Excitation energies from an auxiliary-function formulation of time-dependent density-functional response theory with charge conservation constraint

Journal of Molecular Structure: THEOCHEM

Volumn 762, Issue 1-3, 2006, Pages 179-191

  Ipatov, Andrei ^a   Fouqueau, Antony ^a   Valle, Carlos Perez del ^a   Cordova, Felipe ^a   Casida, Mark E ^a   Köster, Andreas M ^b   Vela, Alberto ^b   Jamorski, Christine Jödicke ^c  

^a UNIVERSITÉ JOSEPH FOURIER   (France)

^b DEPARTAMENTO DE FÍSICA   (Mexico)

^c ETH ZURICH   (Switzerland)

Author keywords

Charge density fitting; Excitation energies; Resolution of the identity; Time dependent density functional theory

Indexed keywords

EID: 33646916280     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2005.07.034     Document Type: Article

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