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Combining Machine Learning and Molecular Simulations to Unlock Gas Separation Potentials of MOF Membranes and MOF/Polymer MMMs
[Image: see text] Due to the enormous increase in the number of metal-organic frameworks (MOFs), combining molecular simulations with machine learning (ML) would be a very useful approach for the accurate and rapid assessment of the separation performances of thousands of materials. In this work, we...
Autores principales: | , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American Chemical Society
2022
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9305976/ https://www.ncbi.nlm.nih.gov/pubmed/35818710 http://dx.doi.org/10.1021/acsami.2c08977 |