DFT study of superhalogen-doped borophene with enhanced nonlinear optical properties
Muhammad Ishaq, Rao Aqil Shehzad, Muhammad Yaseen, Saleem Iqbal, Khurshid Ayub, Javed Iqbal
Topics & Concepts
HyperpolarizabilityBoropheneDensity functional theoryIonization energyDopingMaterials scienceHOMO/LUMOBinding energyBand gapNonlinear opticalMolecular orbitalLithium (medication)Nonlinear systemMolecular physicsComputational chemistryIonizationOptoelectronicsAtomic physicsIonChemistryMoleculePhysicsQuantum mechanicsEndocrinologyOrganic chemistryMedicineNonlinear Optical Materials ResearchBoron and Carbon Nanomaterials ResearchNonlinear Optical Materials Studies