Adsorption and sensing SF6 decomposed gases (SO2, SO2F2, SOF2, H2S, and HF) on Ti and Co decorated B4CN3 monolayer- A DFT study
Hamza Ahmad, Xianshan Li, Basheer Ahmed Kalwar, Xinyu Tan, Muhammad Rafique Naich
Topics & Concepts
Materials scienceMonolayerAdsorptionChemical physicsDensity functional theoryPhysical chemistryComputational chemistryNanotechnologyPhysicsChemistryBoron and Carbon Nanomaterials ResearchMXene and MAX Phase Materials2D Materials and Applications