The structure and energetic of AlAsn (n = 1-15) clusters: A first-principles study

Journal of Alloys and Compounds

Volumn 498, Issue 2, 2010, Pages 121-129

  Guo, Ling ^a  

^a SHANXI NORMAL UNIVERSITY   (China)

Author keywords

AlAsn cluster; Density functional theory; Stability

Indexed keywords

ALASN CLUSTER; CLUSTER DENSITIES; DISSOCIATION ENERGIES; FIRST-PRINCIPLES STUDY; GENERALIZED GRADIENT APPROXIMATIONS; GEOMETRIC STRUCTURE; GROUND-STATE STRUCTURES; GROWTH PATTERNS; HOMO-LUMO GAPS; ODD NUMBERS; PERIPHERAL POSITIONS; SECOND-ORDER ENERGIES; STABILITY ANALYSIS; STATIC POLARIZABILITIES; VALENCE ELECTRON;

ALUMINUM; BINDING ENERGY; DISSOCIATION; ELECTRON AFFINITY; ELECTRONS; GROWTH RATE; HARDNESS; IONIZATION POTENTIAL; STABILITY; TIME VARYING SYSTEMS; WAVE FUNCTIONS;

DENSITY FUNCTIONAL THEORY;

EID: 77953126687     PISSN: 09258388     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jallcom.2010.02.202     Document Type: Article

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