Ab-initio characterization of B4C3 monolayer as a toxic gases sensing material
Sarfraz Ahmed, Abdul Jalil, Syed Zafar Ilyas, Ather Hassan, A Ilahi, Ishaq Ahmed, Maaz Khan, Qasim Khan
Topics & Concepts
MonolayerSiliceneGermaneneWork functionAdsorptionMoleculeDensity functional theoryChemical physicsConductivityMaterials scienceBand gapAb initioCharacterization (materials science)NanotechnologyChemistryComputational chemistryGraphenePhysical chemistryOrganic chemistryOptoelectronicsLayer (electronics)2D Materials and ApplicationsBoron and Carbon Nanomaterials ResearchMXene and MAX Phase Materials