Publications

Complete Publication List

  • Cohen, M., Goculdas, T. & Vlachos, D. G. “Active learning of chemical reaction networks via probabilistic graphical models and Boolean reaction circuits.” React. Chem. Eng., 14, (2023). [DOI:10.1039/d2re00315e].
  • Goculdas, T., Deshpande, S., Zheng, W., Gorte, R. J., Sadula, S. & Vlachos, D. G. “Highly selective cross ketonization of renewable acids over magnesium oxide.” Green ChemGreen Chem., 25, 614-626 (2023). [DOI:10.1039/d2gc04400e].
  • Ye, M., Kuo, M. J. & Lobo, R. F. “Biphenyl dicarboxylates from ethene and bifuran dimethyl esters.” Mol. Catal., 537, 6 (2023). [DOI:10.1016/j.mcat.2023.112949].
  • Chang, J., Feng, Z., Vohs, J. M. & Gorte, R. J. “A Study of Support Effects for the Water-Gas-Shift Reaction over Cu.” Catalysts, 12, 12 (2022). [DOI:10.3390/catal12111364].
  • Batchu, S., Hernandez, B., Malhotra,A., Fang, H., Ierapetritou, M. & Vlachos, D. “Accelerating manufacturing for biomass conversion via integrated process and bench digitalization: a perspective.” Reaction Chemistry & Engineering, 7, 813-832 (2022). [DOI:10.1039/D1RE00560J].
  • Chen, T., Hsiao, Y., Baker-Fales, M., Cameli, F., Dimitrakellis, P., & Vlachos, D. “Microflow chemistry and its electrification for sustainable chemical manufacturing.” Chem. Sci., 13, 10644-10685 (2022). [DOI:10.1039/D2SC01684B].
  • Dai, H., Lee, C., Liu, W., Yang, T., Claret, J., Zou, X., Dauenhauer, P. J., Li, X. & Rimer, J. D. “Enhanced Selectivity and Stability of Finned Ferrierite Catalysts in Butene Isomerization.” Angew. Chem. Int. Ed. Engl., 61, e202113077 (2022). [DOI:10.1002/anie.202113077].
  • Dimitrakellis, P., Delikonstantis, E., D. Stefanidis, G. & G. Vlachos, D. “Plasma technology for lignocellulosic biomass conversion toward an electrified biorefinery.” Green Chem, 24, 2680-2721 (2022). [DOI:10.1039/d1gc03436g].
  • Dorneles de Mello, M.; Ahmad, M., Lee, D., Dimitrakellis, P., Miao, Y.; Zheng, W., Nykypanchuk, D., Vlachos, D., Tsapatsis, M., & Boscoboinik, J. A. “In Situ Tracking of Nonthermal Plasma Etching of ZIF-8 Films.” ACS Appl Mater Interfaces, 14, 19023-19030 (2022). [DOI:10.1021/acsami.2c00259].
  • Fan, M., Ji, Y., Lawal, A., Abdelrahman, O. A., Gorte, R. J. & Vohs, J. M. “Site and Structural Requirements for the Dehydra-Decyclization of Cyclic Ethers on ZrO2..” Catalysts, 12, 13 (2022). [DOI:10.3390/catal12080902].
  • Fu, J. Y., Liu, S. Z., Zheng, W. Q., Huang, R. J., Wang, C., Lawal, A., Alexopoulos, K., Liu, S. B., Wang, Y. Z., Yu, K. W., Boscoboinik, J. A., Liu, Y. F., Liu, X., Frenkel, A. I., Abdelrahman, O. A., Gorte, R. J., Caratzoulas, S. & Vlachos, D. G. “Modulating the dynamics of Bronsted acid sites on PtWOx inverse catalyst.” Nat. Catal., 5, 144-153 (2022). [DOI:10.1038/s41929-022-00745-y].
  • Fu, J., Liu, S., Zheng, W., Huang, R., Wang, C., Lawal, A., Alexopoulos, K., Liu, S., Wang, Y., Yu, K., Boscoboinik, J., Liu, Y., Liu, X., Frenkel, A.; Abdelrahman, O., Gorte, R., Caratzoulas, S., & Vlachos, D. “Modulating the dynamics of Brønsted acid sites on PtWOx inverse catalyst.” Nature Catalysis, 5, 144–153 (2022). [DOI:10.1038/s41929-022-00745-y].
  • Gu, G.H., Lee, M., Jung, Y., & Vlachos, D. “Automated exploitation of the big configuration space of large adsorbates on transition metals reveals chemistry feasibility.” Nature Communications, 13, 2087 (2022). [DOI:10.1038/s41467-022-29705-7].
  • Huang, R., Chang, J., Choi, H., Vohs, J. M. & Gorte, R. J. “Furfural Upgrading by Aldol Condensation with Ketones over Solid-Base Catalysts.” Catal. Lett., 10, (2022). [DOI:10.1007/s10562-022-03960-1].
