Peer-reviewed publications of research supported in part or in whole under an EFRC are listed below. Publications are ordered first by year, then alphabetically by EFRC acronym, and finally alphabetically by first author. Links to the DOI and associated EFRC appear at the end of each citation. The publication list is updated periodically; the last such update was May 5, 2016. To search the most current list of EFRC publications, go to link (upper right corner).

901.McEntee, Monica; Tang, Wenjie; Neurock, M.; and Yates, J. T., Jr.  Mechanistic Insights into the Catalytic Oxidation of Carboxylic Acids on Au/TiO2: Partial Oxidation of Propionic and Butyric Acid to Gold Ketenylidene through Unsaturated Acids  ACS Catal., 5, 744-753 (2015).  [DOI: 10.1021/cs5014255External link] [FIRST]
902.Medina-Ramos, J.; Pupillo, R.C.; Keane, T.P.; DiMeglio, J.L.; and Rosenthal, J.  Efficient Conversion of CO2 to CO using Tin and Other Inexpensive and Easily Prepared Post-Transition Metal Catalysts  J Am Chem Soc, , (2015).  [DOI: 10.1021/ja5121088External link] [FIRST]
903.Ong, Mitchell; Verners, Osvalds; Draeger, Erik; van Duin, Adri C. T.; Lordi, Vincenzo; and Pask, John  Lithium Ion Solvation and Diffusion in Bulk Organic Electrolytes from First-Principles and Classical Reactive Molecular Dynamics  J. Phys. Chem. B, 119, 1535-1545 (2015).  [DOI: 10.1021/jp508184fExternal link] [FIRST]
904.Ostadhossein, Alireza; Cubuk, Ekin D.; Tritsaris, Georgios A; Kaxiras, Efthimios; Zhang, Sulin; and van Duin, Adri C. T.  Stress Effects on the Initial Lithiation of Crystalline Silicon Nanowires: Reactive Molecular Dynamics Simulations using ReaxFF  Phys Chem Chem Phys, 17, 3832-3840 (2015).  [DOI: 10.1039/c4cp05198jExternal link] [FIRST]
905.Osti, N.C.; Cote, A.; Mamontov, E.; Ramirez-Cuesta, A.J.; Wesolowski, D. J.; and Diallo, S.O.  Characteristic Features of Water Dynamics in Restricted Geometries Investigated with Quasi-Elastic neutron Scattering  Chem Phys, 465-466, 1-8 (2015).  [DOI: 10.1016/j.chemphys.2015.11.008External link] [FIRST]
906.Raju, M.; Ganesh, P.; Kent, P.R.C.; and van Duin, Adri C. T.  A Reactive Force Field Study of Li/C Systems for Electrical Energy Storage  Journal of Chemical Theory and Computation, , (2015).  [DOI: 10.1021/ct501027vExternal link] [FIRST]
907.Rouha, M.; and Cummings, Peter T.  Thickness-Dependent Structural Arrangement in Nano-Confined Imidazolium-Based Ionic Liquid Films  Phys Chem Chem Phys, 17, 4152-4159 (2015).  [DOI: 10.1039/c4cp05138fExternal link] [FIRST]
908.Sacci, Robert L. ; Gill, L.; Hagaman, E. W.; and Dudney, N. J.  Operando NMR and XRD Study of Chemically Synthesized LiC2 Oxidation in a Dry Room Environment  J. Power Sources, 287, 253-260 (2015).  [DOI: 10.1016/j.jpowsour.2015.04.035External link] [FIRST]
909.Sacci, Robert L. ; Banuelos, J. L.; Veith, G. M.; Littrell, K.; Cheng, Y; Wildgruber, C. U; Jones, L.L.; Ramirez-Cuesta, A.J.; Rother, Gernot; and Dudney, N. J.  Structure of Spontaneously Formed Solid-Electrolyte Interphase on Lithiated Graphite determined using Small-Angle Neutron Scattering  J Phys Chem C, , (2015).  [DOI: 10.1021/acs.jpcc.5b00215External link] [FIRST]
