Review
Open access
Jul 2026
Leveraging Large Language Models for Understanding Fundamental Principles of Catalysis
This perspective focuses on three opportunities where LLMs can significantly contribute to catalysis: (1) text to properties; (2) text to structure; and (3) text to mechanistic models.
Shane S Michtavy, Sinhara M. H. D. Perera, Marc D. Porosoff
· The journal of physical chem... · 0 citations