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Deciphering Methylation Effects on S(2)(ππ*) Internal Conversion in the Simplest Linear α,β-Unsaturated Carbonyl
[Image: see text] Chemical substituents can influence photodynamics by altering the location of critical points and the topography of the potential energy surfaces (electronic effect) and by selectively modifying the inertia of specific nuclear modes (inertial effects). Using nonadiabatic dynamics s...
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical Society
2023
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10316407/ https://www.ncbi.nlm.nih.gov/pubmed/37331016 http://dx.doi.org/10.1021/acs.jpca.3c02582 |