910.Sacci, Robert L. ; Black, J.M.; Balke, N.; Dudney, N. J.; More, Karren; and Unocic, R. R.  Nanoscale Imaging of Fundamental Li Battery Chemistry: Solid-Electrolyte Interphase Formation and Preferential Growth of Lithium Metal Nanoclusters  NANO LETTERS, 15(3), 2011-2018 (2015).  [DOI: 10.1021/nl5048626External link] [FIRST]
911.Senftle, T.P.; Hong, S.; Islam, M.M.; Kylasa, S.B.; Zheng, Y.; Shin, Y.K.; Junkermeier, C.; Engel-Herbert, R.; Janik, Michael J.; Aktulga, H.M.; Verstraelen, T.; Grama, A.; and van Duin, Adri C. T.  The ReaxFF Reactive Force-field: Development, Applications, and Future Directions  npj Computational Materials, , (2015).  [DOI: 10.1038/npjcompumats.2015.11External link] [FIRST]
912.Silvestre-Alcantara, W.; Henderson, D.; Wu, J.; Kaja, M.; Lamperski, S.; and Bhuiyan, L.B.  Structure of an Electric Double Layer Containing a 2:2 Valency Dimer Electrolyte  J. Colloid and Interface Science, 449, 175-179 (2015).  [DOI: 10.1016/j.jcis.2014.11.070External link] [FIRST]
913.Srinivasan, Sriram; van Duin, Adri C. T.; and Ganesh, P.  Development of a ReaxFF Potential for Carbon Condensed Phases and its Application to the Thermal Fragmentation of a Large Fullerene  J. Phys. Chem. A, 119, 571-580 (2015).  [DOI: 10.1021/jp510274eExternal link] [FIRST]
914.Unocic, R. R.; Baggetto, Loic; Veith, G. M.; Agular, J.; Unocic, K. A.; Sacci, Robert L. ; Dudney, N. J.; and More, Karren  Probing Battery Chemistry with Liquid Cell Electron Energy Loss Spectroscopy  ChemComm, 51, 16377-16380 (2015).  [DOI: 10.1039/C5CC07180AExternal link] [FIRST]
915.Uysal, Ahmet; Zhou, H; Feng, G.; Lee, Sang Soo; Li, S.; Cummings, Peter T.; Fulvio, P. F.; Dai, S.; McDonough, J. K.; Gogotsi, Y.; and Fenter, Paul  Interfacial Ionic 'Liquids': Connecting Static and Dynamic Structures  J Phys.: Condens. Matter, 27, 032101-032109 (2015).  [DOI: 10.1088/0953-8984/27/3/032101External link] [FIRST]
916.Van Aken, Katherine L.; Perez, C. R.; Oh, Youngseok; Beidaghi, M.; Jeong, Yoon Joo; Islam, Mohammed F; and Gogotsi, Y.  High Rate Capacitive Performance of Single-Walled Carbon Nanotube Aerogels  Nano Energy, 15, 662-669 (2015).  [DOI: 10.1016/j.nanoen.2015.05.028External link] [FIRST]
917.Van Aken, Katherine L.; Beidaghi, M.; and Gogotsi, Y.  Formulation of Ionic Liquid Electrolyte to Expand the Voltage Window of Supercapacitors  Angew. Chem. Int. Ed., 127, 4888-4891 (2015).  [DOI: 10.1002/anie.201412257External link] [FIRST]
918.Veith, G. M.; Doucet, Mathieu; Baldwin, J K; Sacci, Robert L. ; Fears, Tyler; Wang, Y.; and Browning, James F  Direct Determination of Solid-Electrolyte Interphase Thickness and Composition as a Function of State of Charge on a Silicon Anode  J. Phys. Chem C, 119, 20339-20349 (2015).  [DOI: 10.1021/acs.jpcc.5b06817External link] [FIRST]
919.Yoon, Kichul; Ostadhossein, Alireza; and van Duin, Adri C. T.  Atomistic-Scale Simulations of the Chemomechanical Behavior of Graphene under Nanoprojectile Impact  Carbon, 99, 58-64 (2015).  [DOI: 10.1016/j.carbon.2015.11.052External link] [FIRST]
920.Zhan, Cheng; Neal, Justin; Wu, J.; and Jiang, D.  Quantum Effects on the Capacitance of Graphene-Based Electrodes  J. Phys. Chem. C, , (2015).  [DOI: 10.1021/acs.jpcc.5b05930External link] [FIRST]
