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Negative / Null Result ReportOpen accessPhysics and Astronomy· cited by 9

Unraveling the Relaxation Dynamics of Uracil: Insights from Time-Resolved X-ray Photoelectron Spectroscopy

Davide Faccialà; M. Bonanomi; Bruno Nunes Cabral Tenorio; L. Avaldi; P. Bolognesi; Carlo Callegari; Marcello Coreno; Sonia Coriani · 2025 · Journal of the American Chemical Society

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Abstract

High Resolution Image Download MS PowerPoint Slide We report a study of the electronic and nuclear relaxation dynamics of the photoexcited RNA base uracil in the gas phase using time-resolved core-level photoelectron spectroscopy together with high-level calculations. The dynamics was investigated by trajectory surface hopping calculations, and the core ionization energies were calculated for geometries sampled from these. The molecule was excited by a UV laser and dynamics probed on the oxygen, nitrogen, and carbon sites by core electron spectroscopy. We find that the main de-excitation chann

Abstract by Davide Faccialà; M. Bonanomi; Bruno Nunes Cabral Tenorio; L. Avaldi; P. Bolognesi; Carlo Callegari; Marcello Coreno; Sonia Coriani, Journal of the American Chemical Society (2025) — licensed CC BY 4.0.

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Metadata source: OpenAlex · DOI 10.1021/jacs.5c04874