3 years ago

# First-principles study of the impact of the atomic configuration on the electronic properties of ${\mathrm{Al}}_{x}{\mathrm{Ga}}_{1−x}\mathrm{N}$ alloys

Alexandros Kyrtsos, Masahiko Matsubara, Enrico Bellotti
We employ first-principles calculations in the formalism of standard and hybrid density functional theory to study the electronic and structural properties of wurtzite ${\text{Al}}_{x}{\text{Ga}}_{1−x}\text{N}$ alloys. We address the discrepancies observed in literature regarding essential electroni...