921.Zhang, P.; Li, M; Yang, B.; Fang, Y.; Jiang, X.; Veith, G. M.; Sun, X-G.; and Dai, S.  Polymerized Ionic Networks with High Charge Density: Quasi-Solid Electrolytes in Lithium-Metal Batteries  Adv. Mater., , (2015).  [DOI: 10.1002/adma.201502855External link] [FIRST]
922.Zhang, P.; Zhu, H; and Dai, S.  Porous Carbon Supports: Recent Advances with Various Morphologies and Compositions  ChemCatChem, 7(18), 2788-2805 (2015).  [DOI: 10.1002/cctc.201500368External link] [FIRST]
923.Zhang, P.; Jiang, X.; Wan, S.; and Dai, S.  Charged Porous Polymers Using a Solid C-O Cross-Coupling Reaction  Chem. Eur. J., 21, 12866-12870 (2015).  [DOI: 10.1002/chem.201501814External link] [FIRST]
924.Zhang, P.; Zhang, Z.; Chen, J.; and Dai, S.  Ultrahigh Surface Area Carbon from Carbonated Beverages: Combining Self-Templating Process and in-situ Activation  Carbon, 93, 39-47 (2015).  [DOI: 10.1016/j.carbon.2015.05.019External link] [FIRST]
925.Zhang, P.; Qiao, Z-A.; and Dai, S.  Recent Advances on Carbon Nanospheres: Synthetic Routes and Applications  Chem. Commun., , (2015).  [DOI: 10.1039/C5CC01759AExternal link] [FIRST]
926.Zhang, P.; Jiang, X.; Wan, S.; and Dai, S.  Advancing Polymers of Intrinsic Microporosity by Mechanochemistry  J Mater Chem A, 3, 6739-6741 (2015).  [DOI: 10.1039/C4TA07196DExternal link] [FIRST]
927.Zhang, P.; Li, H; Veith, G. M.; and Dai, S.  Soluble Porous Coordination Polymers by Mechanochemistry: From Metal-Containing Films/Membranes to Active Catalysts for Aerobic Oxidation  Adv Mater, 27(2), 234-239 (2015).  [DOI: 10.1002/adma.201403299External link] [FIRST]
928.Zhang, P.; Qiao, X.; Jiang, X.; Veith, G. M.; and Dai, S.  Nanoporous Ionic Organic Networks: Stabilizing and Supporting Gold Nanoparticles for Calaysis  NanoLett, 15, 823-828 (2015).  [DOI: 10.1021/nl504780jExternal link] [FIRST]
929.Zhao, Meng-Qiang; Ren, Chang E.; Ling, Zheng; Lukatskaya, M.; Zhang, C.; Van Aken, Katherine L.; Barsoum, M. W.; and Gogotsi, Y.  Flexible MXene/Carbon nanotube Composite Paper with High Volumetric Capacitance  Adv Mater, 5, 1401286 (2015).  [DOI: 10.1002/adma.201404140External link] [FIRST]
930.Zhou, H; Uysal, Ahmet; Anjos, Daniela M.; Cai, Y.; Overbury, Steven H.; Neurock, M.; McDonough, J. K.; Gogotsi, Y.; and Fenter, Paul  Understanding Defect-Stabilized Noncovalent Functionalization of Graphene  Adv. Mater. Interfaces, , (2015).  [DOI: 10.1002/admi.201500277External link] [FIRST]
931.Gershenzon, Naum I; Ritzi, Robert W; Dominic, David F; Soltanian, Mohamadreza; Mehnert, Edward; and Okwen, Roland T  Influence of small-scale fluvial architecture on CO2 trapping processes in deep brine reservoirs  Water Resources Research, 51, 8240–8256 (2015).  [DOI: 10.1002/2015WR017638External link] [GSCO2]
932.Laleian, Artin; Valocchi, Albert J.; and Werth, Charles J.  An incompressible, depth-averaged Lattice Boltzmann method for liquid flow in microfluidic devices with variable aperture  Computation, 3, 600–615 (2015).  [DOI: 10.3390/computation3040600External link] [GSCO2]
933.Yoon, Hongkyu; Kang, Qinjun; and Valocchi, Albert J.  Lattice Boltzmann-based approaches for pore-scale reactive transport  Reviews in Mineralogy and Geochemistry, 80, 393–431 (2015).  [DOI: 10.2138/rmg.2015.80.12External link] [GSCO2]
