Role of molecular conjugation in the surface radical reaction of aldehydes with H-Si(111): First principles study

Physics & Astronomy

• aldehydes 99%
• conjugation 82%
• alkynes 22%
• molecules 22%
• reaction intermediates 20%
• alkenes 17%
• formaldehyde 16%
• viability 14%
• silicon 14%
• routes 11%
• density functional theory 10%

Chemical Compounds

• Radical Reaction 79%
• Aldehyde 47%
• Chain Reaction 27%
• Surface 21%
• Dangling Bond 18%
• Reaction Intermediate 14%
• Benzaldehyde 13%
• Organic Molecule 12%
• Alkyne 11%
• Formaldehyde 11%
• Electron Spin 11%
• Alkene 9%
• Molecule 9%
• Density Functional Theory 8%

Engineering & Materials Science

• Aldehydes 100%
• Molecules 40%
• Dangling bonds 25%
• Reaction intermediates 24%
• Silicon 21%
• Density functional theory 20%
• Formaldehyde 17%
• Olefins 16%
• Experiments 4%