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Time-dependent density functional theory

Autor: Miguel A L Marques; et al
Editorial: Berlin : Springer, ©2006.
Serie: Lecture notes in physics, 706.
Edición/Formato:   Libro-e : Documento : Inglés (eng)Ver todas las ediciones y todos los formatos
Base de datos:WorldCat
Resumen:

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. This work is a  Leer más

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Género/Forma: Electronic books
Formato físico adicional: Print version:
Time-dependent density functional theory.
Berlin ; New York : Springer, c2006
(DLC) 2006928278
(OCoLC)71008305
Tipo de material: Documento, Recurso en Internet
Tipo de documento: Recurso en Internet, Archivo de computadora
Todos autores / colaboradores: Miguel A L Marques; et al
ISBN: 3540354220 9783540354222 9783540354260 3540354263
Número OCLC: 75958979
Descripción: 1 online resource (xxxiv, 589 p.) : ill.
Contenido: 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 ... [et al.] --
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 time-dependent density functional theory for open-shell molecules / M.E. Casida, A. Ipatov, and F. Cordova --
Atoms and clusters / J.R. Chelikowsky, Y. Saad and I. Vasiliev --
Semiconductor Nanostructures / C.A. Ullrich --
Solids from time-dependent current DFT / P.L. de Boeij --
Optical properties of solids and nanostructures from a many-body fxc kernel / A. Marini, R. Del Sole, and A. Rubio --
Biochromophores / X. Lopez and M.A.L. Marques --
Excited states and photochemistry / D. Rappoport and F. Furche --
pt. 5. Applications: beyond linear response --
Atoms and molecules in strong laser fields / C.A. Ullrich and A.D. Bandrauk --
Highlights and challenges in strong-field atomic and molecular processes / V. Véniard --
Cluster dynamics in strong laser fields / P.-G. Reinhard and E. Suraud --
Excited-state dynamics in extended systems / O. Sugino and Y. Miyamoto --
pt. 6. New frontiers --
Back to the ground-state: electron gas / M. Lein and E.K.U. Gross --
The exchange-correlation potential in the adiabatic-connection fluctuation-dissipation framework / Y.M. Niquet and M. Fuchs --
Dispersion (van der waals) forces and TDDFT / J.F. Dobson --Kohn-Sham master equation approach to transport through single molecules / R. Gebauer, K. Burke, and R. Car --
Time-dependent transport through single molecules: nonequilibrium green's functions / G. Stefanucci ... [et al.] --
Scattering amplitudes / A. Wasserman and K. Burke.
Título de la serie: Lecture notes in physics, 706.
Responsabilidad: Miguel A.L. Marques ... [et al.].
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