High-Throughput Screening for Ultrafast Photochemical Reaction Discovery. Bain, M., Godínez Castellanos, J. L., & Bradforth, S. E. The Journal of Physical Chemistry Letters, 14(44):9864–9871, American Chemical Society (ACS), 2023.
High-Throughput Screening for Ultrafast Photochemical Reaction Discovery [link]Paper  doi  abstract   bibtex   1 download  
High-repetition-rate lasers present an opportunity to extend ultrafast spectroscopy from a detailed probe of singular model photochemical systems to a routine analysis technique in training machine learning models to aid the design cycle of photochemical syntheses. We bring together innovations in line scan cameras and micro-electro-mechanical grating modulators with sample delivery via high-pressure liquid chromatography pumps to demonstrate a transient absorption spectrometer that can characterize photoreactions initiated with ultrashort ultraviolet pulses in a time scale of minutes. Furthermore, we demonstrate that the ability to rapidly screen an important class of photochemical system, pyrimidine nucleosides, can be used to explore the effect of conformational modification on the evolution of excited-state processes.
@article{Bain_2023, 
 	title={High-Throughput Screening for Ultrafast Photochemical Reaction Discovery}, 
 	volume={14}, 
 	ISSN={1948-7185}, 
 	url={http://dx.doi.org/10.1021/acs.jpclett.3c02389}, 
 	DOI={10.1021/acs.jpclett.3c02389}, 
 	number={44}, 
 	journal={The Journal of Physical Chemistry Letters}, 
 	publisher={American Chemical Society (ACS)}, 
 	author={Bain, Matthew and Godínez Castellanos, José L. and Bradforth, Stephen E.}, 
 	year={2023}, 
 	pages={9864–9871},
 	abstract = {High-repetition-rate lasers present an opportunity to extend ultrafast spectroscopy from a detailed probe of singular model photochemical systems to a routine analysis technique in training machine learning models to aid the design cycle of photochemical syntheses. We bring together innovations in line scan cameras and micro-electro-mechanical grating modulators with sample delivery via high-pressure liquid chromatography pumps to demonstrate a transient absorption spectrometer that can characterize photoreactions initiated with ultrashort ultraviolet pulses in a time scale of minutes. Furthermore, we demonstrate that the ability to rapidly screen an important class of photochemical system, pyrimidine nucleosides, can be used to explore the effect of conformational modification on the evolution of excited-state processes.},
 	bibbase_note = {<img src="https://pubs.acs.org/cms/10.1021/acs.jpclett.3c02389/asset/images/medium/jz3c02389_0006.gif">}
}

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