Mehmood S.; Ali Z.; Alwadai N.; Al Huwayz M.; Al-Buriahi M.S.; Trukhanov S.V.; Tishkevich D.I.; Trukhanov A.V.
(2023)
In this study, density functional theory (DFT) showed that the electronic band profiles of CaCu3B2Re2O12 (B = Mn, Fe, Co, and Ni) indicate their half-metallic character. The optimized magnetic energy curves in different ...