Journal ArticleDOI
Water stability and adsorption in metal-organic frameworks.
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This article is published in Chemical Reviews.The article was published on 2014-09-29. It has received 1800 citations till now. The article focuses on the topics: Adsorption.read more
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Metal-organic frameworks: functional luminescent and photonic materials for sensing applications.
TL;DR: This comprehensive review summarizes the topical developments in the field of luminescent MOF and MOF-based photonic crystals/thin film sensory materials.
Journal ArticleDOI
Carbon capture and storage (CCS): the way forward
Mai Bui,Claire S. Adjiman,André Bardow,Edward J. Anthony,Andy Boston,Solomon Brown,Paul S. Fennell,Sabine Fuss,Amparo Galindo,Leigh A. Hackett,Jason P. Hallett,Howard J. Herzog,George Jackson,Jasmin Kemper,Samuel Krevor,Geoffrey C. Maitland,Michael Matuszewski,Ian S. Metcalfe,Camille Petit,Graeme Puxty,Jeffrey A. Reimer,David Reiner,Edward S. Rubin,Stuart A. Scott,Nilay Shah,Berend Smit,Berend Smit,J. P. Martin Trusler,Paul A. Webley,Jennifer Wilcox,Niall Mac Dowell +30 more
TL;DR: In this article, the authors review the current state-of-the-art of CO2 capture, transport, utilisation and storage from a multi-scale perspective, moving from the global to molecular scales.
Journal ArticleDOI
Stable Metal-Organic Frameworks: Design, Synthesis, and Applications.
Shuai Yuan,Liang Feng,Kecheng Wang,Jiandong Pang,Matheiu Bosch,Christina T. Lollar,Yujia Sun,Jun-Sheng Qin,Xinyu Yang,Peng Zhang,Qi Wang,Lanfang Zou,Yingmu Zhang,Liangliang Zhang,Yu Fang,Jialuo Li,Hong-Cai Zhou +16 more
TL;DR: This review is expected to guide the design of stable MOFs by providing insights into existing structures, which could lead to the discovery and development of more advanced functional materials.
Journal ArticleDOI
Zr-based metal-organic frameworks: design, synthesis, structure, and applications.
TL;DR: Advances in Zr-MOFs since 2008 are summarized and reviewed from three aspects: design and synthesis, structure, and applications to provide guidance for the in-depth investigation of MOFs towards practical applications.
Journal ArticleDOI
Poly(ethylene oxide)-based electrolytes for lithium-ion batteries
Zhigang Xue,Dan He,Xiaolin Xie +2 more
TL;DR: In this article, a review of the recent developments and issues concerning polyethylene oxide (PEO) based electrolytes for lithium-ion batteries is presented, including blending, modifying and making PEO derivatives.
References
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Journal ArticleDOI
Reporting physisorption data for gas/solid systems with special reference to the determination of surface area and porosity (Recommendations 1984)
TL;DR: Mise au point comportant des definitions generales et la terminologie, la methodologie utilisee, les procedes experimentaux, les interpretations des donnees d'adsorption, les determinations de l'aire superficielle, and les donnes sur la mesoporosite et la microporosite.
Journal ArticleDOI
The Chemistry and Applications of Metal-Organic Frameworks
Hiroyasu Furukawa,Hiroyasu Furukawa,Kyle E. Cordova,Kyle E. Cordova,Michael O'Keeffe,Michael O'Keeffe,Omar M. Yaghi,Omar M. Yaghi,Omar M. Yaghi +8 more
TL;DR: Metal-organic frameworks are porous materials that have potential for applications such as gas storage and separation, as well as catalysis, and methods are being developed for making nanocrystals and supercrystals of MOFs for their incorporation into devices.
Journal ArticleDOI
Hard and soft acids and bases
TL;DR: In this paper, the rate data for the generalized nucleophilic displacement reaction were reviewed, and the authors presented a method to estimate the rate of the generalized displacement reaction in terms of the number of nucleophiles.
Journal ArticleDOI
UFF, a full periodic table force field for molecular mechanics and molecular dynamics simulations
TL;DR: In this article, the Universal force field (UFF) is described, where the force field parameters are estimated using general rules based only on the element, its hybridization, and its connectivity.
Book
Understanding Molecular Simulation: From Algorithms to Applications
Daan Frenkel,Berend Smit +1 more
TL;DR: In this paper, the physics behind molecular simulation for materials science is explained, and the implementation of simulation methods is illustrated in pseudocodes and their practical use in the case studies used in the text.