Comprehensive theoretical study of the conversion reactions of spiropyrans: Substituent and solvent effects

Chemical Compounds

• Substituent Effect 61%
• Solvent Effect 57%
• Potential Energy Surface 57%
• Polarity 19%
• Excited State 19%
• Ground State 19%
• Solvent 16%
• Strength 15%
• Excited Singlet State 12%
• Triplet State 12%
• Photochemical Reaction 11%
• Bond Length 10%
• Density Functional Theory 7%

Engineering & Materials Science

• Potential energy surfaces 100%
• Excited states 40%
• Photochemical reactions 21%
• Ground state 18%
• Density functional theory 17%
• Bond length 17%
• Geometry 7%
• Hot Temperature 5%

Physics & Astronomy

• potential energy 36%
• polarity 16%
• excitation 12%
• Commonwealth of Independent States 12%
• ground state 11%
• alternations 10%
• photochemical reactions 9%
• atomic energy levels 9%
• density functional theory 6%
• geometry 4%