  • Ji, Y., Batchu, S. P., Lawal, A., Vlachos, D. G., Gorte, R. J., Caratzoulas, S. & Abdelrahman, O. A “Selective dehydra-decyclization of cyclic ethers to conjugated dienes over zirconia.” Journal of Catalysis, 410, 10-21 (2022). [DOI:10.1016/j.jcat.2022.03.023].
  • LaFollette, M. R. & Lobo, R. F. “Olefin methylation over iron zeolites and the methanol to hydrocarbons reaction.” Applied Catalysis A: General, 641, 9 (2022). [DOI:10.1016/j.apcata.2022.118645].
  • Le, T. T., Shilpa, K., Lee, C., Han, S., Weiland, C., Bare, S. R., Dauenhauer, P. J. & Rimer, J. D. “Core-shell and egg-shell zeolite catalysts for enhanced hydrocarbon processing.” Journal of Catalysis, 405, 664-675 (2022). [DOI:10.1016/j.jcat.2021.11.004].
  • Li, X., Han, H., Xu, W., Hwang, S. J., Shi, Z., Lu, P., Bhan, A. & Tsapatsis, M. “Acid Catalysis over Low-Silica Faujasite Zeolites.” J. Am. Chem. Soc., 144, 9324-9329 (2022). [DOI:10.1021/jacs.2c01022].
  • Li, X., Han, H., Xu, W., Hwang, S. J., Lu, P., Bhan, A. & Tsapatsis, M. “Enhanced Reactivity of Accessible Protons in Sodalite Cages of Faujasite Zeolite.” Angew. Chem. Int. Ed. Engl., 61, e202111180 (2022). [DOI:10.1002/anie.202111180].
  • Luo, T. Y., Park, S., Chen, T. H., Prerna, Patel, R., Li, X., Ilja Siepmann, J., Caratzoulas, S., Xia, Z. & Tsapatsis, M. “Simultaneously Enhanced Hydrophilicity and Stability of a Metal-Organic Framework via Post-Synthetic Modification for Water Vapor Sorption/Desorption.” Angew. Chem. Int. Ed. Engl., 61, e202209034 (2022). [DOI:10.1002/anie.202209034].
  • Luo, Y., Kuo, M. J., Ye, M., Lobo, R. & Ierapetritou, M. “Comparison of 4,4′-Dimethylbiphenyl from Biomass-Derived Furfural and Oil-Based Resource: Technoeconomic Analysis and Life-Cycle Assessment..” Industrial & Engineering Chemistry Research, 61, 8963-8972 (2022). [DOI:10.1021/acs.iecr.2c00398].
  • Miao, Y., Lee, D. T., de Mello, M. D., Ahmad, M., Abdel-Rahman, M. K., Eckhert, P. M., Boscoboinik, J. A., Fairbrother, D. H. & Tsapatsis, M. “Solvent-free bottom-up patterning of zeolitic imidazolate frameworks.” Nat Commun, 13, 420 (2022). [DOI:10.1038/s41467-022-28050-z].
  • Qi, L., Zhang, Y., Babucci, M., Chen, C., Lu, P., Li, J., Dun, C., Hoffman, A. S., Urban, J. J., Tsapatsis, M., Bare, S. R., Han, Y., Gates, B. C. & Bell, A. T. “Dehydrogenation of Propane and n-Butane Catalyzed by Isolated PtZn4 Sites Supported on Self-Pillared Zeolite Pentasil Nanosheets.” ACS Catal., 12, 11177-11189 (2022). [DOI:10.1021/acscatal.2c01631].
  • Ro, I., Qi, J., Lee, S., Xu, M., Yan, X., Xie, Z., Zakem, G., Morales, A., Chen, J. G., Pan, X., Vlachos, D. G., Caratzoulas, S. & Christopher, P. “Bifunctional hydroformylation on heterogeneous Rh-WOx pair site catalysts.” Nature, 609, 287-292 (2022). [DOI:10.1038/s41586-022-05075-4].
  • Ro, I., Qi, J., Lee, S., Xu, M., Yan, X., Xie, Z., Zakem, G., Morales, A., Chen, J.G., Pan, X., Vlachos, D., Caratzoulas, S. & Christopher, P. “Bifunctional hydroformylation on heterogeneous Rh-WOx pair site catalysts.” Nature, 609, 287–292 (2022). [DOI:10.1038/s41586-022-05075-4].
  • Rosen, D. J., Foucher, A. C., Lee, J. D., Yang, S., Marino, E., Stach, E. A. & Murray, C. B. “Microwave Heating of Nanocrystals for Rapid, Low-Aggregation Intermetallic Phase Transformations.” ACS Mater. Lett., 4, 823-830 (2022). [DOI:10.1021/acsmaterialslett.2c00174].
  • Rosen, D. J., Yang, S., Marino, E., Jiang, Z. & Murray, C. B. “In Situ EXAFS-Based Nanothermometry of Heterodimer Nanocrystals under Induction Heating.” The Journal of Physical Chemistry C, 126, 3623-3634 (2022). [DOI:10.1021/acs.jpcc.2c00608].
