Electronic structure calculations for solids and molecules: theory and computational methods
Auteur :
Kohanoff, Jorge
Éditeur :
Cambridge University Press
ISBN :
9780521815918
Date de publication :
29 juin 2006
Dimensions :
24,4 x 17,0 x 2,2 cm
Poids :
790 g
Langue :
Anglais
Pays d'origine :
Grande Bretagne
This 2006 textbook for graduate students in physics and chemistry describes the theoretical approaches and computational techniques for studying the behavior of electrons. The first part covers the theoretical methods, including both density-functional theory and Hartree-Fock theory and the latter part discusses the different computational methods.