Tracking the atomistic structural transformations in chemical evolution via machine-learned infrared spectroscopy
Peer-Reviewed Publication
Updates every hour. Last Updated: 20-Jun-2025 06:10 ET (20-Jun-2025 10:10 GMT/UTC)
In a paper published in National Science Review, an international team of scientists propose a machine-learned protocol to efficiently and accurately monitor the chemical evolution processes using infrared spectroscopy descriptor. Illustrated with the example of C–C coupling in catalytic reactions, this introduces an intuitive strategy for fingerprinting chemical configurations to using them for assigning dynamic structural information via machine learning approach.
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