Electronic excitations from a linear-response range-separated hybrid scheme

Molecular Physics

Volumn 111, Issue 9-11, 2013, Pages 1219-1234

  Rebolini, Elisa ^a   Savin, Andreas ^a   Toulouse, Julien ^a  

^a LABORATOIRE DE CHIMIE THÉORIQUE   (France)

Author keywords

excitation energies; linear response; range separation; local density approximation; time dependent density functional theory

Indexed keywords

CHARGE-TRANSFER EXCITATIONS; DENSITY FUNCTIONAL APPROXIMATIONS; ELECTRONIC EXCITATION ENERGY; EXCHANGE-CORRELATION KERNEL; HARTREE-FOCK EXCHANGES; LINEAR RESPONSE; LONG RANGE CORRELATIONS; TIME DEPENDENT DENSITY FUNCTIONAL THEORY; ELECTRONIC EXCITATION; HYBRID SCHEME;

CHARGE TRANSFER; DENSITY FUNCTIONAL THEORY; DIMERS; ELECTRIC EXCITATION; MOLECULAR PHYSICS; SEPARATION;

EXCITATION ENERGY;

EID: 84882451049     PISSN: 00268976     EISSN: 13623028     Source Type: Journal    
DOI: 10.1080/00268976.2013.794313     Document Type: Article

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