Structural reversibility of Cu doped NU-1000 MOFs under hydrogenation conditions

Halder, Avik; Lee, Sungsik; Yang, Bing; Pellin, Michael J.; Vajda, Stefan; Li, Zhanyong; Yang, Ying; Farha, Omar K.; Hupp, Joseph T.

doi:10.1063/1.5130600

Title: Structural reversibility of Cu doped NU-1000 MOFs under hydrogenation conditions

Journal Article · Mon Feb 24 00:00:00 EST 2020 · Journal of Chemical Physics

DOI:https://doi.org/10.1063/1.5130600· OSTI ID:1603347

^[1]; Lee, Sungsik ^[2];

^[1]; Pellin, Michael J. ^[1]; Vajda, Stefan ^[3]; Li, Zhanyong ^[4];

^[4]; Farha, Omar K. ^[4];

^[4]

Argonne National Lab. (ANL), Argonne, IL (United States). Materials Science Division
Argonne National Lab. (ANL), Argonne, IL (United States). X-ray Science Division
Argonne National Lab. (ANL), Argonne, IL (United States). Materials Science Division; Univ. of Chicago, IL (United States); Czech Academy of Sciences, Prague (Czech Republic). Dept. of Nanocatalysis, J. Heyrovský Inst. of Physical Chemistry
Northwestern Univ., Evanston, IL (United States). Dept. of Chemistry

The metal-organic framework (MOF), NU-1000, and its metalated counterparts have found proof-of-concept application in heterogeneous catalysis and hydrogen storage amongst others. A vapor-phase technique, akin to atomic layer deposition (ALD), is used to selectively deposit divalent Cu ions on oxo, hydroxo-bridged hexa-zirconium(IV) nodes capped with terminal –OH and -OH₂ ligands. Subsequent reaction with steam yields node-anchored, CuII-oxo,hydroxo clusters. We find that cluster installation via AIM (= ALD In MOFs) is accompanied by an expansion of MOF mesopore (channel) diameter . We investigated the behavior of the cluster-modified material, termed Cu-AIM-NU-1000, to heat treatment up to 325 °C, at atmospheric pressure with a low flow of H2 into the reaction cell. The response under these conditions revealed two important results: (1) Above 200 °C, the initially installed few-metal-ion clusters reduce to neutral Cu atoms. The neutral atoms migrate from the nodes and aggregate into Cu nanoparticles. While the size of particles formed in the MOF interior is constrained by the width of mesopores (ca. 3 nm), those formed on the exterior surface of the MOF can grow as large as ca. 8 nm. (2) Reduction and release of Cu atoms from the MOFs nodes is accompanied NU-1000 undergoes dynamic structural transformation as it reverts back to its original dimension following the release. These results show while the MOF framework itself remains intact at 325 °C in an H₂ atmosphere, the small, AIM-installed Cu^II-oxo,hydroxo clusters are stable with respect to reduction and conversion to metallic nanoparticles only up to ~200 °C.

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Research Organization:: Energy Frontier Research Centers (EFRC) (United States). Energy Frontier Research Center for Inorganometallic Catalyst Design (ICDC); Argonne National Laboratory (ANL), Argonne, IL (United States)

Sponsoring Organization:: USDOE Office of Science (SC), Basic Energy Sciences (BES)

Grant/Contract Number:: AC02-06CH11357; SC0012702

OSTI ID:: 1603347

Alternate ID(s):: OSTI ID: 1601316

Journal Information:: Journal of Chemical Physics, Vol. 152, Issue 8; ISSN 0021-9606

Publisher:: American Institute of Physics (AIP)Copyright Statement

Country of Publication:: United States

Language:: English

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Cited by: 12 works

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References (62)

