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Quantum Monte-Carlo programming : for atoms, molecules, clusters, and solids

Author: Wolfgang Schattke; Ricardo Díez Muiño
Publisher: Weinheim an der Bergstrasse, Germany : Wiley-VCH, ©2013.
Edition/Format:   eBook : Document : German
Summary:

Quantum Monte Carlo is a large class of computer algorithms that simulate quantum systems to solve many body systems in order to investigate the electronic structure of many-body systems. This book  Read more...

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Genre/Form: Electronic books
Material Type: Document, Internet resource
Document Type: Internet Resource, Computer File
All Authors / Contributors: Wolfgang Schattke; Ricardo Díez Muiño
ISBN: 9783527408511 3527408517 9783527675746 3527675744
OCLC Number: 857080171
Description: 1 online resource (xii, 279 pages) : illustrations, graphs
Contents: A first monte-carlo example Variational Quantum-Monte-Carlo for a One-Electron System Two electrons with two adiabatically decoupled nuclei: Hydrogen molecule Three electrons: Lithium Atom Many- electron confined systems Many- electron atomic aggregates: Lithium cluster Infinite number of electrons: Lithium solid Diffusion quantum Monte- Carlo (DQMC)
Responsibility: Wolfgang Schattke and Ricardo Díez Muiño.

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"The combination of both aspects allows the reader to assimilate the fundamentals of Quantum Monte Carlo not only by reading but also by practice." (ETDE Energy Database, 1 November 2013)

 
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