Machine Learning Prediction of the Redox Activity of Quinones

Machine Learning Prediction of the Redox Activity of Quinones

The redox properties of quinones underlie their unique characteristics as organic battery components that outperform the conventional inorganic ones. Furthermore, these redox properties could be precisely tuned by using different substituent groups. Machine learning and statistics, on the other hand...

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Bibliographic Details
Main Authors: Ilia Kichev, Lyuben Borislavov, Alia Tadjer, Radostina Stoyanova
Format: Article
Language:English
Published: MDPI AG 2023-10-01
Series:Materials
Subjects:
quinones
machine learning
ridge regression
decision tree
ensemble methods
density functional theory
Online Access:https://www.mdpi.com/1996-1944/16/20/6687

Internet

https://www.mdpi.com/1996-1944/16/20/6687

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