Dealing with density functional theory, this work covers topics such as quantum-mechanical interpretation of density functional theory, and application of density functional theory to the calculation of force fields and vibrational frequencies of transition metal complexes.
Reihe
Sprache
Verlagsort
Verlagsgruppe
Zielgruppe
Für Beruf und Forschung
Research
Illustrationen
13
13 s/w Abbildungen
XVIII, 182 p. 13 illus.
Maße
Höhe: 23.5 cm
Breite: 15.5 cm
Gewicht
ISBN-13
978-3-540-61132-5 (9783540611325)
DOI
Schweitzer Klassifikation
Quantum-mechanical interpretation of density functional theory.- Application of density functional theory to the calculation of force fields and vibrational frequencies of transition metal complexes.- Structure and spectroscopy of small atomic clusters.- Density functional theory of clusters of nontransition metals using simple models.