Quantum-chemical studies on porphyrins, fullerenes and carbon nanostructures

This book presents theoretical studies of electronic structure, optical and spectroscopic properties of a number of compounds such as porphyrins, fullerenes and heteroatomic single-wall nanotubes. The book presents new, faster calculation methods for application in quantum-chemical theory of electronic structures. It addresses issues of practical importance such as the development of materials for photosensitizers, organic LEDs and solar cells. INDICE: Porphyrins.- Exohedral Metallofullerenes.- Nonlinear optical properties of fullerene derivatives.- Enhohedral metallofullerenes.- Fullerene-Porphyrin Dyads.- Linear Scaling Methodology.

• ISBN: 978-3-642-31844-3
• Editorial: Springer
• Encuadernacion: Cartoné
• Fecha Publicación: 30/09/2012
• Nº Volúmenes: 1
• Idioma: Inglés