Using complex degrees of freedom in the Kohn-Sham self-interaction correction

Physical Review A - Atomic, Molecular, and Optical Physics

Volumn 85, Issue 6, 2012, Pages

  Hofmann, D ^a   Klupfel S ^b   Klupfel P ^b   Kummel S ^a  

^a UNIVERSITY OF BAYREUTH   (Germany)

^b UNIVERSITY OF ICELAND   (Iceland)

Author keywords

[No Author keywords available]

Indexed keywords

DENSITY FUNCTIONALS; GROUND STATE PROPERTIES; KOHN-SHAM ORBITALS; KOHN-SHAM POTENTIAL; MOLECULAR BONDS; ORBITAL DENSITIES; SELF-INTERACTION CORRECTIONS; UNITARY TRANSFORMATIONS;

MATHEMATICAL MODELS; PHYSICS;

BOND LENGTH;

EID: 84863010654     PISSN: 10502947     EISSN: 10941622     Source Type: Journal    
DOI: 10.1103/PhysRevA.85.062514     Document Type: Article

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