Toward accelerated discovery of solid catalysts using extrapolative machine learning approach
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DOI: 10.1093/chemle/upae163
Abstract: Designing novel catalysts is pivotal for overcoming numerous energy and environmental challenges. Although data science approaches, particularly machine learning (ML) approaches, hold promise for accelerating catalyst development, discovering truly novel catalysts through ML remains rare.… read more here.
Keywords: toward accelerated; solid catalysts; approach; machine learning ... See more keywords