Ab initio study of surface acid-base reactions. The case of molecular and dissociative adsorption of ammonia on the (011) surface of rutile TiO2

Chemical Compounds

• Neutralization Reaction 100%
• Dissociative Adsorption 97%
• Rutile 77%
• Ammonia 59%
• Surface 25%
• Monolayer 14%
• Adsorption 14%
• Density of State 10%
• Adsorption Energy 10%
• Photoelectron Spectroscopy 9%
• Lewis Acid 8%
• Drop 8%
• Orbital 8%
• Metal Ion 6%
• Density Functional Theory 6%
• Nitrogen 5%
• Molecule 3%

Physics & Astronomy

• rutile 82%
• ammonia 79%
• acids 70%
• adsorption 60%
• atoms 17%
• metal ions 12%
• solid surfaces 11%
• chemical reactions 10%
• photoelectron spectroscopy 9%
• prototypes 8%
• density functional theory 8%
• nitrogen 8%
• orbitals 7%
• molecules 6%
• electronics 5%
• interactions 4%
• energy 3%

Engineering & Materials Science

• Ammonia 83%
• Adsorption 76%
• Acids 71%
• Atoms 30%
• Monolayers 25%
• Electronic density of states 18%
• Photoelectron spectroscopy 16%
• Density functional theory 14%
• Metal ions 14%
• Chemical reactions 9%
• Molecules 9%
• Nitrogen 9%