Arsenene as a promising sensor for the detection of H<sub>2</sub>S: a first-principles study
Yu‐Ping Tian, Chao-Bo Wang, Wei‐Jiang Gong
Abstract
To explore the feasibility of arsenene in detecting H 2 S gas, we employ the density-functional theory to investigate the geometry, electronic structure and magnetic properties of defected and doped arsenene.
Topics & Concepts
Materials scienceDopingDopantChemisorptionAdsorptionSemiconductorBand gapSubstrate (aquarium)Transition metalConductorDensity functional theoryCondensed matter physicsNanotechnologyOptoelectronicsComputational chemistryChemistryPhysical chemistryPhysicsCatalysisOceanographyGeologyBiochemistryComposite material2D Materials and ApplicationsPerovskite Materials and ApplicationsAdvanced Thermoelectric Materials and Devices