Analyzing molecular static linear response properties with perturbed localized orbitals

Journal of Chemical Physics

Volumn 133, Issue 4, 2010, Pages

  Autschbach, Jochen ^a   King, Harry F ^a  

^a UNIVERSITY AT BUFFALO   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

DERIVATIVE TECHNIQUE; ELECTRIC-FIELD PERTURBATIONS; EXPECTATION VALUES; FIRST ORDER; FLUOROETHENE; FUNCTIONALS; ITERATIVE SEQUENCES; LINEAR RESPONSE; LOCALIZED MOLECULAR ORBITALS; LOCALIZED ORBITALS; MOLECULAR STATICS; ORBITAL ROTATIONS; POLARIZABILITIES; SINGLE-STEP; STATIC POLARIZABILITIES;

CHEMICAL BONDS; MOLECULAR ORBITALS; POLARIZATION;

ETHYLENE;

EID: 77955671155     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3455709     Document Type: Article

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