DFT+U study of the bulk and (001), (110) and (111) surfaces of NaCrAs half-Heusler alloy with hydrogen adsorption for spintronics applications
Mohammad Rostami, M. Abedi, Pooria Amantorkaman, Faramarz Kanjouri
Topics & Concepts
SpintronicsMagnetic momentMaterials scienceFormula unitCondensed matter physicsCurie temperatureDensity functional theoryMagnetismHalf-metalFerromagnetismChemistryCrystallographyComputational chemistryCrystal structurePhysicsHeusler alloys: electronic and magnetic propertiesMXene and MAX Phase MaterialsIntermetallics and Advanced Alloy Properties