Author(s): Haireguli Aihemaiti, Esmat Dastanpour, Anders Bergman, and Levente Vitos
Using $ab$ $initio$ density functional theory (DFT) calculations, we investigate the electronic structure, phase stability, and magnetic properties of equiatomic binary alloys between Al and $3d$ magnetic transition elements (Cr, Mn, Fe, Co, and Ni). Thermodynamically, all five binary aluminides are…
[Phys. Rev. Materials 10, 014404] Published Tue Jan 13, 2026