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 […]