisional dynamics. A. Migani, M. Olivucci -- The multi-mode vibronic-coupling approach / H. Koppel, W. Domcke, L.S. Cederbaum -- Model studies of the dynamics at conical intersections / A. Lami, G. Villani -- Generic aspects of the dynamics at conical intersections : internal conversion, vibrational relaxation and photoisomerization / W. Domcke -- Jahn-Teller and pseudo-Jahn-Teller intersections : spectroscopy and vibronic dynamics / H. Koppel -- Quantum mechanical studies of photodissociation dynamics using accurate global potential energy surfaces / R. Schinke -- Geometric phase effects in chemical reaction dynamics / B.K. Kendrick -- Quantum reaction dynamics on coupled multi-sheeted potential energy surfaces / S. Mahapatra -- Multidimensional dynamics involving a conical intersection : wavepacket calculations using the MCTDH method / G.A. Worth, H.-D. Meyer, L.S. Cederbaum -- Mixed quantum-classical description of the dynamics at conical intersections / G. Stock, M. Thoss
Part III. Detection and control of chemical dynamics at conical intersections. Absorption, emission, and photoelectron continuous-wave spectra / A. Lami, C. Petrongolo, F. Santoro -- Femtosecond time-resolved spectroscopy of the dynamics at conical intersections / G. Stock, W. Domcke -- Nonadiabatic quantum dynamics and control strategies / R. de Vivie-Riedle, A. Hofmann
Summary It is widely recognized nowadays that conical intersections ofmolecular potential-energy surfaces play a key mechanistic role in thespectroscopy of polyatomic molecules, photochemistry and chemicalkinetics. This invaluable book presents a systematic exposition of thecurrent state of knowledge about conical intersections, which has beenelaborated in research papers scattered throughout the chemicalphysics literature
Bibliography Includes bibliographical references and index
Notes Print version record
Subject Spectrum analysis.
Laser spectroscopy.
Molecular dynamics.
Born-Oppenheimer approximation.
Spectrum Analysis
spectroscopy.
SCIENCE -- Chemistry -- Physical & Theoretical.
Born-Oppenheimer approximation
Laser spectroscopy
Molecular dynamics
Spectrum analysis
Fysische chemie.
Moleculaire spectrometrie.
Fotochemie.
Spectroscopie.
Spectroscopie laser.
Dynamique moléculaire.
Born-Oppenheimer, Approximation de.
Form Electronic book
Author Domcke, Wolfgang
Yarkony, David
Köppel, Horst
LC no. 2007273652
ISBN 9812565469
9789812565464
9789812386724
9812386726