Calculations on nonlinear optical properties for large systems - The elongation method (Paperback, 2015 ed.)

For design purposes one needs to relate the structure of proposed materials to their NLO (nonlinear optical) and other properties, which is a situation where theoretical approaches can be very helpful in providing suggestions for candidate systems that subsequently can be synthesized and studied experimentally. This brief describes the quantum-mechanical treatment of the response to one or more external oscillating electric fields for molecular and macroscopic, crystalline systems. To calculate NLO properties of large systems, a linear scaling generalized elongation method for the efficient and accurate calculation is introduced. The reader should be aware that this treatment is particularly feasible for complicated three-dimensional and/or delocalized systems that are intractable when applied to conventional or other linear scaling methods.

General

Imprint:	Springer International Publishing AG
Country of origin:	Switzerland
Series:	SpringerBriefs in Electrical and Magnetic Properties of Atoms, Molecules, and Clusters
Release date:	December 2014
First published:	2015
Authors:	Feng Long Gu • Yuriko Aoki • Michael Springborg • Bernard Kirtman
Dimensions:	235 x 155 x 6mm (L x W x T)
Format:	Paperback
Pages:	93
Edition:	2015 ed.
ISBN-13:	978-3-319-11067-7
Categories:	Books > Science & Mathematics > Physics > Optics (light) Books > Professional & Technical > Technology: general issues > Nanotechnology Books > Science & Mathematics > Chemistry > Physical chemistry > Quantum & theoretical chemistry Books > Science & Mathematics > Biology, life sciences > Biochemistry > Proteins
LSN:	3-319-11067-5
Barcode:	9783319110677

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