Cargando…
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 |
|---|---|
| Otros Autores: | , , |
| Formato: | Electrónico eBook |
| Idioma: | Inglés |
| Publicado: |
River Edge, N.J. ; London :
World Scientific,
2004.
|
| Colección: | Advanced series in physical chemistry ;
v. 15. |
| Temas: | |
| Acceso en línea: | Texto completo |
Tabla de Contenidos:
- 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.