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
Metal-organic frameworks: structure, properties, methods of synthesis and characterization Butova, V. V.; Soldatov, M. A.; Guda, A. A. Russian Chemical Reviews, Vol. 85, Issue 3 https://doi.org/10.1070/rcr4554	journal	March 2016
Structural Transitions of the Metal-Oxide Nodes within Metal–Organic Frameworks: On the Local Structures of NU-1000 and UiO-66 Platero-Prats, Ana E.; Mavrandonakis, Andreas; Gallington, Leighanne C. Journal of the American Chemical Society, Vol. 138, Issue 12 https://doi.org/10.1021/jacs.6b00069	journal	March 2016
Addressing the characterisation challenge to understand catalysis in MOFs: the case of nanoscale Cu supported in NU-1000 Platero-Prats, Ana E.; Li, Zhanyong; Gallington, Leighanne C. Faraday Discussions, Vol. 201 https://doi.org/10.1039/C7FD00110J	journal	January 2017
Methane Oxidation to Methanol Catalyzed by Cu-Oxo Clusters Stabilized in NU-1000 Metal–Organic Framework Ikuno, Takaaki; Zheng, Jian; Vjunov, Aleksei Journal of the American Chemical Society, Vol. 139, Issue 30 https://doi.org/10.1021/jacs.7b02936	journal	July 2017
Supported gold catalysts: new properties offered by nanometer and sub-nanometer structures Gates, Bruce C. Chemical Communications, Vol. 49, Issue 72 https://doi.org/10.1039/c3cc44942d	journal	January 2013
Complete furanics–sugar separations with metal–organic framework NU-1000 Yabushita, Mizuho; Li, Peng; Kobayashi, Hirokazu Chemical Communications, Vol. 52, Issue 79 https://doi.org/10.1039/C6CC05864G	journal	January 2016
Toward Inexpensive Photocatalytic Hydrogen Evolution: A Nickel Sulfide Catalyst Supported on a High-Stability Metal–Organic Framework Peters, Aaron W.; Li, Zhanyong; Farha, Omar K. ACS Applied Materials & Interfaces, Vol. 8, Issue 32 https://doi.org/10.1021/acsami.6b04729	journal	August 2016
Metal–Organic Framework Supported Cobalt Catalysts for the Oxidative Dehydrogenation of Propane at Low Temperature Li, Zhanyong; Peters, Aaron W.; Bernales, Varinia ACS Central Science, Vol. 3, Issue 1 https://doi.org/10.1021/acscentsci.6b00290	journal	November 2016
Metal–Organic Framework Nodes as Nearly Ideal Supports for Molecular Catalysts: NU-1000- and UiO-66-Supported Iridium Complexes Yang, Dong; Odoh, Samuel O.; Wang, Timothy C. Journal of the American Chemical Society, Vol. 137, Issue 23, p. 7391-7396 https://doi.org/10.1021/jacs.5b02956	journal	June 2015
CO ₂ Electroreduction to Hydrocarbons on Carbon-Supported Cu Nanoparticles Baturina, Olga A.; Lu, Qin; Padilla, Monica A. ACS Catalysis, Vol. 4, Issue 10 https://doi.org/10.1021/cs500537y	journal	September 2014
Redox-Mediator-Assisted Electrocatalytic Hydrogen Evolution from Water by a Molybdenum Sulfide-Functionalized Metal–Organic Framework Noh, Hyunho; Kung, Chung-Wei; Otake, Ken-ichi ACS Catalysis, Vol. 8, Issue 10 https://doi.org/10.1021/acscatal.8b02921	journal	September 2018
Exceptional Mechanical Stability of Highly Porous Zirconium Metal–Organic Framework UiO-66 and Its Important Implications Wu, Hui; Yildirim, Taner; Zhou, Wei The Journal of Physical Chemistry Letters, Vol. 4, Issue 6 https://doi.org/10.1021/jz4002345	journal	March 2013
Stable Metal–Organic Framework-Supported Niobium Catalysts Ahn, Sol; Thornburg, Nicholas E.; Li, Zhanyong Inorganic Chemistry, Vol. 55, Issue 22 https://doi.org/10.1021/acs.inorgchem.6b02103	journal	October 2016
X-ray photoelectron, Cu L3MM Auger and X-ray absorption spectroscopic studies of Cu nanoparticles produced in aqueous solutions: The effect of sample preparation techniques Saikova, Svetlana; Vorobyev, Sergey; Likhatski, Maxim Applied Surface Science, Vol. 258, Issue 20 https://doi.org/10.1016/j.apsusc.2012.05.024	journal	August 2012
Regioselective Atomic Layer Deposition in Metal–Organic Frameworks Directed by Dispersion Interactions Gallington, Leighanne C.; Kim, In Soo; Liu, Wei-Guang Journal of the American Chemical Society, Vol. 138, Issue 41 https://doi.org/10.1021/jacs.6b08711	journal	October 2016
