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. 2019 Feb 11;10:704. doi: 10.1038/s41467-019-08657-5

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© The Author(s) 2019

Open Access This article is licensed under a Creative Commons Attribution 4.0 International License, which permits use, sharing, adaptation, distribution and reproduction in any medium or format, as long as you give appropriate credit to the original author(s) and the source, provide a link to the Creative Commons license, and indicate if changes were made. The images or other third party material in this article are included in the article’s Creative Commons license, unless indicated otherwise in a credit line to the material. If material is not included in the article’s Creative Commons license and your intended use is not permitted by statutory regulation or exceeds the permitted use, you will need to obtain permission directly from the copyright holder. To view a copy of this license, visit http://creativecommons.org/licenses/by/4.0/.

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Fig. 3 — Computational analysis of the peroxidase-mimicking activity of ABO₃ perovskite TMOs. a Proposed sub-processes responsible for the oxidation of TMB to _oxTMB with the (001) facet of ABO₃ as peroxidase mimics. b, c Adsorption energies of O (E_ads,O) and OH (E_ads,OH) plotted as a function of e_g occupancy, where E_ads and e_g occupancy were obtained by calculations and experiments, respectively. Source data are provided as a Source Data file