Charge transfer excited state energies by perturbative delta self consistent field method

Journal of Chemical Physics

Volumn 137, Issue 8, 2012, Pages

  Baruah, Tunna ^a   Olguin, Marco ^a   Zope, Rajendra R ^a  

^a UNIVERSITY OF TEXAS AT EL PASO   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CALCULATION COST; CHARGE-TRANSFER EXCITATIONS; CHARGE-TRANSFER EXCITED STATE; DONOR-ACCEPTOR COMPLEX; FUNCTIONALS; PERTURBATIVE APPROACH; SELF-CONSISTENT FIELD METHOD; TIME DEPENDENT DENSITY FUNCTIONAL THEORY;

CHARGE TRANSFER; DENSITY FUNCTIONAL THEORY; EXCITATION ENERGY; HYDROCARBONS; PORPHYRINS;

EXCITED STATES;

EID: 84865755067     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4739269     Document Type: Article

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