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dc.contributor.authorLimaye, Aditya M
dc.contributor.authorZeng, Joy
dc.contributor.authorWillard, Adam P.
dc.contributor.authorManthiram, Karthish
dc.date.accessioned2021-09-22T17:28:27Z
dc.date.available2021-09-22T17:28:27Z
dc.date.issued2021-01
dc.date.submitted2020-11
dc.identifier.issn2041-1723
dc.identifier.urihttps://hdl.handle.net/1721.1/132626
dc.description.abstractThe Tafel slope is a key parameter often quoted to characterize the efficacy of an electrochemical catalyst. In this paper, we develop a Bayesian data analysis approach to estimate the Tafel slope from experimentally-measured current-voltage data. Our approach obviates the human intervention required by current literature practice for Tafel estimation, and provides robust, distributional uncertainty estimates. Using synthetic data, we illustrate how data insufficiency can unknowingly influence current fitting approaches, and how our approach allays these concerns. We apply our approach to conduct a comprehensive re-analysis of data from the CO₂ reduction literature. This analysis reveals no systematic preference for Tafel slopes to cluster around certain "cardinal values” (e.g. 60 or 120 mV/decade). We hypothesize several plausible physical explanations for this observation, and discuss the implications of our finding for mechanistic analysis in electrochemical kinetic investigations.en_US
dc.description.sponsorshipNational Science Foundation (Grants 1745302, 1955628)en_US
dc.description.sponsorshipAir Force Office of Scientific Research (Award FA9550-18-1-0420)en_US
dc.publisherSpringer Science and Business Media LLCen_US
dc.relation.isversionofhttps://doi.org/10.1038/s41467-021-20924-yen_US
dc.rightsCreative Commons Attribution 4.0 International licenseen_US
dc.rights.urihttps://creativecommons.org/licenses/by/4.0/en_US
dc.sourceNatureen_US
dc.titleBayesian data analysis reveals no preference for cardinal Tafel slopes in CO2 reduction electrocatalysisen_US
dc.typeArticleen_US
dc.identifier.citationLimaye, Aditya M. "Bayesian data analysis reveals no preference for cardinal Tafel slopes in CO2 reduction electrocatalysis." Nature Communications 12, 1 (January 2021): 703 © 2021 The Author(s)en_US
dc.contributor.departmentMassachusetts Institute of Technology. Department of Chemical Engineeringen_US
dc.contributor.departmentMassachusetts Institute of Technology. Department of Chemistryen_US
dc.relation.journalNature Communicationsen_US
dc.eprint.versionFinal published versionen_US
dc.type.urihttp://purl.org/eprint/type/JournalArticleen_US
eprint.statushttp://purl.org/eprint/status/PeerRevieweden_US
dspace.date.submission2021-05-25T17:52:50Z
mit.journal.volume12en_US
mit.journal.issue1en_US
mit.licensePUBLISHER_CC
mit.metadata.statusCompleteen_US


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