Ab initio calculation of neutral and singly charged Mgn (n≤11) clusters

Physica B: Condensed Matter

Volumn 403, Issue 18, 2008, Pages 3119-3124

  Zhang, Jian Min ^a   Duan, Ying Ni ^a   Xu, Ke Wei ^b   Ji, Vincent ^c   Man, Zhen Yong ^d  

^a SHAANXI NORMAL UNIVERSITY   (China)

^b XI'AN JIAOTONG UNIVERSITY   (China)

^c UNIVERSITÉ PARIS SUD   (France)

^d SHANGHAI INSTITUTE OF CERAMICS   (China)

Author keywords

Ab initio; Electronic structure; Geometries; Mg clusters

Indexed keywords

ELECTRONIC PROPERTIES;

AB INITIO CALCULATIONS; GENERALIZED GRADIENT (GGA) APPROXIMATIONS; GEOMETRICAL STRUCTURES; SIZE DEPENDENCE;

MAGNESIUM PRINTING PLATES;

BONDING; CLUMPS; ELECTRIC CHARGE; ELECTRONS; MAGNESIUM; PLATES; PRINTING; REMOVAL; STABILITY; VALENCE;

EID: 48749100823     PISSN: 09214526     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.physb.2008.03.021     Document Type: Article

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