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The combination of computational chemistry and catalysis is an insightful approach that can be utilized to predict and design a catalyst, its function and the outcome of the catalytic chemical… Click to show full abstract
The combination of computational chemistry and catalysis is an insightful approach that can be utilized to predict and design a catalyst, its function and the outcome of the catalytic chemical reaction that this catalyst activates in terms of activity, selectivity and applications. [...]
Keywords:
computational chemistry;
chemistry catalysis;
catalysis prediction;
chemistry;
design
Journal Title: Catalysts
Year Published: 2023
Link to full text (if available)
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Journal Title: Catalysts
Year Published: 2023
Link to full text (if available)
Share on Social Media: Sign Up to like & get
recommendations!