Influence of impurity configuration on electronic and optical properties of Ce-doped YVO4 : Semi-local & hybrid functionals
We investigate the impact of impurity configuration on electronic and optical properties of YVO4 through application of plane-wave DFT. Since this crystal is a common host material for optical devices and it has been widely used as a phosphor and a laser host material, it is important to identify a correlation between impurity location and the intrinsic properties of the material. To further impro