Effect of metal (Zn and Co) doped/co-doped on Ti3C2O2 MXene to NO gas sensing capability: A DFT study
JiaHui Su, Xin Liu, Hanmei Zhang, Bing Zhao, Tao Shen
Topics & Concepts
AdsorptionDensity functional theoryDopingCharge densityMoleculeMetalMaterials scienceTransition metalInorganic chemistryCarbon monoxideDensity of statesOxideMethaneFormaldehydeAnalytical Chemistry (journal)ChemistryPhysical chemistryComputational chemistryCatalysisOrganic chemistryPhysicsQuantum mechanicsMetallurgyCondensed matter physicsOptoelectronicsMXene and MAX Phase Materials2D Materials and ApplicationsAdvanced Photocatalysis Techniques