Record High Hydrogen Storage Capacity in the Metal–Organic Framework Ni2(m-dobdc) at Near-Ambient Temperatures

Kapelewski, Matthew T.; Runčevski, Tomče; Tarver, Jacob D.; Jiang, Henry H.; Hurst, Katherine E.; Parilla, Philip A.; Ayala, Anthony; Gennett, Thomas; FitzGerald, Stephen A.; Brown, Craig M.; Long, Jeffrey R.

doi:10.1021/acs.chemmater.8b03276

Title: Record High Hydrogen Storage Capacity in the Metal–Organic Framework Ni₂(m-dobdc) at Near-Ambient Temperatures

Journal Article · Wed Nov 07 00:00:00 EST 2018 · Chemistry of Materials

DOI:https://doi.org/10.1021/acs.chemmater.8b03276· OSTI ID:1975065

Kapelewski, Matthew T. ^[1]; Runčevski, Tomče ^[1]; Tarver, Jacob D. ^[2]; Jiang, Henry H. ^[1]; Hurst, Katherine E. ^[3]; Parilla, Philip A. ^[4]; Ayala, Anthony ^[5]; Gennett, Thomas ^[6];

^[7]; Brown, Craig M. ^[8];

^[1]

Univ. of California, Berkeley, CA (United States); Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
National Inst. of Standards and Technology (NIST), Gaithersburg, MD (United States); National Renewable Energy Laboratory (NREL), Golden, CO (United States). Chemistry and Nanoscience Center
National Renewable Energy Laboratory (NREL), Golden, CO (United States). Chemistry and Nanoscience Center
National Renewable Energy Laboratory (NREL), Golden, CO (United States)
National Inst. of Standards and Technology (NIST), Gaithersburg, MD (United States). Center for Neutron Research; Univ. of Maryland, College Park, MD (United States)
National Renewable Energy Laboratory (NREL), Golden, CO (United States). Chemistry and Nanoscience Center; Colorado School of Mines, Golden, CO (United States)
Oberlin College, OH (United States)
National Inst. of Standards and Technology (NIST), Gaithersburg, MD (United States). Center for Neutron Research; Univ. of Delaware, Newark, DE (United States)

Hydrogen holds promise as a clean alternative automobile fuel, but its on-board storage presents significant challenges due to the low temperatures and/or high pressures required to achieve a sufficient energy density. The opportunity to significantly reduce the required pressure for high density H₂ storage persists for metal-organic frameworks due to their modular structures and large internal surface areas. The measurement of H₂ adsorption in such materials under conditions most relevant to on-board storage is crucial to understanding how these materials would perform in actual applications, although such data have to date been lacking. In the present work, the metal-organic frameworks M₂(m-dobdc) (M = Co, Ni; m-dobdc^4- = 4,6-dioxido-1,3-benzenedicarboxylate) and the isomeric frameworks M₂(dobdc) (M = Co, Ni; dobdc^4- = 1,4-dioxido-1,3-benzenedicarboxylate), which are known to have open metal cation sites that strongly interact with H₂, were evaluated for their usable volumetric H₂ storage capacities over a range of near-ambient temperatures relevant to on-board storage. Based upon adsorption isotherm data, Ni₂(m-dobdc) was found to be the top-performing physisorptive storage material with a usable volumetric capacity between 100 and 5 bar of 11.0 g/L at 25 °C and 23.0 g/L with a temperature swing between -75 and 25 °C. Additional neutron diffraction and infrared spectroscopy experiments performed with in situ dosing of D₂ or H₂ were used to probe the hydrogen storage properties of these materials under the relevant conditions. Finally, the results provide benchmark characteristics for comparison with future attempts to achieve improved adsorbents for mobile hydrogen storage applications.

View Accepted Manuscript (DOE)

Cite

Export

Save

Research Organization:: Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)

Sponsoring Organization:: USDOE Office of Science (SC); USDOE Office of Energy Efficiency and Renewable Energy (EERE), Office of Sustainable Transportation. Hydrogen Fuel Cell Technologies Office (HFTO); National Science Foundation (NSF)

Grant/Contract Number:: AC02-05CH11231; AC36-08GO28308; CHE-1111896

OSTI ID:: 1975065

Journal Information:: Chemistry of Materials, Vol. 30, Issue 22; ISSN 0897-4756

Publisher:: American Chemical Society (ACS)Copyright Statement

Country of Publication:: United States

Language:: English

Citation Metrics:

