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Combined GCMC, MD, and DFT Approach for Unlocking the Performances of COFs for Methane Purification
[Image: see text] Covalent organic frameworks (COFs) are promising materials for gas storage and separation; however, the potential of COFs for separation of CH(4) from industrially relevant gases such as H(2), N(2), and C(2)H(6) is yet to be investigated. In this work, we followed a multiscale comp...
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical Society
2021
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8431337/ https://www.ncbi.nlm.nih.gov/pubmed/34526735 http://dx.doi.org/10.1021/acs.iecr.1c01742 |