Best Practices for the Synthesis, Activation, and Characterization of Metal–Organic Frameworks Howarth, Ashlee J.; Peters, Aaron W.; Vermeulen, Nicolaas A. Chemistry of Materials, Vol. 29, Issue 1 https://doi.org/10.1021/acs.chemmater.6b02626	journal	September 2016
Atomically Precise Growth of Catalytically Active Cobalt Sulfide on Flat Surfaces and within a Metal–Organic Framework via Atomic Layer Deposition Peters, Aaron W.; Li, Zhanyong; Farha, Omar K. ACS Nano, Vol. 9, Issue 8 https://doi.org/10.1021/acsnano.5b03429	journal	July 2015
Synthesis and Stabilization of Supported Metal Catalysts by Atomic Layer Deposition Lu, Junling; Elam, Jeffrey W.; Stair, Peter C. Accounts of Chemical Research, Vol. 46, Issue 8 https://doi.org/10.1021/ar300229c	journal	March 2013
Irena : tool suite for modeling and analysis of small-angle scattering Ilavsky, Jan; Jemian, Peter R. Journal of Applied Crystallography, Vol. 42, Issue 2 https://doi.org/10.1107/S0021889809002222	journal	February 2009
Sintering of Catalytic Nanoparticles: Particle Migration or Ostwald Ripening? Hansen, Thomas W.; DeLaRiva, Andrew T.; Challa, Sivakumar R. Accounts of Chemical Research, Vol. 46, Issue 8 https://doi.org/10.1021/ar3002427	journal	April 2013
Defining the Proton Topology of the Zr₆-Based Metal–Organic Framework NU-1000 Planas, Nora; Mondloch, Joseph E.; Tussupbayev, Samat The Journal of Physical Chemistry Letters, Vol. 5, Issue 21, p. 3716-3723 https://doi.org/10.1021/jz501899j	journal	October 2014
Pd-Supported on N-doped carbon: improved heterogeneous catalyst for base-free alkoxycarbonylation of aryl iodides Ziccarelli, Ida; Neumann, Helfried; Kreyenschulte, Carsten Chemical Communications, Vol. 52, Issue 86 https://doi.org/10.1039/c6cc07269k	journal	January 2016
Vapor-Phase Metalation by Atomic Layer Deposition in a Metal–Organic Framework Mondloch, Joseph E.; Bury, Wojciech; Fairen-Jimenez, David Journal of the American Chemical Society, Vol. 135, Issue 28, p. 10294-10297 https://doi.org/10.1021/ja4050828	journal	May 2013
A versatile sample-environment cell for non-ambient X-ray scattering experiments Chupas, Peter J.; Chapman, Karena W.; Kurtz, Charles Journal of Applied Crystallography, Vol. 41, Issue 4 https://doi.org/10.1107/S0021889808020165	journal	July 2008
Cooperative Cluster Metalation and Ligand Migration in Zirconium Metal-Organic Frameworks Yuan, Shuai; Chen, Ying-Pin; Qin, Junsheng Angewandte Chemie International Edition, Vol. 54, Issue 49 https://doi.org/10.1002/anie.201505625	journal	October 2015
Control of Metal Nanocrystal Size Reveals Metal-Support Interface Role for Ceria Catalysts Cargnello, M.; Doan-Nguyen, V. V. T.; Gordon, T. R. Science, Vol. 341, Issue 6147 https://doi.org/10.1126/science.1240148	journal	July 2013
Metal Nanoparticles Covered with a Metal–Organic Framework: From One-Pot Synthetic Methods to Synergistic Energy Storage and Conversion Functions Kobayashi, Hirokazu; Mitsuka, Yuko; Kitagawa, Hiroshi Inorganic Chemistry, Vol. 55, Issue 15 https://doi.org/10.1021/acs.inorgchem.6b00911	journal	June 2016
Metal–organic framework materials as catalysts Lee, JeongYong; Farha, Omar K.; Roberts, John Chemical Society Reviews, Vol. 38, Issue 5, p. 1450-1459 https://doi.org/10.1039/B807080F	journal	January 2009
Reduction of CuO and Cu ₂ O with H ₂ : H Embedding and Kinetic Effects in the Formation of Suboxides Kim, Jae Y.; Rodriguez, José A.; Hanson, Jonathan C. Journal of the American Chemical Society, Vol. 125, Issue 35 https://doi.org/10.1021/ja0301673	journal	September 2003
Pd Nanoparticles Embedded into a Metal-Organic Framework: Synthesis, Structural Characteristics, and Hydrogen Sorption Properties Zlotea, Claudia; Campesi, Renato; Cuevas, Fermin Journal of the American Chemical Society, Vol. 132, Issue 9 https://doi.org/10.1021/ja9084995	journal	March 2010
