Quantum Chemistry of Solids: Lcao Treatment of Crystals and Nanostructures

Name: Quantum Chemistry of Solids: Lcao Treatment of Crystals and Nanostructures
Price: 125.4 USD
Availability: InStock
ISBN: 9783642303555

ISBN-10: 3642303552

ISBN-13: 9783642303555

Edition: 2012

Authors: R. A. Evarestov

List price: $229.00

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Description:

Quantum Chemistry of Solids delivers a comprehensive account of the main features and possibilities of LCAO methods for the first principles calculations of electronic structure of periodic systems. The first part describes the basic theory underlying the LCAO methods applied to periodic systems and the use of Hartree-Fock(HF), Density Function theory(DFT) and hybrid Hamiltonians. The translation and site symmetry consideration is included to establish connection between k-space solid -state physics and real-space quantum chemistry. The inclusion of electron correlation effects for periodic systems is considered on the basis of localized crystalline orbitals. The possibilities of LCAO…

Book details

List price: $229.00
Copyright year: 2012
Publisher: Textstream
Binding: Cloth Text
Pages: 650
Size: 6.50" wide x 9.75" long x 1.60" tall
Weight: 2.596
Language: English