Structures and properties of neutral gallium clusters: A theoretical investigation

Journal of Chemical Physics

Volumn 135, Issue 4, 2011, Pages

  Drebov, Nedko ^a   Weigend, Florian ^a   Ahlrichs, Reinhart ^a  

^a KARLSRUHE INSTITUTE OF TECHNOLOGY   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

BASIS SETS; BULK VALUE; CCSD; CCSD CALCULATIONS; COHESIVE ENERGIES; COUPLED-CLUSTER SINGLES AND DOUBLES; DISSOCIATION ENERGIES; DOUBLET GROUND STATE; GLOBAL MINIMA; JAHN TELLER EFFECT; LOW ENERGIES; NEUTRAL GALLIUM CLUSTERS; QUARTET STATE; SEARCH-BASED; SIX-MEMBERED RINGS; STABLE CLUSTERS; THEORETICAL INVESTIGATIONS; TRIGONAL PRISMS; TRIPLET STATE;

CESIUM; DENSITY FUNCTIONAL THEORY; GROUND STATE; ISOMERS; PRISMS;

GALLIUM ALLOYS;

EID: 79961081432     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3615501     Document Type: Article

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