Cited by: 134 works

Citation information provided by
Web of Science

References (49)

Hydrogen Storage in Metal–Organic Frameworks Suh, Myunghyun Paik; Park, Hye Jeong; Prasad, Thazhe Kootteri Chemical Reviews, Vol. 112, Issue 2, p. 782-835 https://doi.org/10.1021/cr200274s	journal	September 2011
Linker Installation: Engineering Pore Environment with Precisely Placed Functionalities in Zirconium MOFs Yuan, Shuai; Chen, Ying-Pin; Qin, Jun-Sheng Journal of the American Chemical Society, Vol. 138, Issue 28 https://doi.org/10.1021/jacs.6b04501	journal	July 2016
Capture of heavy hydrogen isotopes in a metal-organic framework with active Cu(I) sites Weinrauch, I.; Savchenko, I.; Denysenko, D. Nature Communications, Vol. 8, Issue 1 https://doi.org/10.1038/ncomms14496	journal	March 2017
M₂(m-dobdc) (M = Mg, Mn, Fe, Co, Ni) Metal–Organic Frameworks Exhibiting Increased Charge Density and Enhanced H₂ Binding at the Open Metal Sites Kapelewski, Matthew T.; Geier, Stephen J.; Hudson, Matthew R. Journal of the American Chemical Society, Vol. 136, Issue 34, p. 12119-12129 https://doi.org/10.1021/ja506230r	journal	August 2014
Optimum Conditions for Adsorptive Storage Bhatia, Suresh K.; Myers, Alan L. Langmuir, Vol. 22, Issue 4 https://doi.org/10.1021/la0523816	journal	February 2006
Techno-economic Analysis of Metal–Organic Frameworks for Hydrogen and Natural Gas Storage DeSantis, Daniel; Mason, Jarad A.; James, Brian D. Energy & Fuels, Vol. 31, Issue 2 https://doi.org/10.1021/acs.energyfuels.6b02510	journal	January 2017
Hydrogen Storage in a Microporous Metal−Organic Framework with Exposed Mn ²⁺ Coordination Sites Dincǎ, Mircea; Dailly, Anne; Liu, Yun Journal of the American Chemical Society, Vol. 128, Issue 51 https://doi.org/10.1021/ja0656853	journal	December 2006
Understanding Volumetric and Gravimetric Hydrogen Adsorption Trade-off in Metal–Organic Frameworks Gómez-Gualdrón, Diego A.; Wang, Timothy C.; García-Holley, Paula ACS Applied Materials & Interfaces, Vol. 9, Issue 39 https://doi.org/10.1021/acsami.7b01190	journal	April 2017
Automotive hydrogen storage system using cryo-adsorption on activated carbon Ahluwalia, R. K.; Peng, J. K. International Journal of Hydrogen Energy, Vol. 34, Issue 13 https://doi.org/10.1016/j.ijhydene.2009.05.023	journal	July 2009
Catenated metal-organic frameworks: Promising hydrogen purification materials and high hydrogen storage medium with further lithium doping Meng, Zhaoshun; Lu, Ruifeng; Rao, Dewei International Journal of Hydrogen Energy, Vol. 38, Issue 23 https://doi.org/10.1016/j.ijhydene.2013.05.140	journal	August 2013
A review on the current progress of metal hydrides material for solid-state hydrogen storage applications Rusman, N. A. A.; Dahari, M. International Journal of Hydrogen Energy, Vol. 41, Issue 28 https://doi.org/10.1016/j.ijhydene.2016.05.244	journal	July 2016
Hydrogen storage in metal–organic frameworks Murray, Leslie J.; Dincă, Mircea; Long, Jeffrey R. Chemical Society Reviews, Vol. 38, Issue 5, p. 1294-1314 https://doi.org/10.1039/b802256a	journal	January 2009
Hydrogen-storage materials for mobile applications Schlapbach, Louis; Züttel, Andreas Nature, Vol. 414, Issue 6861 https://doi.org/10.1038/35104634	journal	November 2001
Hydrogen Storage in Microporous Metal-Organic Frameworks Rosi, Nathaniel L.; Eckert, Juergen; Eddaoudi, Mohamed Science, Vol. 300, Issue 5622, p. 1127-1129 https://doi.org/10.1126/science.1083440	journal	May 2003
Hydrogen Storage in Microporous Metal-Organic Frameworks with Exposed Metal Sites Dincă, Mircea; Long, Jeffrey R. Angewandte Chemie International Edition, Vol. 47, Issue 36, p. 6766-6779 https://doi.org/10.1002/anie.200801163	journal	August 2008
Simulation and modelling of MOFs for hydrogen storage Basdogan, Yasemin; Keskin, Seda CrystEngComm, Vol. 17, Issue 2 https://doi.org/10.1039/C4CE01711K	journal	January 2015
