Structural, electronic and optical properties of hexagonal boron-nitride (h-BN) monolayer: An Ab-initio study
Akshay M. Satawara, Gaushiya A. Shaikh, Sanjeev K. Gupta, P. N. Gajjar
Topics & Concepts
Materials scienceBand gapAb initioRefractive indexDensity functional theorySemiconductorPhononAbsorption (acoustics)Direct and indirect band gapsDielectricDispersion (optics)Absorption edgeAb initio quantum chemistry methodsCondensed matter physicsMolecular physicsOptoelectronicsComputational chemistryChemistryOpticsPhysicsMoleculeComposite materialOrganic chemistry2D Materials and ApplicationsGraphene research and applicationsBoron and Carbon Nanomaterials Research