First principles study of structural and electronic properties of AlnN (n=1–19) clusters

作者: Qiugui Bai , Bin Song , Jinyu Hou , Pimo He

DOI: 10.1016/J.PHYSLETA.2008.03.067

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摘要: The structural and electronic properties of Al n N (n=1–19) clusters have been investigated using generalized gradient approximation to the density functional theory. The lowest-energy …

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