Molecular simulation of carbon dioxide/methane/hydrogen mixture adsorption in metal-organic frameworks.
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Summary
This work performs a systematic computational study toward a molecular understanding of the separation characteristics of metal-organic frameworks (MOFs), for which the purification of synthetic gas by two representative MOFs, MOF-5 and Cu-BTC, is adopted as an example.
- Type
- article
- Published
- 2006-08-19
- Cited by
- 514
- References
- 0
- OpenAlex
- https://openalex.org/W1987736265
- Semantic Scholar
- https://api.semanticscholar.org/CorpusID:34985015
Keywords
Metal-organic framework, Adsorption, Methane, Gas separation, Selectivity
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