Absorption Spectra of Flexible Fluorescent Probes by a Combined Computational Approach: Molecular Dynamics Simulations and Time-Dependent Density Functional Theory

[Image: see text] A detailed understanding and interpretation of absorption spectra of molecular systems, especially in condensed phases, requires computational models that allow their structural and electronic features to be connected to the observed macroscopic spectra. This work is focused on mod...

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Detalles Bibliográficos
Autores principales: Di Grande, Silvia, Ciofini, Ilaria, Adamo, Carlo, Pagliai, Marco, Cardini, Gianni
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2022
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9720718/
https://www.ncbi.nlm.nih.gov/pubmed/36383687
http://dx.doi.org/10.1021/acs.jpca.2c04637

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9720718/
https://www.ncbi.nlm.nih.gov/pubmed/36383687
http://dx.doi.org/10.1021/acs.jpca.2c04637

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