The DOI matches its Crossref record; 45 of the 45 references it cites were found in a registry or an index.
Adsorption of CO2, CH4, and N2 on Zeolitic Imidazolate Frameworks: Experiments and Simulations
Abstract
Experimental measurements and molecular simulations were conducted for two zeolitic imidazolate frameworks, ZIF‐8 and ZIF‐76. The transferability of the force field was tested by comparing molecular simulation results of gas adsorption with experimental data available in the literature for other ZIF materials (ZIF‐69). Owing to the good agreement observed between simulation and experimental data, the simulation results can be used to identify preferential adsorption sites, which are located close to the organic linkers. Topological mapping of the potential‐energy surfaces makes it possible to relate the preferential adsorption sites, Henry constant, and isosteric heats of adsorption at zero coverage to the nature of the host–guest interactions and the chemical nature of the organic linker. The role played by the topology of the solid and the organic linkers, instead of the metal sites, upon gas adsorption on zeolite‐like metal–organic frameworks is discussed.
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Cites
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Cited by
Chizallet, C., Lazare, S., Bazer-Bachi, D., Bonnier, F., Lecocq, V., Soyer, E., Quoineaud, A.-A., & Bats, N. (2010) · Journal of the American Chemical Society · doi:10.1021/ja103365s · Cited by 586
Self-citationTrends in Solid Adsorbent Materials Development for CO 2 Capture
Pardakhti, M., Jafari, T., Tobin, Z., Dutta, B., Moharreri, E., Shemshaki, N. S., Suib, S., & Srivastava, R. (2019) · ACS Applied Materials & Interfaces · doi:10.1021/acsami.9b08487 · Cited by 357
Zhou, H., Hui, X., Li, D., Hu, D., Chen, X., He, X., Gao, L., Huang, H., Lee, C., & Mu, X. (2020) · Advanced Science · doi:10.1002/advs.202001173 · Cited by 136
Performance-Based Screening of Porous Materials for Carbon Capture
Farmahini, A. H., Krishnamurthy, S., Friedrich, D., Brandani, S., & Sarkisov, L. (2021) · Chemical Reviews · doi:10.1021/acs.chemrev.0c01266 · Cited by 7
Metadata
- Authors
- Pérez‐Pellitero, J., Amrouche, H., Siperstein, F. R., Pirngruber, G., Nieto‐Draghi, C., Chaplais, G., Simon‐Masseron, A., Bazer‐Bachi, D., Peralta, D., & Bats, N.
- Venue
- Chemistry – A European Journal
- Publisher
- Wiley
- Published
- 2010-01-26
- Volume
- 16
- Issue
- 5
- Pages
- 1560-1571
- ISSN
- 0947-6539 (ISSN-L)
- 1521-3765
- OpenAlex
- W2051958965
- Cited by
- 417
- References
- 45
- FWCI
- 11.99
- Type
- journal article
- Language
- en
- Open access
- closed
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- Pérez‐Pellitero, J., Amrouche, H., Siperstein, F. R., Pirngruber, G., Nieto‐Draghi, C., Chaplais, G., Simon‐Masseron, A., Bazer‐Bachi, D., Peralta, D., & Bats, N. (2010). Adsorption of CO2, CH4, and N2 on Zeolitic Imidazolate Frameworks: Experiments and Simulations. Chemistry – A European Journal. https://doi.org/10.1002/chem.200902144
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