Fluorine doped porous boron nitride for efficient CO2 capture and separation: A DFT study
Yan Liu, Lanlan Li, Qiaoling Li, Jing Lin, Zhonglu Guo, Xinghua Zhang, Zunming Lu, Yuanhui Ma, Yang Huang, Chengchun Tang
Topics & Concepts
AdsorptionDopingWork functionMaterials scienceFluorineDensity functional theoryBoron nitrideSelectivityBand gapDispersion (optics)Chemical physicsGraphitic carbon nitrideDopantBoronPorosityComputational chemistryImpurityChemical engineeringNanotechnologyPhysical chemistryChemistryOptoelectronicsOrganic chemistryLayer (electronics)Composite materialPhotocatalysisCatalysisPhysicsOpticsEngineeringMetallurgyBoron and Carbon Nanomaterials ResearchGraphene research and applicationsSuperconductivity in MgB2 and Alloys