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    Prediction of Adsorption Energies using Machine Learning

    Abstract: In this article, we have a much more comprehensive method that promotes the exploration of automated descriptors. Primary component analysis (PCA) with varimax rotation is used to find the strongest minimum range of adsorption energies that can be used as metal descriptors for a given data set. Our findings demonstrate that the mixture of descriptors produced by this method outperforms conventional descriptors such as nuclear carbon, hydrogen and oxygen adsorption …

    Published in International Journal of Electrical Power System and Technology · Vol. 6, Issue 2, 2020 · pp. 38–46 Read article

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