Effect of hydrogen-bonding networks in water on the proton conductivity properties of metal–organic frameworks

My V. Nguyen1,2, Hieu C. Dong1,3, Duc Nguyen-Manh4, Nam H. Vu3,5, Thuat T. Trinh6, Thang B. Phan1,3
1Center for Innovative Materials and Architectures (INOMAR), Ho Chi Minh City, Viet Nam
3Vietnam National University-Ho Chi Minh (VNU-HCM), Ho Chi Minh City, Viet Nam
4Culham Centre for Fusion Energy, United Kingdom Atomic Energy Authority, OX143DB, Abingdon, UK
5Faculty of Materials Science and Technology, Ho Chi Minh City, Viet Nam
6Department of Civil and Environmental Engineering, Norwegian University of Science and Technology, S.P Andersen Vei 5, 7491, Trondheim, Norway

Tài liệu tham khảo

Steele, 2001, Materials for fuel-cell technologies, Nature, 414, 345, 10.1038/35104620 Li, 2003, Approaches and recent development of polymer electrolyte membranes for fuel cells operating above 100 °C, Chem. Mater., 15, 4896, 10.1021/cm0310519 Paddison, 2003, Proton conduction mechanisms at low degrees of hydration in sulfonic acid-based polymer electrolyte membranes, Annu. Rev. Mater. Res., 33, 289, 10.1146/annurev.matsci.33.022702.155102 Mauritz, 2004, State of understanding of nafion, Chem. Rev., 104, 4535, 10.1021/cr0207123 Fang, 2002, Novel sulfonated polyimides as polyelectrolytes for fuel cell application. 1. Synthesis, proton conductivity, and water stability of polyimides from 4,4‘-Diaminodiphenyl ether-2,2‘-disulfonic acid, Macromolecules, 35, 9022, 10.1021/ma020005b Wang, 2002, Nafion-bifunctional silica composite proton conductive membranes, J. Mater. Chem., 12, 834, 10.1039/b107498a Peighambardoust, 2010, Review of the proton exchange membranes for fuel cell applications, Int. J. Hydrogen Energy, 35, 9349, 10.1016/j.ijhydene.2010.05.017 Yamada, 2013, Designer coordination polymers: dimensional crossover architectures and proton conduction, Chem. Soc. Rev., 42, 6655, 10.1039/c3cs60028a Guo, 2015, New anhydrous proton exchange membranes for high-temperature fuel cells based on PVDF–PVP blended polymers, J. Mater. Chem. A., 3, 148, 10.1039/C4TA04952G Ramaswamy, 2014, MOFs as proton conductors-challenges and opportunities, Chem. Soc. Rev., 43, 5913, 10.1039/C4CS00093E Meng, 2017, Proton-conducting crystalline porous materials, Chem. Soc. Rev., 46, 464, 10.1039/C6CS00528D Tu, 2016, High proton conductivity at low relative humidity in an anionic Fe-based metal–organic framework, J. Mater. Chem. A, 4, 3638, 10.1039/C5TA10467J Cavka, 2018, A new zirconium inorganic building brick forming metal organic frameworks with exceptional stability, J. Am. Chem. Soc., 130, 13850, 10.1021/ja8057953 Jiang, 2013, An exceptionally stable, porphyrinic Zr metal-organic framework exhibiting pH-dependent fluorescence, J. Am. Chem. Soc., 135, 13934, 10.1021/ja406844r Lo, 2017, An anchoring strategy leads to enhanced proton conductivity in a new metal-organic framework, Inorg. Chem. Front., 4, 1509, 10.1039/C7QI00350A Nguyen, 2018, Enhancing proton conductivity in a metal–organic framework at T> 80 °C by an anchoring strategy, J. Mater. Chem. A, 6, 1816, 10.1039/C7TA10148A Rijn, 2013, Challenges and advances in the field of self-assembled membranes, Chem. Soc. Rev., 42, 6578, 10.1039/c3cs60125k Yoon, 2013, Proton conduction in metal-organic frameworks and related modularly built porous solids, Angew. Chem. Int. Ed., 52, 2688, 10.1002/anie.201206410 Lim, 2019, Proton transfer in hydrogen-bonded degenerate systems of water and ammonia in metal-organic frameworks, Chem. Sci., 10, 16, 10.1039/C8SC04475A Costantino, 2012, Survey on the phase transitions and their effect on the ion-exchange and on the proton-conduction properties of a flexible and robust Zr phosphonate coordination polymer, Inorg. Chem., 51, 6992, 10.1021/ic3009656 Taylor, 2013, A water-stable metal-organic framework with highly acidic pores for proton-conducting applications, J. Am. Chem. Soc., 135, 1193, 10.1021/ja310435e Ramaswamy, 2014, Highly