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Time Dependent Density Functional Theory Concepts and Applications Oxford Graduate Texts

by [Ullrich, Carsten A.]

$48.64

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Description

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.

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Product Details

  • Oxford University Press Brand
  • Jun 30, 2019 Pub Date:
  • 9780198841937 ISBN-13:
  • 0198841930 ISBN-10:
  • 536.0 pages Paperback
  • English Language
  • 1.09 in * 6.69 in * 9.61 in Dimensions:
  • 2 lb Weight: