Water adsorption on the stoichiometric and reduced CeO₂(111) surface: A first-principles investigation

Physics & Astronomy

• adsorption 100%
• water 74%
• oxygen 35%
• water vapor 23%
• cerium oxides 16%
• cerium 13%
• configurations 12%
• oxygen atoms 12%
• atomic structure 11%
• hydrogen atoms 11%
• desorption 10%
• binding energy 10%
• fragments 10%
• dissociation 9%
• free energy 9%
• interactions 9%
• phase diagrams 9%
• density functional theory 9%
• activation energy 8%
• thermodynamics 8%
• estimates 6%
• molecules 6%
• temperature 3%

Chemical Compounds

• Adsorption 64%
• Dioxygen 45%
• Surface 41%
• Cerium 35%
• Water Vapor 35%
• Surface Structure 18%
• Phase Diagrams 16%
• Binding Energy 16%
• Hydrogen Atom 16%
• Oxygen Atom 14%
• Gibbs Free Energy 14%
• Dissociation 13%
• Sorption 13%
• Reaction Activation Energy 12%
• Density Functional Theory 11%
• Thermodynamics 11%
• Pressure 10%
• Environment 10%
• Oxide 10%
• Molecule 6%