Articles with "activity descriptors" as a keyword



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Activity descriptors derived from comparison of Mo and Fe as active metal for methane conversion to aromatics.

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Published in 2019 at "Journal of the American Chemical Society"

DOI: 10.1021/jacs.9b09710

Abstract: Producing aromatics directly from the smallest hydrocarbon building block, methane, is attractive because it could help satisfy increasing demand for aromatics while filling the gap created by decreased production from naphtha crackers. The system that… read more here.

Keywords: descriptors derived; active metal; comparison active; methane ... See more keywords
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Distilling universal activity descriptors for perovskite catalysts from multiple data sources via multi-task symbolic regression.

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Published in 2023 at "Materials horizons"

DOI: 10.1039/d3mh00157a

Abstract: Developing activity descriptors via data-driven machine learning (ML) methods can speed up the design of highly active and low-cost electrocatalysts. Despite the fact that a large amount of activity data for electrocatalysts is stored in… read more here.

Keywords: universal activity; task symbolic; activity descriptors; activity ... See more keywords