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Energetics, electronic and magnetic properties of monolayer WSe2 doped with pnictogens, halogens and transition-metal (4d, 5d) atoms: An ab-initio study

L.B. Mabelet, B.R. Malonda-Boungou, H.B. Mabiala-Poaty, A.T. Raji, B. M’Passi-Mabiala

2020Physica E Low-dimensional Systems and Nanostructures19 citationsDOI

Topics & Concepts

DopantMonolayerDensity functional theoryDopingTransition metalAb initioHalogenAtom (system on chip)ChemistryMaterials scienceCrystallographyComputational chemistryNanotechnologyCatalysisOrganic chemistryOptoelectronicsAlkylEmbedded systemComputer science2D Materials and ApplicationsMXene and MAX Phase MaterialsChalcogenide Semiconductor Thin Films
Energetics, electronic and magnetic properties of monolayer WSe2 doped with pnictogens, halogens and transition-metal (4d, 5d) atoms: An ab-initio study | Litcius