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CO(2) induced phase transitions in diamine-appended metal–organic frameworks
Using a combination of density functional theory and lattice models, we study the effect of CO(2) adsorption in an amine functionalized metal–organic framework. These materials exhibit a step in the adsorption isotherm indicative of a phase change. The pressure at which this step occurs is not only...
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| Publicado no: | Chem Sci |
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| Main Authors: | , , , , , , , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
Royal Society of Chemistry
2015
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC5500831/ https://ncbi.nlm.nih.gov/pubmed/28717499 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1039/c5sc01828e |
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