Half-metallicity and magnetism in BAs monolayer induced by anchoring 3d transition metals (TM = V, Cr and Mn)
D.M. Hoat, Mosayeb Naseri, Nguyen N. Hieu, R. Ponce‐Pérez, Hien D. Tong, J.F. Rivas‐Silva, Tuan V. Vu, Gregorio H. Cocoletzi
Topics & Concepts
MonolayerMagnetismMaterials sciencePseudopotentialDensity functional theoryCondensed matter physicsBand gapTransition metalMagnetic semiconductorDopingParamagnetismElectronic structureFerromagnetismMagnetic momentComputational chemistryNanotechnologyChemistryPhysicsCatalysisOptoelectronicsBiochemistryGraphene research and applications2D Materials and ApplicationsBoron and Carbon Nanomaterials Research