Electronic structure of small copper oxide clusters: From ${Cu}_{2}$ O to ${Cu}_{2}$ $O_{4}$ Wang, Lai-Sheng; Wu, Hongbin; Desai, Sunil R. Physical Review B, Vol. 53, Issue 12 https://doi.org/10.1103/physrevb.53.8028	journal	March 1996
Perfluoroalkane Functionalization of NU-1000 via Solvent-Assisted Ligand Incorporation: Synthesis and CO₂ Adsorption Studies Deria, Pravas; Mondloch, Joseph E.; Tylianakis, Emmanuel Journal of the American Chemical Society, Vol. 135, Issue 45, p. 16801-16804 https://doi.org/10.1021/ja408959g	journal	October 2013
Tuning the properties of metal–organic framework nodes as supports of single-site iridium catalysts: node modification by atomic layer deposition of aluminium Yang, Dong; Momeni, Mohammad R.; Demir, Hakan Faraday Discussions, Vol. 201 https://doi.org/10.1039/C7FD00031F	journal	January 2017
Postsynthetic Tuning of Metal–Organic Frameworks for Targeted Applications Islamoglu, Timur; Goswami, Subhadip; Li, Zhanyong Accounts of Chemical Research, Vol. 50, Issue 4 https://doi.org/10.1021/acs.accounts.6b00577	journal	February 2017
Investigation on Hydrogenation of Metal–Organic Frameworks HKUST-1, MIL-53, and ZIF-8 by Hydrogen Spillover Chen, Hao; Wang, Lifeng; Yang, Jun The Journal of Physical Chemistry C, Vol. 117, Issue 15 https://doi.org/10.1021/jp401367k	journal	April 2013
Metals@MOFs - Loading MOFs with Metal Nanoparticles for Hybrid Functions Meilikhov, Mikhail; Yusenko, Kirill; Esken, Daniel European Journal of Inorganic Chemistry, Vol. 2010, Issue 24, p. 3701-3714 https://doi.org/10.1002/ejic.201000473	journal	July 2010
Scalable synthesis and post-modification of a mesoporous metal-organic framework called NU-1000 Wang, Timothy C.; Vermeulen, Nicolaas A.; Kim, In Soo Nature Protocols, Vol. 11, Issue 1 https://doi.org/10.1038/nprot.2016.001	journal	December 2015
Uniformity begets selectivity Yang, Dong; Gates, Bruce C. Nature Materials, Vol. 16, Issue 7 https://doi.org/10.1038/nmat4924	journal	June 2017
Catalytic Zirconium/Hafnium-Based Metal–Organic Frameworks Rimoldi, Martino; Howarth, Ashlee J.; DeStefano, Matthew R. ACS Catalysis, Vol. 7, Issue 2 https://doi.org/10.1021/acscatal.6b02923	journal	December 2016
Copper nanoparticles embedded in metal–organic framework MIL-101(Cr) as a high performance catalyst for reduction of aromatic nitro compounds Wu, Fang; Qiu, Ling-Guang; Ke, Fei Inorganic Chemistry Communications, Vol. 32 https://doi.org/10.1016/j.inoche.2013.03.003	journal	June 2013
Reticular Chemistry—Construction, Properties, and Precision Reactions of Frameworks Yaghi, Omar M. Journal of the American Chemical Society, Vol. 138, Issue 48 https://doi.org/10.1021/jacs.6b11821	journal	November 2016
Electrochemical behaviour of naked sub-nanometre sized copper clusters and effect of CO ₂ Passalacqua, Rosalba; Parathoner, Siglinda; Centi, Gabriele Catalysis Science & Technology, Vol. 6, Issue 18 https://doi.org/10.1039/C6CY00942E	journal	January 2016
Chemical, thermal and mechanical stabilities of metal–organic frameworks Howarth, Ashlee J.; Liu, Yangyang; Li, Peng Nature Reviews Materials, Vol. 1, Issue 3 https://doi.org/10.1038/natrevmats.2015.18	journal	February 2016
Coking- and Sintering-Resistant Palladium Catalysts Achieved Through Atomic Layer Deposition Lu, Junling; Fu, Baosong; Kung, Mayfair C. Science, Vol. 335, Issue 6073 https://doi.org/10.1126/science.1212906	journal	March 2012
Direct formation of hydrogen peroxide from H2/O2 using a gold catalyst Landon, Philip; Collier, Paul J.; Papworth, Adam J. Chemical Communications, Issue 18 https://doi.org/10.1039/b205248m	journal	August 2002
Nanostructured Catalysts for Organic Transformations Chng, Leng Leng; Erathodiyil, Nandanan; Ying, Jackie Y. Accounts of Chemical Research, Vol. 46, Issue 8 https://doi.org/10.1021/ar300197s	journal	January 2013
