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Title Density-functional methods for excited states / Nicolas Ferré, Michael Filatov, Miquel Huix-Rotllant, editors ; with contributions by C. Adamo [and twenty four others].
Published Cham : Springer, [2016]
©2016
Book Cover

LOCATION CALL # STATUS
 Floor4  QD1 .F58 no.368    IN LIBRARY
Description xii, 481 pages : illustrations (some color) ; 24 cm.
Content Type text
Format volume
Series Topics in current chemistry, 0340-1022 ; 368
Topics in current chemistry ; 368. 0340-1022
Bibliography Includes bibliographical references and index.
Contents Many-body perturbation theory (MBPT) and time-dependent density-functional theory (TD-DFT): MBPT insights about what is missing in, and corrections to, the TD-DFT adiabatic approximation -- Constricted variational density functional theory aproach to the description of excited states - Ensemble DFT approach to excited states of strongly correlated molecular systems -- Reduced density matrix functional theory (RDMFT) and linear response time-dependent RDMFT (TD-RDMFT) -- Excitation in time-dependent density-functional theory -- Dynamical processes in open quantum systems from a TDDFT perspective: resonances and electron photoemission -- Nonlinear spectroscopy of core and valence excitations using short x-ray pulses: simulation challenges -- Computational molecular electronic spectroscopy with TD-DFT -- Absorption spectroscopy, emissive properties, and ultrafast intersystem corssing processes in transition metal complexes: TD-DFT and spin-orbit coupling -- Surface hopping dynamics with DFT excited states -- Description of canonical intersections with density functional methods.
Note Also issued online.
Subject Density functionals.
Excited state chemistry.
Quantum chemistry.
Related Names Ferré, Nicolas, editor.
Filatov, Michael, editor.
Huix-Rotllant, Miquel, editor.
Adamo, C. (Carlo), author.
ISBN 3319220802
9783319220802
OCLC number 913557062