Computational studies on the structural, electronic and optical properties of M2CT2 (M=Y, Sc and T=F, Cl) MXene monolayer

Alireza Mostafaei, Mohaddeseh Abbasnejad

2020Journal of Alloys and Compounds72 citationsDOI

Topics & Concepts

MonolayerDielectric functionDensity functional theoryDielectricSemiconductorMaterials scienceElectronic structureAbsorption (acoustics)Condensed matter physicsChemistryOptoelectronicsNanotechnologyComputational chemistryPhysicsComposite materialMXene and MAX Phase Materials2D Materials and ApplicationsGraphene research and applications