The DOI matches its Crossref record; 43 of the 43 references it cites were found in a registry or an index.
Thermodynamics of Guest-Induced Structural Transitions in Hybrid Organic−Inorganic Frameworks
Open accessAbstract
We provide a general thermodynamic framework for the understanding of guest-induced structural transitions in hybrid organic-inorganic materials. The method is based on the analysis of experimental adsorption isotherms. It allows the determination of the free energy differences between host structures involved in guest-induced transitions, especially hard to obtain experimentally. We discuss the general case of adsorption in flexible materials and show how a few key quantities, such as pore volumes and adsorption affinities, entirely determine the phenomenology of adsorption, including the occurrence of structural transitions. On the basis of adsorption thermodynamics, we then propose a taxonomy of guest-induced structural phase transitions and the corresponding isotherms. In particular, we derive generic conditions for observing a double structural transition upon adsorption, often resulting in a two-step isotherm. Finally, we show the wide applicability and the robustness of the model through three case studies of topical hybrid organic-inorganic frameworks: the hysteretic hydrogen adsorption in Co(1,4-benzenedipyrazolate), the guest-dependent gate-opening in Cu(4,4'-bipyridine)(2,5-dihydroxybenzoate)2 and the CO2-induced "breathing" of hybrid material MIL-53.
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Cites
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Functional Porous Coordination Polymers
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High-Throughput Synthesis of Zeolitic Imidazolate Frameworks and Application to CO 2 Capture
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Crystallized Frameworks with Giant Pores: Are There Limits to the Possible?
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Self-citationHydrogen Sorption in Functionalized Metal−Organic Frameworks
Rowsell, J. L. C., Millward, A. R., Park, K. S., & Yaghi, O. M. (2004) · Journal of the American Chemical Society · doi:10.1021/ja049408c · Cited by 1,326
Cited by
Horike, S., Shimomura, S., & Kitagawa, S. (2009) · Nature Chemistry · doi:10.1038/nchem.444 · Cited by 2,486
Metal–Organic Frameworks: Opportunities for Catalysis
Farrusseng, D., Aguado, S., & Pinel, C. (2009) · Angewandte Chemie International Edition · doi:10.1002/anie.200806063 · Cited by 1,888
Methane storage in flexible metal–organic frameworks with intrinsic thermal management
Mason, J. A., Oktawiec, J., Taylor, M. K., Hudson, M. R., Rodriguez, J., Bachman, J. E., Gonzalez, M. I., Cervellino, A., Guagliardi, A., Brown, C. M., et al. (2015) · Nature · doi:10.1038/nature15732 · Cited by 1,076
CO2 Capture and Separations Using MOFs: Computational and Experimental Studies
Yu, J., Xie, L.-H., Li, J.-R., Ma, Y., Seminario, J. M., & Balbuena, P. B. (2017) · Chemical Reviews · doi:10.1021/acs.chemrev.6b00626 · Cited by 1,047
An Amine-Functionalized MIL-53 Metal−Organic Framework with Large Separation Power for CO 2 and CH 4
Couck, S., Denayer, J. F. M., Baron, G. V., Rémy, T., Gascon, J., & Kapteijn, F. (2009) · Journal of the American Chemical Society · doi:10.1021/ja900555r · Cited by 988
Coudert, F.-X. (2015) · Chemistry of Materials · doi:10.1021/acs.chemmater.5b00046 · Cited by 528
Self-citationMOFs for Use in Adsorption Heat Pump Processes
Henninger, S. K., Jeremias, F., Kummer, H., & Janiak, C. (2012) · European Journal of Inorganic Chemistry · doi:10.1002/ejic.201101056 · Cited by 318
Solid Solutions of Soft Porous Coordination Polymers: Fine‐Tuning of Gas Adsorption Properties
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Functionalized MOFs for Enhanced CO2 Capture
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Self-citationStress-Based Model for the Breathing of Metal−Organic Frameworks
Neimark, A. V., Coudert, F.-X., Boutin, A., & Fuchs, A. H. (2010) · The Journal of Physical Chemistry Letters · doi:10.1021/jz9003087 · Cited by 254
Self-citationGating effect for gas adsorption in microporous materials—mechanisms and applications
Chen, K., Mousavi, S. H., Singh, R., Snurr, R. Q., Li, G., & Webley, P. A. (2022) · Chemical Society Reviews · doi:10.1039/d1cs00822f · Cited by 133
Thermodynamic analysis of framework deformation in Na,Cs-RHO zeolite upon CO 2 adsorption
Pera-Titus, M., Palomino, M., Valencia, S., & Rey, F. (2014) · Phys. Chem. Chem. Phys. · doi:10.1039/c4cp03409k · Cited by 22
Metadata
- Authors
- Coudert, F.-X., Jeffroy, M., Fuchs, A. H., Boutin, A., & Mellot-Draznieks, C.
- Venue
- Journal of the American Chemical Society
- Publisher
- American Chemical Society (ACS)
- Published
- 2008-09-27
- Volume
- 130
- Issue
- 43
- Pages
- 14294-14302
- ISSN
- 0002-7863 (ISSN-L)
- 1520-5126
- OpenAlex
- W2016885611
- Cited by
- 337
- References
- 43
- FWCI
- 12.01
- Type
- journal article
- Language
- en
- Open access
- green
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