934.Bacsa, Revathi R.; Camean, Ignacio; Ramos, Alberto; Garcia, Ana B.; Tishkova, Victoria; Bacsa, Wolfgang S.; Gallagher, James R.; Miller, Jeffrey T; Navas, Hugo; Jourdain, Vincent; Girleanu, Maria; Ersen, Ovidiu; and Serp, Philippe  Few layer graphene synthesis on transition metal ferrite catalysts  Carbon, 89, 350-360 (2015).  [DOI: 10.1016/j.carbon.2015.03.054External link] [IACT]
935.Bo, Zhenyu; Eaton, Todd R.; Gallagher, James R.; Canlas, Christian P.; Miller, Jeffrey T; and Notestein, Justin  Size-Selective Synthesis and Stabilization of Small Silver Nanoparticles on TiO2 Partially Masked by SiO2  Chem. Mater., 27(4), 1269-1277 (2015).  [DOI: 10.1021/cm504243fExternal link] [IACT]
936.Detwiler, Michael D.; Majumdar, Paulami; Gu, Xiang-Kui; Delgass, W. Nicholas; Ribeiro, Fabio H; Greeley, Jeffrey P; and Zemylanov, Dmitry  Characterization and theory of Re films on Pt(111) grown by UHV-CVD  Surf. Sci., , (2015).  [DOI: 10.1016/j.susc.2015.05.015External link] [IACT]
937.Detwiler, Michael D.; Gharachorlou, Amir; Mayr, Lukas; Gu, Xiang-Kui; Liu, Bin; Greeley, Jeffrey P; Delgass, W. Nicholas; Ribeiro, Fabio H; and Zemylanov, Dmitry  Reaction of Trimethylaluminum with Water on Pt(111) and Pd(111) from 10–5 to 10–1 Millibar  J. Phys. Chem. C, 119(5), 2399-2411 (2015).  [DOI: 10.1021/jp510032uExternal link] [IACT]
938.Gallagher, James R.; Childers, David J.; Zhao, Haiyan; Winans, Randall E.; Meyer, Randall J.; and Miller, Jeffrey T  Structural evolution of an intermetallic Pd–Zn catalyst selective for propane dehydrogenation   Phys Chem Chem Phys, , (2015).  [DOI: 10.1039/C5CP00222BExternal link] [IACT]
939.Gharachorlou, Amir; Detwiler, Michael D.; Mayr, Lukas; Gu, Xiang-Kui; Greeley, Jeffrey P; Reifenberger, Ronald C.; Delgass, W. Nicholas; Ribeiro, Fabio H; and Zemylanov, Dmitry  The Surface Chemistry of Trimethylaluminium on Pd(111) and Pt(111)  J. Phys. Chem. C, , (2015).  [DOI: 10.1021/jp512915fExternal link] [IACT]
940.Hakim, Sikander H. ; Sener, Canan; Alba-Rubio, Ana C.; Gostanian, Thomas M.; O'Neill, Brandon J.; Ribeiro, Fabio H; Miller, Jeffrey T; and Dumesic, James A  Synthesis of supported bimetallic nanoparticles with controlled size and composition distributions for active site elucidation  J. Catal., 328, 75-90 (2015).  [DOI: 10.1016/j.jcat.2014.12.015External link] [IACT]
941.Jackson, David H. K. ; O'Neill, Brandon J.; Lee, Jechan; Huber, George W.; Dumesic, James A; and Kuech, Thomas F  Tuning Acid-Base Properties Using Mg-Al Oxide Atomic Layer Deposition  ACS Appl. Mater. Interfaces, , (2015).  [DOI: 10.1021/acsami.5b04107External link] [IACT]
942.Kim, Hyung Ju; Jackson, David H. K. ; Lee, Jechan; Guan, Yingxin; Kuech, Thomas F; and Huber, George W.  Enhanced Activity and Stability of TiO2-Coated Cobalt/Carbon Catalysts for Electrochemical Water Oxidation  ACS Catal., 5, 3463-3469 (2015).  [DOI: 10.1021/acscatal.5b00173External link] [IACT]
943.Lee, Jechan; Burt, Samuel P.; Carrero, Carlos A.; Alba-Rubio, Ana C.; Ro, Insoo; O'Neill, Brandon J.; Kim, Hyung Ju; Jackson, David H. K. ; Kuech, Thomas F; Hermans, Ive; Dumesic, James A; and Huber, George W.  Stabilizing cobalt catalysts for aqueous-phase reactions by strong metal-support interaction  J. Catal., 330, 19-27 (2015).  [DOI: 10.1016/j.jcat.2015.07.003External link] [IACT]
