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Ab initio investigation of Br-3d core-excited states in HBr and HBr(+) toward XUV probing of photochemical dynamics

Ultrafast X-ray/XUV transient absorption spectroscopy is a powerful tool for real-time probing of chemical dynamics. Interpretation of the transient absorption spectra requires knowledge of core-excited potentials, which necessitates assistance from high-level electronic-structure computations. In t...

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Detalles Bibliográficos
Autores principales: Kobayashi, Yuki, Zeng, Tao, Neumark, Daniel M., Leone, Stephen R.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Crystallographic Association 2019
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6404917/
https://www.ncbi.nlm.nih.gov/pubmed/30868084
http://dx.doi.org/10.1063/1.5085011