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Beryllium sulfide (BeS) in different forms from molecule, bulk, monolayer (h-BeS), to the single-walled nanotube obtained by wrapping the h-BeS monolayer along the (n,0) hexagonal lattice vector for n varying from n = 6 to 64, has been examined. Density functional theory (DFT) with an all electron basis set and the hybrid DFT/B3LYP level have been applied to compute energetic and geometrical, electronic...
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