Buch, Englisch, 536 Seiten, Format (B × H): 170 mm x 244 mm, Gewicht: 924 g
Reihe: Oxford Graduate Texts
Concepts and Applications
Buch, Englisch, 536 Seiten, Format (B × H): 170 mm x 244 mm, Gewicht: 924 g
Reihe: Oxford Graduate Texts
ISBN: 978-0-19-884193-7
Verlag: OXFORD UNIV PR
Time-dependent density-functional theory (TDDFT) describes the quantum dynamics of interacting electronic many-body systems formally exactly and in a practical and efficient manner. TDDFT has become the leading method for calculating excitation energies and optical properties of large molecules, with accuracies that rival traditional wave-function based methods, but at a fraction of the computational cost.
This book is the first graduate-level text on the concepts and applications of TDDFT, including many examples and exercises, and extensive coverage of the literature.
The book begins with a self-contained review of ground-state DFT, followed by a detailed and pedagogical treatment of the formal framework of TDDFT. It is explained how excitation energies can be calculated from linear-response TDDFT. Among the more advanced topics are time-dependent current-density-functional theory, orbital functionals, and many-body theory. Many applications are discussed, including molecular excitations, ultrafast and strong-field phenomena, excitons in solids, van der
Waals interactions, nanoscale transport, and molecular dynamics.
Autoren/Hrsg.
Fachgebiete
- Technische Wissenschaften Maschinenbau | Werkstoffkunde Technische Mechanik | Werkstoffkunde
- Naturwissenschaften Physik Thermodynamik Festkörperphysik, Kondensierte Materie
- Naturwissenschaften Biowissenschaften Biochemie (nichtmedizinisch)
- Naturwissenschaften Biowissenschaften Angewandte Biologie Biophysik
- Naturwissenschaften Physik Angewandte Physik Biophysik
- Naturwissenschaften Physik Quantenphysik Atom- und Molekülphysik
- Naturwissenschaften Physik Angewandte Physik Chemische Physik
- Naturwissenschaften Chemie Physikalische Chemie
