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Density functional study of AlB n clusters for n = 114
Density functional study of AlB n clusters for n = 114
2011
Mustafa Böyükata
Ziya B. Güvenç
Keywords:
Atomic physics
Non-bonding orbital
Materials science
Cluster (physics)
Band gap
Molecular physics
HOMO/LUMO
Binding energy
Density functional theory
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