Atomistic Insight into Nitrogen-Terminated Diamond(001) Surfaces by the Adsorption of N, NH, and NH₂: A Density Functional Theory Study

Engineering & Materials Science

• Density functional theory 100%
• Diamonds 66%
• Adsorption 65%
• Nitrogen 61%
• Adsorbates 50%
• Substrates 23%
• Scanning tunneling microscopy 19%
• Core levels 17%
• Dimers 16%
• Monolayers 14%
• Carbon 8%
• Geometry 6%
• Experiments 3%

Physics & Astronomy

• diamonds 53%
• density functional theory 51%
• adsorption 51%
• nitrogen 49%
• attack 12%
• configurations 11%
• scanning tunneling microscopy 10%
• dimers 10%
• interactions 8%
• carbon 7%
• vibration 7%
• shift 6%
• geometry 6%
• simulation 4%

Chemical Compounds

• Diamond 63%
• Nitrogen 40%
• Adsorption 32%
• Surface 21%
• Core Level 13%
• Scanning Tunneling Microscopy 11%
• Monolayer 8%
• Simulation 7%
• Density Functional Theory 6%
• Modification 6%
• Carbon Atom 5%