Stabilizing Co, Ni and Cu on the h-BN surface: Using O O bond activation to probe their performance as single atom catalyst
J. Datta, Chiranjib Majumder
Topics & Concepts
Vacancy defectAtom (system on chip)MoleculeMetalCatalysisDensity functional theoryCrystallographyMaterials scienceChemistryComputational chemistryMetallurgyBiochemistryEmbedded systemOrganic chemistryComputer scienceSemiconductor materials and devicesCatalytic Processes in Materials ScienceZnO doping and properties