Band-gap engineering of La1−<italic>x</italic><bold>Nd</bold><italic>x</italic><bold>AlO</bold>3 (<italic>x</italic> = 0, 0.25, 0.50, 0.75, 1) perovskite using density functional theory: A modified Becke Johnson potential study

Band-gap engineering of La_1−xNd_xAlO₃ (x = 0, 0.25, 0.50, 0.75, 1) perovskite using density functional theory: A modified Becke Johnson potential study

Sandeep ^{1, †,}, Rai D P², Shankar A³, Ghimire M P⁴, Pradhan Sakhya Anup⁵, Sinha T P⁵, Khenata R⁶, Bin Omran S⁷, Thapa R K¹

Plots of energy versus volume for La_1−xNd_xAlO₃ alloys with (a) x = 0% or (0/8), (b) x = 25% or (2/8), (c) x = 50% or (4/8), (d) x = 75% or (6/8), (e) x = 100% or (8/8), and (f) plot of the percentage of Nd doping vs volume for the La_1−xNd_xAlO₃ alloys.