Monolayered Carbides of Main Group Elements (Si, Ge, Sn and Pb) for NO2 Gas Sensing: Insights from First-Principle Studies
Anshul Yadav
Topics & Concepts
Materials scienceDensity functional theoryMoleculeAdsorptionHOMO/LUMOCarbideBasis setCluster (spacecraft)Density of statesNanosheetElectronic structureChemical physicsComputational chemistryPhysical chemistryNanotechnologyCondensed matter physicsPhysicsOrganic chemistryChemistryProgramming languageComposite materialComputer science2D Materials and ApplicationsGraphene research and applicationsMXene and MAX Phase Materials