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Reassignment of the Photoelectron Spectrum of Methylketene Using a Hybrid Model of Harmonic and Anharmonic Oscillators to Compute Franck–Condon Factors
[Image: see text] We constructed a hybrid model of harmonic and anharmonic oscillators to compute Franck–Condon factors and interpret the photoelectron spectrum of methylketene. The equilibrium structures of methylketene and its cation were optimized, and then, the harmonic and anharmonic vibrationa...
| 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/PMC10637627/ https://www.ncbi.nlm.nih.gov/pubmed/37953835 http://dx.doi.org/10.1021/acsomega.3c05750 |