Bonding in the homologous series CsAu, CsAg, and CsCu studied at the 4-component density functional theory and coupled cluster levels

Journal of Chemical Physics

Volumn 119, Issue 18, 2003, Pages 9355-9363

  Fossgaard, O ^a   Gropen, O ^a   Eliav, E ^b   Saue, T ^c  

^a UNIVERSITY OF TROMSØ   (Norway)

^b TEL AVIV UNIVERSITY   (Israel)

^c UNIVERSITÉ DE STRASBOURG   (France)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMS; BOND STRENGTH (CHEMICAL); CALCULATIONS; CHARGE TRANSFER; DISSOCIATION; ELECTRONIC STRUCTURE; HYDROGEN BONDS; INTERMETALLICS; MAGNETIC MOMENTS; PROBABILITY DENSITY FUNCTION; RARE EARTH ELEMENTS; RELATIVITY;

COUPLED CLUSTER LEVELS; DIPOLE MOMENTS; DISSOCIATION ENERGY; FOUR COMPONENT DENSITY FUNCTIONAL THEORY; LANTHANIDE CONTRACTION;

CESIUM COMPOUNDS;

EID: 0345098405     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1615953     Document Type: Article

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