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Accurate Relativistic Real-Time Time-Dependent Density Functional Theory for Valence and Core Attosecond Transient Absorption Spectroscopy

[Image: see text] First principles theoretical modeling of out-of-equilibrium processes observed in attosecond pump–probe transient absorption spectroscopy (TAS) triggering pure electron dynamics remains a challenging task, especially for heavy elements and/or core excitations containing fingerprint...

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Detalles Bibliográficos
Autores principales: Moitra, Torsha, Konecny, Lukas, Kadek, Marius, Rubio, Angel, Repisky, Michal
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2023
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9940299/
https://www.ncbi.nlm.nih.gov/pubmed/36757216
http://dx.doi.org/10.1021/acs.jpclett.2c03599