proton conductive nanoporous coordination polymers with sulfonic acid groups on the pore surface, Chem. Commun., 50, 1144, 10.1039/C3CC47980C Wu, 2010, Enhancing the stability of metal-organic frameworks in humid air by incorporating water repellent functional groups, Chem. Commun., 46, 6120, 10.1039/c0cc01170c Nagarkar, 2014, Two-in-one: inherent anhydrous and water-assisted high proton conduction in a 3D metal-organic framework, Angew. Chem. Int. Ed., 53, 2638, 10.1002/anie.201309077 Vu, 2020, Mechanism of proton transport in water cluster and the effect of electric field, Curr. Appl. Phys., 25, 62, 10.1016/j.cap.2021.02.006 Zhang, 2018, Extra water- and acid-stable MOF-801 with high proton conductivity and its composite membrane for proton-exchange membrane, ACS Appl. Mater. Interfaces, 10, 28656, 10.1021/acsami.8b09070 Furukawa, 2014, Water adsorption in porous metal-organic frameworks and related materials, J. Am. Chem. Soc., 136, 4369, 10.1021/ja500330a Shimizu, 2013, Proton conduction with metal-organic frameworks, Science, 341, 354, 10.1126/science.1239872 Allcock, 2006, Ultraviolet photolithographic development of polyphosphazene hydrogel microstructures for potential use in microarray biosensors, Chem. Mater., 18, 609, 10.1021/cm050316b Price, 2004, A modified TIP3P water potential for simulation with Ewald summation, J. Chem. Phys., 121, 10096, 10.1063/1.1808117 Abascal, 2005, A general purpose model for the condensed phases of water: TIP4P/2005, J. Chem. Phys., 123, 234505, 10.1063/1.2121687 Rick, 2004, A reoptimization of the five-site water potential (TIP5P) for use with Ewald sums, J. Chem. Phys., 120, 6085, 10.1063/1.1652434 Brini, 2017, How water's properties are encoded in its molecular structure and energies, Chem. Rev., 117, 12385, 10.1021/acs.chemrev.7b00259 Rudenko, 2014, Multiscale modeling of water in Mg-MOF-74: from electronic structure calculations to adsorption isotherms, J. Phys. Chem. C, 118, 16218, 10.1021/jp503778m Chen, 2012, Improving predictions of gas adsorption in metal-organic frameworks with coordinatively unsaturated metal sites: model potentials, ab initio parameterization, and GCMC simulations, J. Phys. Chem. C, 116, 18899, 10.1021/jp3062527 Dzubak, 2012, Ab initio carbon capture in open-site metal-organic frameworks, Nat. Chem., 4, 810, 10.1038/nchem.1432 Krishna, 2011, In silico screening of metal–organic frameworks in separation applications, Phys. Chem. Chem. Phys., 13, 10593, 10.1039/c1cp20282k Dannenberg, 1998, An introduction to hydrogen bonding by George A. Jeffrey, J. Am. Chem. Soc., 120 Steiner, 2002, The hydrogen bond in the solid state, Angew. Int. Ed. Chem., 41, 49, 10.1002/1521-3773(20020104)41:1<48::AID-ANIE48>3.0.CO;2-U Zhang, 2018, Computer-aided design of molecularly imprinted polymers for simultaneous detection of clenbuterol and its metabolites, Polymers, 11, 17, 10.3390/polym11010017 Jeffrey, 2003, Hydrogen-bonding: an update, Crystallogr. Rev., 9, 135, 10.1080/08893110310001621754 Tachikawa, 2015, Proton transfer rates in ionized water clusters (H2O)n (n = 2-4), RSC Adv, 5, 6945, 10.1039/C4RA14763D Kaila, 2011, Energetics and dynamics of proton transfer reactions along short water wires, Phys. Chem. Chem. Phys., 13, 13207, 10.1039/c1cp21112a Ngam, 2011, Proton transfer reactions and dynamics in protonated water clusters, Phys. Chem. Chem. Phys., 13, 4562, 10.1039/c0cp02068k Prodi, 2008, The nature of hydrogen bond: new insights into old theories, Acta Chim. Slov., 55, 692 Sun, 2019, A path to improve proton conductivity: from a 3D hydrogen-bonded organic framework to a 3D copper-organic framework, New J. Chem., 43, 10637, 10.1039/C9NJ02025J Dong, 2019, A proton transfer mechanism along the PO4 anion chain in the [Zn(HPO4)(H2PO4)]2- coordination polymer, Phys. Chem. Chem. Phys., 21, 18605, 10.1039/C9CP04216D Umeyama, 2012, Inherent proton conduction in a 2D coordination framework, J. Am. Chem. Soc., 134, 12780, 10.1021/ja304693r