Elucidating the validity of electronic characteristics of transition metal perovskites as descriptors bridging electro- and chemocatalysis

Journal Article · 02 November 2023 · EES Catalysis

DOI: https://doi.org/10.1039/D3EY00206C · OSTI ID:2000805

Mürtz, Sonja D.  ^[1]; Simböck, Johannes  ^[2]; Zeng, Feng  ^[3]; Ghiasi, Mahnaz ^[4]; Schönebaum, Simon  ^[5]; Simon, Ulrich  ^[5]; de Groot, Frank M. F.  ^[4]; Palkovits, Regina  ^[2]

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1. Chair of Heterogeneous Catalysis and Chemical Technology, RWTH Aachen University, Worringerweg 2, 52074 Aachen, Germany
2. Chair of Heterogeneous Catalysis and Chemical Technology, RWTH Aachen University, Worringerweg 2, 52074 Aachen, Germany, Center for Automotive Catalytic Systems Aachen, RWTH Aachen University, Aachen, 52074, Germany
3. State Key Laboratory of Materials-Oriented Chemical Engineering, College of Chemical Engineering, Nanjing Tech University, Nanjing, 211816, China, Chair of Heterogeneous Catalysis and Chemical Technology, RWTH Aachen University, Worringerweg 2, 52074 Aachen, Germany
4. Inorganic Chemistry and Catalysis, Debye Institute for Nanomaterials Science, Utrecht University, Universiteitsweg 99, 3584 CG Utrecht, The Netherlands
5. Center for Automotive Catalytic Systems Aachen, RWTH Aachen University, Aachen, 52074, Germany, Institute of Inorganic Chemistry, RWTH Aachen University, Landoltweg 1a, 52074 Aachen, Germany

The analysis of electronic characteristics as descriptors for the efficacy of catalysts provides fundamental insights into catalyst design criteria, but few studies address the applicability of descriptors across a broader range of reactions.

• Sponsoring Organization: USDOE
• Grant/Contract Number: NONE; AC02-05CH11231
• OSTI ID: 2000805
• Journal Information: EES Catalysis, Journal Name: EES Catalysis Journal Issue: 6 Vol. 1; ISSN 2753-801X; ISSN ECEACE
• Publisher: Royal Society of Chemistry (RSC)Copyright Statement
• Country of Publication: United States
• Language: English