Geometries, stabilities, and electronic properties of Y-doped Sin (n = 1-16) clusters: A relativistic density functional investigation

Journal of Molecular Structure: THEOCHEM

Volumn 856, Issue 1-3, 2008, Pages 88-95

  Yang, A Ping ^a   Ren, Zhao Yu ^a   Guo, Ping ^a   Wang, Guang Hou ^b  

^a NORTHWEST UNIVERSITY   (China)

^b NANJING UNIVERSITY   (China)

Author keywords

Charge transfer; Density functional method; HOMO LUMO gap; Silicon metal clusters; Stability

Indexed keywords

EID: 41949091555     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2008.01.016     Document Type: Article

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