DOI: 10.1039/d3cc03229a ISSN: 1359-7345
Mechanism to model: a physical organic chemistry approach to reaction prediction
Jolene P. Reid, Isaiah O. Betinol, Yutao Kuang- Materials Chemistry
- Metals and Alloys
- Surfaces, Coatings and Films
- General Chemistry
- Ceramics and Composites
- Electronic, Optical and Magnetic Materials
- Catalysis
Combining a working knowledge of reaction mechanism with statistical modelling is a powerful approach to prediction.