Ab initio molecular dynamics: basic theory and advanced methods
Auteur :
Marx, Dominik / Hutter, Jürg
Éditeur :
Cambridge University Press
ISBN :
9780521898638
Date de publication :
30 avr. 2009
Dimensions :
25,3 x 17,9 x 3,0 cm
Poids :
1280 g
Langue :
Anglais
Pays d'origine :
Grande Bretagne
Providing the first coherent presentation of this rapidly growing field, this book covers a range of methods and their applications. Ideal for graduate students and researchers, it contains pseudo-code and program layout for typical plane wave electronic structure codes, allowing readers to improve and add new features in their code.