Böyükata, Mustafa; Güvenç, Büşra
(Elsevier Science S A, 2011-03-17)
Density functional theory (DFT) B3LYP at 6-311++G(d,p) level is employed to optimize the structures of AlBn (n = 1-14) microclusters. Analysis of the energetic and structural stability of these clusters and their various ...