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Structural, electronic and mechanical properties of single-walled AlN and GaN nanotubes via DFT/B3LYP
Structural, electronic and mechanical properties of single-walled AlN and GaN nanotubes via DFT/B3LYP Abstract: Density functional theory with B3LYP hybrid functional and all-electron basis set was applied to study the AlN (SWAlNNTs) and GaN (SWGaNNTs) single-walled […]