First-principles calculations to investigate half-metallic ferromagnetism in Zn0.50Ti0.50S alloy by using DFT + U calculations

ABSTRACTThe spin-polarized structural, electronic and magnetic properties of the Ti-doped zincblende ZnS compound at x = 0.50 (Zn0.50Ti0.50S alloy) have been investigated by employing the first-pri...