944.Lei, Yu; Liu, Bin; Lu, Junling; Lin, Xiao; Gao, Li; Guisinger, Nathan; Greeley, Jeffrey P; and Elam, Jeffrey W.  Synthesis of Palladium Nanoparticles on TiO2(110) using a Beta-Diketonate Precursor  Phys Chem Chem Phys, , (2015).  [DOI: 10.1039/C4CP05761AExternal link] [IACT]
945.Lentizio-Mozo, Sergio; Tan, Reasmey P.; Garcia-Marcelot, Cecile; Altantzis, Thomas; Fazzini, Pier-Francesco; Hungria, Teresa; Cormary, Benoit; Gallagher, James R.; Miller, Jeffrey T; Martinez, Herve; Schrittwieser, Stefan; Schotter, Joerg; Respaud, Marc; Bals, Sara; Van Tendeloo, Gustaaf; Gatel, Christophe; and Soulantica, Katerina  Air- and Water-Resistant Noble Metal Coated Ferromagnetic Cobalt Nanorods  ACS Nano, 9(3), 2792-2804 (2015).  [DOI: 10.1021/nn506709kExternal link] [IACT]
946.Lohr, Tracy L.; Li, Zhi; Curtiss, Larry A; Assary, Rajeev S.; and Marks, Tobin J.  Mono- and Tri-Ester Hydrogenolysis using Tandem Catalysis. Scope and Mechanism   Energy Environ. Sci., , (2015).  [DOI: 10.1039/C5EE03256CExternal link] [IACT]
947.Lohr, Tracy L.; Li, Zhi; and Marks, Tobin J.  Selective Ether/Ester C–O Cleavage of an Acetylated Lignin Model via Tandem Catalysis  ACS Catal., 5(11), 7004-7007 (2015).  [DOI: 10.1021/acscatal.5b01972External link] [IACT]
948.Lohr, Tracy L.; Li, Zhi; Assary, Rajeev S.; Curtiss, Larry A; and Marks, Tobin J.  Thermodynamically Leveraged Tandem Catalysis for Ester RC(O)O–R′ Bond Hydrogenolysis. Scope and Mechanism  ACS Catal., 5(6), 3675-3679 (2015).  [DOI: 10.1021/acscatal.5b00950External link] [IACT]
949.Lohr, Tracy L.; and Marks, Tobin J.  Orthogonal tandem catalysis  Nat. Chem., 7, 477-482 (2015).  [DOI: 10.1038/nchem.2262External link] [IACT]
950.Lu, Junling; and Elam, Jeffrey W.  Low Temperature ABC-type Ru ALD through Consecutive Dissociative Chemisorption, Combustion and Reduction Steps  Chem. Mater, , (2015).  [DOI: 10.1021/acs.chemmater.5b00818External link] [IACT]
951.O'Neill, Brandon J.; Jackson, David H. K. ; Lee, Jechan; Canlas, Christian P.; Stair, Peter C; Marshall, Christopher L; Elam, Jeffrey W.; Kuech, Thomas F; Dumesic, James A; and Huber, George W.  Catalyst Design with Atomic Layer Deposition  ACS Catal., 5(3), 1804-1825 (2015).  [DOI: 10.1021/cs501862hExternal link] [IACT]
952.Zhang, Hongbo; Canlas, Christian P.; Kropf, Jeremy; Elam, Jeffrey W.; Dumesic, James A; and Marshall, Christopher L  Enhancing the stability of copper chromite catalysts for the selective hydrogenation of furfural with ALD overcoating (II) – Comparison between TiO2 and Al2O3 overcoatings  J. Catal., 326, 172-181 (2015).  [DOI: 10.1016/j.jcat.2015.03.017External link] [IACT]
953.Bao, Junwei Lucas; Yu, Haoyu S.; Duanmu, Kaining ; Makeev, Maxim A.; Xu, Xuefei; and Truhlar, D. G.  Density Functional Theory of the Water Splitting Reaction on Fe(0): Comparison of Local and Nonlocal Correlation Functionals  ACS Catal., 5 , 2060-2080 (2015).  [DOI: 10.1021/cs501675tExternal link] [ICDC]
954.Cammarota, Ryan C.; and Lu, Connie C.  Tuning Nickel with Lewis Acidic Group 13 Metalloligands for Catalytic Olefin Hydrogenation  J. Am. Chem. Soc., 137 (39), 12486-12489 (2015).  [DOI: 10.1021/jacs.5b08313External link] [ICDC]
