Time-dependent density functional theory

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Time-dependent density functional theory (TDDFT) is based on a set of ideas and theorems quite distinct from those governing ground-state DFT, but emphasizing similar techniques. Today, the use of TDDFT is rapidly growing in many areas of physics, chemistry and materials sciences where direct solution of the Schrödinger equation is too demanding. This is the first comprehensive, textbook-style introduction to the relevant basics and techniques.

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Title Statements

Full title :Time-dependent density functional theory / Miguel A.L. Marques [and others].

Summary

Time-dependent density functional theory (TDDFT) is based on a set of ideas and theorems quite distinct from those governing ground-state DFT, but emphasizing similar techniques. Today, the use of TDDFT is rapidly growing in many areas of physics, chemistry and materials sciences where direct solution of the Schrödinger equation is too demanding. This is the first comprehensive, textbook-style introduction to the relevant basics and techniques.

Edition Statements

Publication Date:©2006.

Publication Statements

Publisher(s):Springer
Place of Publication:Berlin
Language:eng
Publication Date:©2006.

The Physical Object

Description:1 online resource (xxxiv, 589 pages) : : illustrations

Edition Identifiers

ISBN:3540354220, 9783540354222, 9783540354260, 3540354263, 1280627433, 9781280627439, 9786610627431, 6610627436
DOI:10.1007/b11767107
oclc:ocm75958979
LC Classification:QC20.7.D43
Dewey Decimal:541/.28

Basics / E.K.U. Gross and K. Burke -- pt. 1. Formal theory -- Beyond the Runge-Gross Theorem / R. van Leeuwen -- Introduction to the keldysh formalism / R. van Leeuwen [and others] -- Initial-state dependence and memory / N.T. Maitra -- Current density functional theory / G. Vignale -- Multicomponent density-functional theory / R. van Leeuwen and E.K.U. Gross -- Intermolecular forces and generalized response functions in Liouville space / S. Mukamel, A.E. Cohen, and U. Harbola -- pt. 2. Approximate functionals -- Time-dependent deformation approximation / I.V. Tokatly -- Exact-exchange methods and perturbation theory along the adiabatic connection / A. Görling -- Approximate functionals from many-body perturbation theory / A. Marini, R. Del Sole, and A. Rubio -- Exact conditions / K. Burke -- pt. 3. Numerical aspects -- Propagators for the time-dependent Kohn-Sham equations / A. Castro and M.A.L. Marques -- Solution of the linear-response equations in a basic set / P.L. de Boeij -- Excited-state dynamics in finite systems and biomolecules / J. Hutter -- Time versus frequency space techniques / M.L.A. Marques and A. Rubio -- pt. 4. Applications: linear response -- Linear-response t…

Subjects

Density functionals Fonctionnelles densité Mathematical physics Physique Physique mathématique Science -- Chemistry Time-dependent density functional theory