The crystal structure of solid hydrogen Van Kranendonk, J.; Gush, H. P. Physics Letters, Vol. 1, Issue 1 https://doi.org/10.1016/0031-9163(62)90265-2	journal	April 1962
Enhanced H₂ Adsorption in Isostructural Metal−Organic Frameworks with Open Metal Sites: Strong Dependence of the Binding Strength on Metal Ions Zhou, Wei; Wu, Hui; Yildirim, Taner Journal of the American Chemical Society, Vol. 130, Issue 46, p. 15268-15269 https://doi.org/10.1021/ja807023q	journal	November 2008
Boron–nitrogen based hydrides and reactive composites for hydrogen storage Jepsen, Lars H.; Ley, Morten B.; Lee, Young-Su Materials Today, Vol. 17, Issue 3 https://doi.org/10.1016/j.mattod.2014.02.015	journal	April 2014
On hydrogen and hydrogen energy strategies Midilli, A.; Ay, M.; Dincer, I. Renewable and Sustainable Energy Reviews, Vol. 9, Issue 3 https://doi.org/10.1016/j.rser.2004.05.003	journal	June 2005
Role of Exposed Metal Sites in Hydrogen Storage in MOFs Vitillo, Jenny G.; Regli, Laura; Chavan, Sachin Journal of the American Chemical Society, Vol. 130, Issue 26, p. 8386-8396 https://doi.org/10.1021/ja8007159	journal	July 2008
Materials for hydrogen storage Züttel, Andreas Materials Today, Vol. 6, Issue 9 https://doi.org/10.1016/S1369-7021(03)00922-2	journal	September 2003
Evaluating metal–organic frameworks for natural gas storage Mason, Jarad A.; Veenstra, Mike; Long, Jeffrey R. Chemical Science, Vol. 5, Issue 1, p. 32-51 https://doi.org/10.1039/C3SC52633J	journal	January 2014
Scorpionate-Type Coordination in MFU-4 l Metal-Organic Frameworks: Small-Molecule Binding and Activation upon the Thermally Activated Formation of Open Metal Sites Denysenko, Dmytro; Grzywa, Maciej; Jelic, Jelena Angewandte Chemie International Edition, Vol. 53, Issue 23 https://doi.org/10.1002/anie.201310004	journal	May 2014
The U.S. Department of Energy's National Hydrogen Storage Project: Progress towards meeting hydrogen-powered vehicle requirements Satyapal, Sunita; Petrovic, John; Read, Carole Catalysis Today, Vol. 120, Issue 3-4 https://doi.org/10.1016/j.cattod.2006.09.022	journal	February 2007
Hydrogen as an energy carrier: Prospects and challenges Mazloomi, Kaveh; Gomes, Chandima Renewable and Sustainable Energy Reviews, Vol. 16, Issue 5 https://doi.org/10.1016/j.rser.2012.02.028	journal	June 2012
Cryogenic apparatus for diffuse reflection infrared spectroscopy with high-pressure capabilities FitzGerald, S. A.; Churchill, H. O. H.; Korngut, P. M. Review of Scientific Instruments, Vol. 77, Issue 9 https://doi.org/10.1063/1.2349289	journal	September 2006
Evaluating topologically diverse metal–organic frameworks for cryo-adsorbed hydrogen storage Gómez-Gualdrón, Diego A.; Colón, Yamil J.; Zhang, Xu Energy & Environmental Science, Vol. 9, Issue 10 https://doi.org/10.1039/C6EE02104B	journal	January 2016
Cigarette butt-derived carbons have ultra-high surface area and unprecedented hydrogen storage capacity Blankenship, L. Scott; Mokaya, Robert Energy & Environmental Science, Vol. 10, Issue 12 https://doi.org/10.1039/C7EE02616A	journal	January 2017
A pressure-amplifying framework material with negative gas adsorption transitions Krause, Simon; Bon, Volodymyr; Senkovska, Irena Nature, Vol. 532, Issue 7599 https://doi.org/10.1038/nature17430	journal	April 2016
Lithium-Doped Metal-Organic Frameworks for Reversible H₂ Storage at Ambient Temperature Han, Sang Soo; Goddard, William A. Journal of the American Chemical Society, Vol. 129, Issue 27 https://doi.org/10.1021/ja072599+	journal	June 2007
A comparative analysis of the cryo-compression and cryo-adsorption hydrogen storage methods Petitpas, G.; Bénard, P.; Klebanoff, L. E. International Journal of Hydrogen Energy, Vol. 39, Issue 20 https://doi.org/10.1016/j.ijhydene.2014.04.200	journal	July 2014
Theoretical Limits of Hydrogen Storage in Metal–Organic Frameworks: Opportunities and Trade-Offs Goldsmith, Jacob; Wong-Foy, Antek G.; Cafarella, Michael J. Chemistry of Materials, Vol. 25, Issue 16 https://doi.org/10.1021/cm401978e	journal	August 2013
