Efficient exact-exchange time-dependent density-functional theory methods and their relation to time-dependent Hartree-Fock

Journal of Chemical Physics

Volumn 134, Issue 3, 2011, Pages

  Heßelmann, Andreas ^a   Grling, Andreas ^a  

^a UNIVERSITY OF ERLANGEN NUREMBERG   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

CORRELATION POTENTIAL; DAVIDSON ALGORITHM; EIGENSOLVERS; EIGENVALUE EQUATIONS; EIGENVALUE PROBLEM; EIGENVALUES; ELECTRONIC EXCITATION ENERGY; EXACT EXCHANGE; FREQUENCY-DEPENDENT; GENERALIZED EIGENVALUE PROBLEMS; SERIES EXPANSION; TIME DEPENDENT DENSITY FUNCTIONAL THEORY; TIME-DEPENDENT; TIME-DEPENDENT HARTREE-FOCK;

ALDEHYDES; DENSITY FUNCTIONAL THEORY; ETHYLENE; EXCITATION ENERGY; LEARNING ALGORITHMS; MOLECULAR PHYSICS; SWITCHING SYSTEMS; TIME VARYING SYSTEMS; WAVE FUNCTIONS;

EIGENVALUES AND EIGENFUNCTIONS;

ACETALDEHYDE; ETHYLENE; ETHYLENE DERIVATIVE; PYRIDINE; PYRIDINE DERIVATIVE;

ALGORITHM; ARTICLE; CHEMISTRY; QUANTUM THEORY; TIME;

ACETALDEHYDE; ALGORITHMS; ETHYLENES; PYRIDINES; QUANTUM THEORY; TIME FACTORS;

EID: 79551643121     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3517312     Document Type: Article

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