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Reaction intermediates during operando electrocatalysis identified from full solvent quantum mechanics molecular dynamics

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Exemplar Discovery Paper for CO2 reduction. Exemplar discovery paper for CO2 reduction; selected as a highly cited or venue-prominent research article rather than a general review.

Citation: Tao Cheng, Alessandro Fortunelli, William A. Goddard. Reaction intermediates during operando electrocatalysis identified from full solvent quantum mechanics molecular dynamics. Proceedings of the National Academy of Sciences 2019. https://doi.org/10.1073/pnas.1821709116

Acknowledgement: Curated by MaterialsAtlas Open Resources from OpenAlex, Crossref, and manual landmark-paper review.

TypeReading List

DomainCO2 reduction

LicenseScholarly article; see publisher

ContributorsTao Cheng, Alessandro Fortunelli, William A. Goddard