Density Functional Theory of Molecules, Clusters, and Solids by De Ellis

Density Functional Theory of Molecules, Clusters, and Solids by De Ellis

Rapid advances are taking place in the application of density functional theory (DFT) to describe complex electronic structures, to accurately treat large systems and to predict physical and chemical properties. Both theoretical content and computational methodology are developing at a pace which offers researchers new opportunities in areas such as quantum chemistry, cluster science, and solid state physics. This volume contains ten contributions by leading scientists in the field and provides an authoritative overview of the most important developments. The book focuses on the following themes: determining adequate approximations for the many-body problem of electronic correlations; how to transform these approximations into computational algorithms; applications to discover and predict properties of electronic systems; and developing the theory. For researchers in surface chemistry, catalysis, ceramics and inorganic chemistry.

SKU	Nicht verfügbar
ISBN 13	9789401042185
ISBN 10	9401042187
Titel	Density Functional Theory of Molecules, Clusters, and Solids
Autor	De Ellis
Serie	Understanding Chemical Reactivity
Buchzustand	Nicht verfügbar
Bindungsart	Paperback
Verlag	Springer
Erscheinungsjahr	2012-11-05
Seitenanzahl	320
Hinweis auf dem Einband	Die Abbildung des Buches dient nur Illustrationszwecken, die tatsächliche Bindung, das Cover und die Auflage können sich davon unterscheiden.
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