955.Carlson, R. K.; Odoh, Samuel; Tereniak, Stephen J. ; Lu, Connie C.; and Gagliardi, Laura  Can Multiconfigurational Self-Consistent Field Theory and Density Functional Theory Correctly Predict the Ground State of Metal–Metal-Bonded Complexes?  J. Chem. Theory Comput., 11 (9), 4093-4101 (2015).  [DOI: 10.1021/acs.jctc.5b00412External link] [ICDC]
956.Carlson, R. K.; Truhlar, D. G.; and Gagliardi, Laura  Multiconfiguration Pair-Density Functional Theory: A Fully Translated Gradient Approximation and Its Performance for Transition Metal Dimers and the Spectroscopy of Re2Cl82–  J. Chem. Theory Comput., 11 (9), 4077-4085 (2015).  [DOI: 10.1021/acs.jctc.5b00609External link] [ICDC]
957.Carlson, R. K.; Li Manni, G.; Sonnenberger, A. L.; Truhlar, D. G.; and Gagliardi, Laura  Multiconfiguration Pair-Density Functional Theory: Barrier Heights and Main Group and Transition Metal Energetics  J. Chem. Theory Comput., 11 (1), 82-90 (2015).  [DOI: 10.1021/ct5008235External link] [ICDC]
958.Clouston, Laura J. ; Bernales, Varinia ; Cammarota, Ryan C.; Carlson, R. K.; Bill, Eckhard; Gagliardi, Laura; and Lu, Connie C.  Heterobimetallic Complexes That Bond Vanadium to Iron, Cobalt, and Nickel  Inorg. Chem., , (2015).  [DOI: 10.1021/acs.inorgchem.5b01631External link] [ICDC]
959.Clouston, Laura J. ; Bernales, Varinia ; Carlson, R. K.; Gagliardi, Laura; and Lu, Connie C.  Bimetallic Cobalt–Dinitrogen Complexes: Impact of the Supporting Metal on N2 Activation  Inorg. Chem., 54 (19), 9263-9270 (2015).  [DOI: 10.1021/acs.inorgchem.5b00983External link] [ICDC]
960.Dix, Sean T; Scott, Joseph K. ; Getman, Rachel ; and Campbell, Charles T.  Using degrees of rate control to improve selective n-butane oxidation over model MOF-encapsulated catalysts: sterically-constrained Ag3Pd(111)  Faraday Discuss., 2015, (2015).  [DOI: 10.1039/C5FD00198FExternal link] [ICDC]
961.Duanmu, Kaining ; and Truhlar, D. G.  Validation of Methods for Computational Catalyst Design: Geometries, Structures, and Energies of Neutral and Charged Silver Clusters  J. Phys. Chem. C, 119 (17), 9617-9626 (2015).  [DOI: 10.1021/acs.jpcc.5b01545External link] [ICDC]
962.Eisenhart, Reed J.; Carlson, R. K.; Clouston, Laura J. ; Young Jr., Victor G.; Chen, Yu-Sheng; Bill, Eckhard; Gagliardi, Laura; and Lu, Connie C.  Influence of Copper Oxidation State on the Bonding and Electronic Structure of Cobalt–Copper Complexes  Inorg. Chem., , (2015).  [DOI: 10.1021/acs.inorgchem.5b01950External link] [ICDC]
963.Eisenhart, Reed J.; Rudd, P. Alex; Planas, Nora; Boyce, David W.; Carlson, R. K.; Tolman, William B.; Bill, Eckhard; Gagliardi, Laura; and Lu, Connie C.  Pushing the Limits of Delta Bonding in Metal–Chromium Complexes with Redox Changes and Metal Swapping  Inorg. Chem., 54, 7579–7592 (2015).  [DOI: 10.1021/acs.inorgchem.5b01163External link] [ICDC]
964.Eisenhart, Reed J.; Carlson, R. K.; Boyle, Kelsey M.; Gagliardi, Laura; and Lu, Connie C.  Synthesis and redox reactivity of a phosphine-ligated dichromium paddlewheel  Inorganica Chimica Acta, 424, 336-344 (2015).  [DOI: 10.1016/j.ica.2014.10.013External link] [ICDC]
