Correlation and Localization

Name: Correlation and Localization
Brand: Springer-Verlag Berlin and Heidelberg GmbH & Co. KG
SKU: 9783540657545
Price: 4566 CZK
Availability: InStock

With Contributions by numerous experts

Autor: Peter R. Surjan

Jazyk:

Vazba: Pevná

Vydavatel: Springer-Verlag Berlin and Heidelberg GmbH & Co. KG

Dostupnost: Skladem u dodavatele

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This volume contains review and research articles in a field of quantum chemicalmethodology: the the...

Informace o knize

Autor

Peter R. Surjan

Jazyk

Angličtina

Vazba

Kniha - Pevná

Vydáno

1999

Stránek

236

EAN

9783540657545

ISBN

3540657541

Enbook ID

01566927

Vydavatel

Springer-Verlag Berlin and Heidelberg GmbH & Co. KG

Hmotnost

1180

Rozměry

156 x 234 x 18

Kompletní popis

This volume contains review and research articles in a field of quantum chemicalmethodology: the theory of electron correlation and the localization problem. Correlation energy (i.e., the energy beyond the Hartree-Fock) plays an important role in the theoretical description of several chemical processes (reactions, excitations, ionization) while localization in quantum chemistry usually emerges as a mathematical transformation of the wave function. The connection between these two issues is provided by the need to evaluate correlation energy for larger molecules, which is much easier in terms of localized contributions. The articles selected discuss copuled cluster, perturbational and geminal-based schemes, and cover wave function as well as density based approaches.

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Correlation and Localization

With Contributions by numerous experts

Informace o knize

Kompletní popis

Mohlo by vás zajímat

Zákaznicí kteří koupili tuto knihu koupili také