Hartree-Fock and Kohn-Sham time-dependent response theory in a second-quantization atomic-orbital formalism suitable for linear scaling

Journal of Chemical Physics

Volumn 129, Issue 5, 2008, Pages

  Kjaergaard, Thomas ^a   Jørgensen, Poul ^a   Olsen, Jeppe ^a   Coriani, Sonia ^b,c   Helgaker, Trygve ^c  

^a AARHUS UNIVERSITY   (Denmark)

^b UNIVERSITY OF TRIESTE   (Italy)

^c UNIVERSITY OF OSLO   (Norway)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMS; MOLECULAR PHYSICS; SURFACE STRUCTURE;

HARTREE-FOCK; HYPERPOLARIZABILITIES; KOHN-SHAM DENSITY; LINEAR SCALING; ORBITAL METHODS; TIME-DEPENDENT RESPONSE; TWO-PHOTON TRANSITIONS;

ATOMIC PHYSICS;

EID: 49349117879     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2961039     Document Type: Article

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