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Conical Intersections : Electronic Structure, Dynamics & Spectroscopy.
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...
| Clasificación: | Libro Electrónico |
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| Autor principal: | |
| Otros Autores: | , |
| Formato: | Electrónico eBook |
| Idioma: | Inglés |
| Publicado: |
Singapore :
World Scientific,
2004.
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| Edición: | 15th ed. |
| Temas: | |
| Acceso en línea: | Texto completo |
Tabla de Contenidos:
- Introduction; Preface; Historical Introduction J. Michl; CONTENTS; 1. Born-Oppenheimer Approximation and Beyond L.S. Cederbaum; 2. Conical Intersections: Their Description and Consequences D.R. Yarkony; 3. Determination of Potential Energy Surface Intersections and Derivative Couplings in the Adiabatic Representation D.R. Yarkony; 4. Diabatic Representation: Methods for the Construction of Diabatic Electronic States H. Koppel; 5. Modeling and Interpolation of Global Multi-Sheeted Potential Energy Surfaces A.J.C. Varandas.
- 6. Conical Intersections and Organic Reaction Mechanisms A. Migani and M. Olivucci7. The Multi-Mode Vibronic-Coupling Approach H. Koppel, W. Domcke and L.S. Cederbaum; 8. Model Studies of the Dynamics at Conical Intersections A. Lami and G. Villani; 9. Generic Aspects of the Dynamics at Conical Intersections: Internal Conversion, Vibrational Relaxation and Photoisomerization W. Domcke; 10. Jahn-Teller and Pseudo-Jahn-Teller Intersections: Spectroscopy and Vibronic Dynamics H.K.