Geometrical and electronic structures of small Wn (n=2-16) clusters

Journal of Chemical Physics

Volumn 131, Issue 4, 2009, Pages

  Du, Jiguang ^a   Sun, Xiyuan ^a   Meng, Daqiao ^b   Zhang, Pengcheng ^b   Jiang, Gang ^a  

^a SICHUAN UNIVERSITY   (China)

^b NATIONAL KEY LABORATORY FOR SURFACE PHYSICS AND CHEMISTRY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

CHEMICAL ACTIVITIES; CHEMICAL BONDINGS; CLUSTER SIZES; D ELECTRONS; ELECTRONIC BAND STRUCTURE; EXPERIMENTAL DATA; GEOMETRICAL AND ELECTRONIC STRUCTURES; GRADIENT-CORRECTED DENSITY FUNCTIONAL THEORY; HIGHEST OCCUPIED MOLECULAR ORBITAL; ISO SURFACE; LOWEST UNOCCUPIED MOLECULAR ORBITAL; ON-BODY; ORBITALS; PROJECTED DENSITY OF STATE; TUNGSTEN CLUSTER; VERTICAL ELECTRON AFFINITIES; VERTICAL IONIZATION;

ATOMS; CHEMICAL BONDS; ELECTRONIC PROPERTIES; ELECTRONIC STRUCTURE; IONIZATION POTENTIAL; MOLECULAR MODELING; MOLECULAR ORBITALS; TUNGSTEN;

DENSITY FUNCTIONAL THEORY;

EID: 68249120973     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3187525     Document Type: Article

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