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Autonomous Reaction Network Exploration in Homogeneous and Heterogeneous Catalysis
Autonomous computations that rely on automated reaction network elucidation algorithms may pave the way to make computational catalysis on a par with experimental research in the field. Several advantages of this approach are key to catalysis: (i) automation allows one to consider orders of magnitud...
| Autores principales: | , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Springer US
2022
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8816766/ https://www.ncbi.nlm.nih.gov/pubmed/35185305 http://dx.doi.org/10.1007/s11244-021-01543-9 |