Single-Site Cobalt Catalysts at New Zr ₈ (μ ₂ -O) ₈ (μ ₂ -OH) ₄ Metal-Organic Framework Nodes for Highly Active Hydrogenation of Alkenes, Imines, Carbonyls, and Heterocycles Ji, Pengfei; Manna, Kuntal; Lin, Zekai Journal of the American Chemical Society, Vol. 138, Issue 37 https://doi.org/10.1021/jacs.6b06759	journal	September 2016
An Exceptionally Stable Metal–Organic Framework Supported Molybdenum(VI) Oxide Catalyst for Cyclohexene Epoxidation Noh, Hyunho; Cui, Yuexing; Peters, Aaron W. Journal of the American Chemical Society, Vol. 138, Issue 44 https://doi.org/10.1021/jacs.6b08898	journal	October 2016
Catalysis with Metal Nanoparticles Immobilized within the Pores of Metal–Organic Frameworks Aijaz, Arshad; Xu, Qiang The Journal of Physical Chemistry Letters, Vol. 5, Issue 8, p. 1400-1411 https://doi.org/10.1021/jz5004044	journal	March 2014
Density Functional Calculation of the Structure and Electronic Properties of Cu _n O _n ( n = 1−8) Clusters Bae, Gyun-Tack; Dellinger, Barry; Hall, Randall W. The Journal of Physical Chemistry A, Vol. 115, Issue 11 https://doi.org/10.1021/jp104177q	journal	March 2011
Temperature Treatment of Highly Porous Zirconium-Containing Metal–Organic Frameworks Extends Drug Delivery Release Teplensky, Michelle H.; Fantham, Marcus; Li, Peng Journal of the American Chemical Society, Vol. 139, Issue 22 https://doi.org/10.1021/jacs.7b01451	journal	May 2017
Roll-to-Roll Production of Metal-Organic Framework Coatings for Particulate Matter Removal Chen, Yifa; Zhang, Shenghan; Cao, Sijia Advanced Materials, Vol. 29, Issue 15 https://doi.org/10.1002/adma.201606221	journal	January 2017
Thermal Stabilization of Metal–Organic Framework-Derived Single-Site Catalytic Clusters through Nanocasting Malonzo, Camille D.; Shaker, Sammy M.; Ren, Limin Journal of the American Chemical Society, Vol. 138, Issue 8 https://doi.org/10.1021/jacs.5b12688	journal	February 2016
Nanoparticles for Catalysis Xia, Younan; Yang, Hong; Campbell, Charles T. Accounts of Chemical Research, Vol. 46, Issue 8 https://doi.org/10.1021/ar400148q	journal	April 2013
Synthesis and Stability of Tagged UiO-66 Zr-MOFs Kandiah, Mathivathani; Nilsen, Merete Hellner; Usseglio, Sandro Chemistry of Materials, Vol. 22, Issue 24 https://doi.org/10.1021/cm102601v	journal	December 2010
Copper Cluster Size Effect in Methanol Synthesis from CO ₂ Yang, Bing; Liu, Cong; Halder, Avik The Journal of Physical Chemistry C, Vol. 121, Issue 19 https://doi.org/10.1021/acs.jpcc.7b01835	journal	May 2017
The Chemistry and Applications of Metal-Organic Frameworks Furukawa, H.; Cordova, K. E.; O'Keeffe, M. Science, Vol. 341, Issue 6149, p. 1230444-1230444 https://doi.org/10.1126/science.1230444	journal	August 2013
Cluster calculations for H ₂ dissociation on Cu and Ni Rantala, Tapio T.; Nieminen, Risto M. Physica Scripta, Vol. 37, Issue 1 https://doi.org/10.1088/0031-8949/37/1/020	journal	January 1988
Molecular structure of copper(I) hydroxide and copper hydroxide(1-) (Cu(OH)2-). An ab initio study Illas, F.; Rubio, J.; Centellas, F. The Journal of Physical Chemistry, Vol. 88, Issue 22 https://doi.org/10.1021/j150666a022	journal	October 1984
MOF Functionalization via Solvent-Assisted Ligand Incorporation: Phosphonates vs Carboxylates Deria, Pravas; Bury, Wojciech; Hod, Idan Inorganic Chemistry, Vol. 54, Issue 5 https://doi.org/10.1021/ic502639v	journal	February 2015
Versatile functionalization of the NU-1000 platform by solvent-assisted ligand incorporation Deria, Pravas; Bury, Wojciech; Hupp, Joseph T. Chemical Communications, Vol. 50, Issue 16, p. 1965-1968 https://doi.org/10.1039/C3CC48562E	journal	January 2014

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Title: Structural reversibility of Cu doped NU-1000 MOFs under hydrogenation conditions

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