The Subsurface Diffusion of Hydrogen on Rutile TiO2 Surfaces: A Periodic DFT Study
Baohuan Wei, Mónica Calatayud
Topics & Concepts
RutileHydrogenMaterials scienceChemical physicsHydrogen spilloverDiffusionOxideActivation energyDiffusion barrierChemical engineeringNanotechnologyPhysical chemistryThermodynamicsChemistryMetallurgyLayer (electronics)PhysicsEngineeringOrganic chemistryCatalytic Processes in Materials ScienceAdvanced Photocatalysis TechniquesGas Sensing Nanomaterials and Sensors