1. Addressing complexity in catalyst design: From volcanos and scaling to more sophisticated design strategies.
- Author
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Stratton, Sarah M., Zhang, Shengjie, and Montemore, Matthew M.
- Subjects
- *
CATALYSTS , *HETEROGENEOUS catalysis - Abstract
Volcano plots and scaling relations are commonly used to design catalysts and understand catalytic behavior. These plots are a useful tool due to their robust and simple analysis of catalysis; however, catalysts that follow the volcano plot paradigm have an inherent limit to their performance. Scaling and Brønsted-Evans-Polanyi (BEP) relations, which are linear correlations in reaction energetics, force tradeoffs when optimizing catalysts, which leads to this limit on performance. Therefore, materials and design strategies that are not limited by volcano plots and scaling relations are of high interest, and this is the focus of this Report. We first give an overview of volcano plots and scaling relations. Deviations from scaling relations and the volcano plot and their causes are discussed in more detail. Finally, design strategies that do not rely on the volcano plot paradigm are reviewed. • Volcano plots are powerful tools in catalyst design. • Catalysts that conform to volcano plots have a limit to their performance. • There are many ways to deviate from the volcano plot and underlying scaling relations. • New design strategies have been developed to handle cases that do not obey volcano plots and scaling relations. [ABSTRACT FROM AUTHOR]
- Published
- 2023
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