965.Kim, In Soo; Borycz, Joshua; Platero-Prats, Ana E.; Tussupbayev, Samat; Wang, Timothy C. ; Farha, Omar K.; Hupp, Joseph T.; Gagliardi, Laura; Chapman, Karena W.; Cramer, Christopher J.; and Martinson, Alex B. F.  Targeted Single-Site MOF Node Modification: Trivalent Metal Loading via Atomic Layer Deposition  Chem. Mater., 27 (13), 4772-4778 (2015).  [DOI: 10.1021/acs.chemmater.5b01560External link] [ICDC]
966.Klet, Rachel C.; Tussupbayev, Samat; Borycz, Joshua; Gallagher, James R.; Stalzer, Madelyn M.; Miller, Jeffrey T; Gagliardi, Laura; Hupp, Joseph T.; Marks, Tobin J.; Cramer, Christopher J.; Delferro, Massimiliano; and Farha, Omar K.  Single-Site Organozirconium Catalyst Embedded in a Metal–Organic Framework  J. Am. Chem. Soc., 137 (50), 15680–15683 (2015).  [DOI: 10.1021/jacs.5b11350External link] [ICDC]
967.Madrahimov, Sherzod T.; Gallagher, James R.; Zhang, Guanghui; Meinhart, Zachary; Garibay, Sergio J.; Delferro, Massimiliano; Miller, Jeffrey T; Farha, Omar K.; Hupp, Joseph T.; and Nguyen, SonBinh T.  Gas-Phase Dimerization of Ethylene under Mild Conditions Catalyzed by MOF Materials Containing (bpy)NiII Complexes  ACS Catal., 5, 6713-6718 (2015).  [DOI: 10.1021/acscatal.5b01604External link] [ICDC]
968.Odoh, Samuel; Yang, Dong; Wang, Timothy C. ; Farha, Omar K.; Hupp, Joseph T.; Cramer, Christopher J.; Gagliardi, Laura; and Gates, Bruce C.  Metal–Organic Framework Nodes as Nearly Ideal Supports for Molecular Catalysts: NU-1000- and UiO-66-Supported Iridium Complexes  J. Am. Chem. Soc., 137, 7391–7396 (2015).  [DOI: 10.1021/jacs.5b02956External link] [ICDC]
969.Peters, Aaron W.; Li, Zhanyong; Farha, Omar K.; and Hupp, Joseph T.  Atomically Precise Growth of Catalytically Active Cobalt Sulfide on Flat Surfaces and within a Metal–Organic Framework via Atomic Layer Deposition  ACS Nano, 9, 8484-8490 (2015).  [DOI: 10.1021/acsnano.5b03429External link] [ICDC]
970.Siedschlag, Randall B. ; Bernales, Varinia ; Vogiatzis, Konstantinos D. ; Planas, Nora ; Clouston, Laura J. ; Bill, Eckhard; Gagliardi, Laura; and Lu, Connie C.  Catalytic Silylation of Dinitrogen with a Dicobalt Complex  JACS, 137 (14), 4638–4641 (2015).  [DOI: 10.1021/jacs.5b01445External link] [ICDC]
971.Wang, Timothy C. ; Vermeulen, Nicolaas A ; Kim, In Soo; Martinson, Alex B. F.; Stoddart, J. Fraser; Hupp, Joseph T.; and Farha, Omar K.  Scalable synthesis and post-modification of a mesoporous metal-organic framework called NU-1000  Nat. Protoc., 11, 149-162 (2015).  [DOI: 10.1038/nprot.2016.001External link] [ICDC]
972.Wang, Timothy C. ; Bury, Wojciech; Gomez-Gualdron, Diego A.; Vermeulen, Nicolaas A.; Mondloch, Joseph E.; Deria, Pravas; Zhang, Kainan; Moghadam, Peyman Z.; Sarjeant, A. A.; Snurr, Randall Q.; Stoddart, J. Fraser; Hupp, Joseph T.; and Farha, Omar K.  Ultrahigh Surface Area Zirconium MOFs and Insights into the Applicability of the BET Theory  J. Am. Chem. Soc., 137 (10), 3585-3591 (2015).  [DOI: 10.1021/ja512973bExternal link] [ICDC]
973.Wolcott, Christopher A.; Medford, Andrew J. ; Studt, F.; and Campbell, Charles T.  Degree of rate control approach to computational catalyst screening  J. Catal., 330, 197-207 (2015).  [DOI: 10.1016/j.jcat.2015.07.015External link] [ICDC]
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