Chemist's guide to density functional theory, a
Auteur :
Koch, Wolfram / Holthausen, Max C.
Éditeur :
Wiley-VCH Verlag GmbH
ISBN :
9783527303724
Date de publication :
30 juil. 2001
Dimensions :
24,6 x 17,2 x 1,7 cm
Poids :
620 g
Langue :
Anglais
Pays d'origine :
Allemagne
Many use Density Functional Theory (DFT) programs as black-box tools without having a quantum theoretical background or a concise knowledge about the strength and weaknesses of this approach. This text is designed to bridge the gap and to guide the non-expert user.