Van der Waals heterostructures of SiC and Janus MSSe (M = Mo, W) monolayers: a first principles study
M. Idrees, Muhammad Fawad, M. Bilal, Y. Saeed, Chuong V. Nguyen, B. Amin
Abstract
Using DFT calculations, we have investigated the electronic structure, Rashba effect, optical and photocatalytic performance of SiC-MSSe (M = Mo, W) van der Waals heterostructures with different stacking patterns of chalcogen atoms.
Topics & Concepts
HeterojunctionStackingMaterials scienceExcitonDensity functional theoryCondensed matter physicsChalcogenvan der Waals forceChemistryPhysicsOptoelectronicsCrystallographyComputational chemistryQuantum mechanicsOrganic chemistryMolecule2D Materials and ApplicationsMXene and MAX Phase MaterialsGraphene research and applications