Metal-Specific Interactions of H ₂ Adsorbed within Isostructural Metal–Organic Frameworks FitzGerald, Stephen A.; Burkholder, Brian; Friedman, Michael Journal of the American Chemical Society, Vol. 133, Issue 50 https://doi.org/10.1021/ja2071384	journal	December 2011
Liquid organic and inorganic chemical hydrides for high-capacity hydrogen storage Zhu, Qi-Long; Xu, Qiang Energy & Environmental Science, Vol. 8, Issue 2 https://doi.org/10.1039/C4EE03690E	journal	January 2015
Mesoporous MCM-41 material for hydrogen storage: A short review Dündar-Tekkaya, Ezgi; Yürüm, Yuda International Journal of Hydrogen Energy, Vol. 41, Issue 23 https://doi.org/10.1016/j.ijhydene.2016.03.050	journal	June 2016
Synchrotron X-ray Diffraction Measurements of Single-Crystal Hydrogen to 26.5 Gigapascals Mao, H. K.; Jephcoat, A. P.; Hemley, R. J. Science, Vol. 239, Issue 4844 https://doi.org/10.1126/science.239.4844.1131	journal	March 1988
An international multi-laboratory investigation of carbon-based hydrogen sorbent materials Hurst, Katherine E.; Parilla, Philip A.; O’Neill, Kevin J. Applied Physics A, Vol. 122, Issue 1 https://doi.org/10.1007/s00339-015-9537-x	journal	January 2016
Stability of MOF-5 in a hydrogen gas environment containing fueling station impurities Ming, Yang; Purewal, Justin; Yang, Jun International Journal of Hydrogen Energy, Vol. 41, Issue 22 https://doi.org/10.1016/j.ijhydene.2016.03.155	journal	June 2016
Metal–Organic Framework Materials with Ultrahigh Surface Areas: Is the Sky the Limit? Farha, Omar K.; Eryazici, Ibrahim; Jeong, Nak Cheon Journal of the American Chemical Society, Vol. 134, Issue 36, p. 15016-15021 https://doi.org/10.1021/ja3055639	journal	August 2012
Methane storage in flexible metal–organic frameworks with intrinsic thermal management Mason, Jarad A.; Oktawiec, Julia; Taylor, Mercedes K. Nature, Vol. 527, Issue 7578 https://doi.org/10.1038/nature15732	journal	October 2015
Hydrogen carriers He, Teng; Pachfule, Pradip; Wu, Hui Nature Reviews Materials, Vol. 1, Issue 12 https://doi.org/10.1038/natrevmats.2016.59	journal	October 2016
Multiscale study of the structure and hydrogen storage capacity of an aluminum metal-organic framework Rahali, Seyfeddine; Belhocine, Youghourta; Seydou, Mahamadou International Journal of Hydrogen Energy, Vol. 42, Issue 22 https://doi.org/10.1016/j.ijhydene.2017.04.258	journal	June 2017
Lithium-doped MOF impregnated with lithium-coated fullerenes: A hydrogen storage route for high gravimetric and volumetric uptakes at ambient temperatures Rao, Dewei; Lu, Ruifeng; Xiao, Chuanyun Chemical Communications, Vol. 47, Issue 27 https://doi.org/10.1039/c1cc11832c	journal	January 2011
A sol–gel monolithic metal–organic framework with enhanced methane uptake Tian, Tian; Zeng, Zhixin; Vulpe, Diana Nature Materials, Vol. 17, Issue 2 https://doi.org/10.1038/nmat5050	journal	December 2017
Highly Effective Hydrogen Isotope Separation in Nanoporous Metal–Organic Frameworks with Open Metal Sites: Direct Measurement and Theoretical Analysis Oh, Hyunchul; Savchenko, Ievgeniia; Mavrandonakis, Andreas ACS Nano, Vol. 8, Issue 1 https://doi.org/10.1021/nn405420t	journal	December 2013
A dynamic calibration technique for temperature programmed desorption spectroscopy Hurst, K. E.; Heben, M. J.; Blackburn, J. L. Review of Scientific Instruments, Vol. 84, Issue 2 https://doi.org/10.1063/1.4770115	journal	February 2013
Impact of Preparation and Handling on the Hydrogen Storage Properties of Zn₄O(1,4-benzenedicarboxylate)₃ (MOF-5) Kaye, Steven S.; Dailly, Anne; Yaghi, Omar M. Journal of the American Chemical Society, Vol. 129, Issue 46, p. 14176-14177 https://doi.org/10.1021/ja076877g	journal	November 2007
Increasing the Density of Adsorbed Hydrogen with Coordinatively Unsaturated Metal Centers in Metal−Organic Frameworks Liu, Yun; Kabbour, Houria; Brown, Craig M. Langmuir, Vol. 24, Issue 9 https://doi.org/10.1021/la703864a	journal	May 2008

