CO oxidation catalyzed by Cu-exchanged zeolites: A density functional theory study

Engineering & Materials Science

• Density functional theory 100%
• Zeolites 80%
• Molecules 65%
• Adsorption 65%
• Oxidation 59%
• Catalytic oxidation 51%
• Carbonates 37%
• Atoms 34%
• Silica 34%
• Oxygen 27%

Chemical Compounds

• Zeolite 50%
• Oxidation Reaction 30%
• Cyclic Compound 28%
• Adsorption 21%
• Carbonate 17%
• Molecule 15%
• Density Functional Theory 13%
• Dioxygen 10%
• Reduction 10%