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Quantum-chemical studies on Porphyrins, Fullerenes and Carbon Nanostructures

by Loboda, Oleksandr.
Authors: SpringerLink (Online service) Series: Carbon Nanostructures, 2191-3005 Physical details: XVIII, 151 p. 63 illus., 16 illus. in color. online resource. ISBN: 3642318452 Subject(s): Chemistry, Physical organic. | Nanotechnology. | Materials Science. | Nanotechnology. | Physical Chemistry. | Nanoscale Science and Technology.
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E-Book E-Book AUM Main Library 620.115 (Browse Shelf) Not for loan

Porphyrins -- Exohedral Metallofullerenes -- Nonlinear optical properties of fullerene derivatives -- Enhohedral metallofullerenes -- Fullerene-Porphyrin Dyads -- Linear Scaling Methodology.

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.

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