ArticleJournal of the American Chemical Society2021
Charting the Complete Thermodynamic Landscape of Gas Adsorption for a Responsive Metal-Organic Framework.
Article in Journal of the American Chemical Society, 2021. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 12 papers.
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Who cites it
12 citing papers in PubMed.
- Adsorption and Separation by Flexible MOFs.Advanced materials (Deerfield Beach, Fla.) · 2025Review
- Computational Modeling of Reticular Materials: The Past, the Present, and the Future.Advanced materials (Deerfield Beach, Fla.) · 2025Review
- Computational Simulations of Metal-Organic Frameworks to Enhance Adsorption Applications.Advanced materials (Deerfield Beach, Fla.) · 2025Review
- Elucidating the Structure and the Impact of Synthesis Methods on the Flexibility of the Metal-Organic Framework MIL-88 A (Fe) During Water Capture.Small (Weinheim an der Bergstrasse, Germany) · 2025Article
- Negative gas adsorption transitions and pressure amplification phenomena in porous frameworks.Chemical Society reviews · 2025Review
- Ab Initio Predictions of Adsorption in Flexible Metal-Organic Frameworks for Water Harvesting Applications.Journal of the American Chemical Society · 2025Article
- Theoretical isotherm equation for adsorption-induced structural transition on flexible metal-organic frameworks.Proceedings of the National Academy of Sciences of the United States of America · 2023Article
- On the role of history-dependent adsorbate distribution and metastable states in switchable mesoporous metal-organic frameworks.Nature communications · 2023Article
- Cutting-edge molecular modelling to unveil new microscopic insights into the guest-controlled flexibility of metal-organic frameworks.Chemical science · 2022Article
- Cooperative light-induced breathing of soft porous crystals via azobenzene buckling.Nature communications · 2022Article
- MOFs in the time domain.Nature reviews. Chemistry · 2022Review
- Unraveling the Guest-Induced Switchability in the Metal-Organic Framework DUT-13(Zn)*.Chemistry (Weinheim an der Bergstrasse, Germany) · 2021Article
Corrections and comments
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Authors and funding
5 authors.
Funding
No grant is acknowledged in the PubMed record.
Abstract
New nanoporous materials have the ability to revolutionize adsorption and separation processes. In particular, materials with adaptive cavities have high selectivity and may display previously undiscovered phenomena, such as negative gas adsorption (NGA), in which gas is released from the framework upon an increase in pressure. Although the thermodynamic driving force behind this and many other counterintuitive adsorption phenomena have been thoroughly investigated in recent years, several experimental observations remain difficult to explain. This necessitates a comprehensive analysis of gas adsorption akin to the conformational free energy landscapes used to understand the function of proteins. We have constructed the complete thermodynamic landscape of methane adsorption on DUT-49. Traversing this complex landscape reproduces the experimentally observed structural transitions, temperature dependence, and the hysteresis between adsorption and desorption. The complete thermodynamic description presented here provides unparalleled insight into adsorption and provides a framework to understand other adsorbents that challenge our preconceptions.
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Registered trials
Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the OpenQuestion graph.