Computational study on nickel doped encapsulated Mg, K, Ca on pristine C24 nanocage for gas sensing applications
Adanna D. Nwagu, Hitler Louis, Henry O. Edet, Innocent Benjamin, Vincent N. Osabor, Adedapo S. Adeyinka
Topics & Concepts
AdsorptionNanocagesDensity functional theoryMaterials scienceDopingDopantMoleculeNickelCovalent bondPhysisorptionReusabilityNanotechnologyChemical engineeringComputational chemistryPhysical chemistryChemistryOrganic chemistryComputer scienceOptoelectronicsCatalysisProgramming languageMetallurgyEngineeringSoftwareGas Sensing Nanomaterials and SensorsBoron and Carbon Nanomaterials ResearchMXene and MAX Phase Materials