Linked Research (5)

Similar Records

Record High Hydrogen Storage Capacity in the Metal–Organic Framework Ni₂ (m-dobdc) at Near-Ambient Temperatures

Journal Article · Mon Oct 29 00:00:00 EDT 2018 · Chemistry of Materials · OSTI ID:1975065

Kapelewski, Matthew T.; Runčevski, Tomče; Tarver, Jacob D.; +8 more

Evaluating solvothermal and mechanochemical routes towards the metal–organic framework Mg₂(m-dobdc)

Journal Article · Thu Jun 30 00:00:00 EDT 2022 · CrystEngComm · OSTI ID:1975065

Chen, Elena Y.; Mandel, Ruth M.; Milner, Phillip J.

CO2/CH4, CH4/H2 and CO2/CH4/H2 Separations at High Pressures Using Mg2(dobdc)

Journal Article · · Microporous and Mesoporous Materials · OSTI ID:1975065

Herm, Zoey R; Krishna, Rajamani; Long, Jeffrey R

Related Subjects

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY
adsorption
desorption
Hydrogen
materials
metal organic frameworks

CCDC 1816040: Experimental Crystal Structure Determination Kapelewski, Matthew T.; Runčevski, Tomče; Tarver, Jacob D. https://doi.org/10.5517/ccdc.csd.cc1yyqyk The current record is supplemented by this dataset	dataset	January 2019
CCDC 1816041: Experimental Crystal Structure Determination Kapelewski, Matthew T.; Runčevski, Tomče; Tarver, Jacob D. https://doi.org/10.5517/ccdc.csd.cc1yyqzl The current record is supplemented by this dataset	dataset	January 2019
CCDC 1816042: Experimental Crystal Structure Determination T., Kapelewski, Matthew; Tomče, Runčevski,; D., Tarver, Jacob https://doi.org/10.5517/ccdc.csd.cc1yyr0n The current record is supplemented by this dataset	dataset	January 2019
CCDC 1816043: Experimental Crystal Structure Determination Kapelewski, Matthew T.; Runčevski, Tomče; Tarver, Jacob D. https://doi.org/10.5517/ccdc.csd.cc1yyr1p The current record is supplemented by this dataset	dataset	January 2019
CCDC 1816044: Experimental Crystal Structure Determination Kapelewski, Matthew T.; Runčevski, Tomče; Tarver, Jacob D. https://doi.org/10.5517/ccdc.csd.cc1yyr2q The current record is supplemented by this dataset	dataset	January 2019

Title: Record High Hydrogen Storage Capacity in the Metal–Organic Framework Ni2(m-dobdc) at Near-Ambient Temperatures

Citation Formats

References (49)

Linked Research (5)

Similar Records

Related Subjects

Title: Record High Hydrogen Storage Capacity in the Metal–Organic Framework Ni₂(m-dobdc) at Near-Ambient Temperatures