Performance of the OPBE exchange-correlation functional

Molecular Physics

Volumn 102, Issue 23-24, 2004, Pages 2467-2474

  Swart, Marcel ^a   Ehlers, Andreas W ^a   Lammertsma, Koop ^a  

^a VU UNIVERSITY AMSTERDAM   (Netherlands)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMIZATION; CORRELATION METHODS; DATA REDUCTION; GROUND STATE; MOLECULES; OPTIMIZATION; POLARIZATION;

DENSITY FUNCTIONAL THEORY (DFT); IRON COMPLEXES; SPIN STATE ENERGY; VIBRATIONAL ENERGY;

PROBABILITY DENSITY FUNCTION;

EID: 10944234613     PISSN: 00268976     EISSN: None     Source Type: Journal    
DOI: 10.1080/0026897042000275017     Document Type: Article

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