Mechanism of atmospheric photooxidation of aromatics: A theoretical study

Chemical Compounds

• 1,2,4-trimethylbenzene 88%
• Photooxidation 59%
• Toluene 42%
• Correlation Function 37%
• Density Functional Theory 35%
• Aromatic Compound 27%
• Energy 27%
• Ab Initio Calculation 24%
• Chemistry 16%
• Oxidation Reaction 12%

Physics & Astronomy

• photooxidation 78%
• xylene 75%
• toluene 31%
• density functional theory 22%
• data products 21%
• aromatic compounds 21%
• products 18%
• chemistry 12%
• oxidation 10%
• atmospheres 10%
• optimization 9%
• energy 8%
• geometry 8%

Engineering & Materials Science

• Photooxidation 100%
• Xylene 77%
• Density functional theory 42%
• Toluene 34%
• Aromatic compounds 22%
• Oxidation 12%
• Geometry 8%