Computational methods for large systems electronic structure approaches for biotechnology and nanotechnology /

"While its results normally complement the information obtained by chemical experiments, computer computations can in some cases predict unobserved chemical phenomena Electronic-Structure Computational Methods for Large Systems gives readers a simple description of modern electronic-structure t...

Ausführliche Beschreibung

Gespeichert in:
Bibliographische Detailangaben
Körperschaft: ebrary, Inc
Weitere Verfasser: Reimers, Jeffrey R.
Format: Elektronisch E-Book
Sprache:Englisch
Veröffentlicht: Hoboken, N.J. : Wiley, 2011.
Schlagworte:
Online-Zugang:An electronic book accessible through the World Wide Web; click to view
Tags: Tag hinzufügen
Keine Tags, Fügen Sie den ersten Tag hinzu!
Inhaltsangabe:
  • A. DFT : the basic workhorse
  • B. Higher-accuracy methods
  • C. More-economical methods
  • D. Advanced applications.