  • Sheehan, J. D., Ebikade, E., Vlachos, D. G. & Lobo, R. F. “Lignin-Based Water-Soluble Polymers Exhibiting Biodegradability and Activity as Flocculating Agents.” ACS Sustain. Chem. Eng., 10, 11117-11129 (2022). [DOI:10.1021/acssuschemeng.2c01428].
  • Sokol, H., Ebrahim, A., Caratzoulas, S., Frenkel, A. & Valla, J. “In Situ XAFS, XRD, and DFT Characterization of the Sulfur Adsorption Sites on Cu and Ce Exchanged Y Zeolites.” The Journal of Physical Chemistry C, 126, 1496-1512 (2022). [DOI:10.1021/acs.jpcc.1c09128].
  • Wang, Y., Su, Y.-Q., Hensen, E. J. M. & Vlachos, D. G. “Insights into Supported Subnanometer Catalysts Exposed to CO via Machine-Learning-Enabled Multiscale Modeling.” Chem. Mater., 34, 1611-1619 (2022). [DOI:10.1021/acs.chemmater.1c03616].
  • Wang, Y., Kalscheur, J., Ebikade, E., Li, Q. & Vlachos, D. G. “LigninGraphs: lignin structure determination with multiscale graph modeling.” J Cheminform, 14, 43 (2022). [DOI:10.1186/s13321-022-00627-2].
  • Wang, Y., Lee, S., Zhou, J., Fu, J., Foucher, A., Stach, E., Ma, L., Marinkovic N., Ehrlich, S., Zheng, W. & Vlachos, D. “Higher loadings of Pt single atoms and clusters over reducible metal oxides: application to C–O bond activation.” Catal. Sci. Technol., 9, (2022). [DOI:10.1039/d2cy00193d].
  • Wittreich, G., Liu, S., Dauenhauer, P. & Vlachos, D. “Catalytic resonance of ammonia synthesis by simulated dynamic ruthenium crystal strain.” Sci Adv, 8, eabl6576 (2022). [DOI:10.1126/sciadv.abl6576].
  • Zhao, L., Yang, P., Shi, S., Zhu, G., Feng, X., Zheng, W., Vlachos, D. G. & Xu, J. “Activation of Molecular Oxygen for Alcohol Oxidation over Vanadium Carbon Catalysts Synthesized via the Heterogeneous Ligand Strategy.” ACS Catal., 12, 15249-15258 (2022). [DOI:10.1021/acscatal.2c04601].
  • Deegan, M. M., Bhattacharjee, R., Caratzoulas, S. & Bloch, E. D. “Stabilizing Porosity in Organic Cages through Coordination Chemistry.” Inorganic Chemistry, 60, 7044-7050 (2021). [DOI:10.1021/acs.inorgchem.0c03590].
  • Chen, H. & Abdelrahman, O. A. “Cooperative Adsorption: Solvating the Hofmann Elimination of Alkylamines.” ACS Catal., 11, 6416-6430 (2021). [DOI:10.1021/acscatal.1c01364].
  • Chen, T. H., Vlachos, D. G. & Caratzoulas, S. “Bronsted Acid Catalysis of the Direct Acylation of 2-Methylfuran by Acetic Acid. Theoretical Insights into the Role of Bronsted Acidity and Confinement.” ACS Catal., 11, 9916-9925 (2021). [DOI:10.1021/acscatal.1c01318].
  • Cho, H. J., Kuo, M. J., Ye, M. C., Kurz, Y., Yuan, Y. & Lobo, R. F. “Selective Synthesis of 4,4 '-Dimethylbiphenyl from 2-Methylfuran.” ACS Sustain. Chem. Eng., 9, 3316-3323 (2021). [DOI:10.1021/acssuschemeng.0c09227].
  • Ebikade, E. O., Sadula, S., Gupta, Y. & Vlachos, D. G. “A review of thermal and thermocatalytic valorization of food waste.” Green Chem, 23, 2806-2833 (2021). [DOI:10.1039/d1gc00536g].
  • Ebikade, E. O., Sadula, S., Liu, S. & Vlachos, D. G. “Lignin monomer conversion into biolubricant base oils.” Green Chem, 23, 10090-10100 (2021). [DOI:10.1039/d1gc03350f].
  • Foucher, A. C., Marcella, N., Lee, J. D., Rosen, D. J., Tappero, R., Murray, C. B., Frenkel, A. I. & Stach, E. A. “Structural and Valence State Modification of Cobalt in CoPt Nanocatalysts in Redox Conditions.” ACS Nano, 15, 20619-20632 (2021). [DOI:10.1021/acsnano.1c09450].
  • Halder, A., Lenardi, C., Timoshenko, J., Mravak, A., Yang, B., Kolipaka, L. K., Piazzoni, C., Seifert, S., Bonacic-Koutecky, V., Frenkel, A. I., Milani, P. & Vajda, S. “CO2 Methanation on Cu-Cluster Decorated Zirconia Supports with Different Morphology: A Combined Experimental In Situ GIXANES/GISAXS, Ex Situ XPS and Theoretical DFT Study.” ACS Catal., 11, 6210-6224 (2021). [DOI:10.1021/acscatal.0c05029].
  • Hayashi, M., Lee, D. T., de Mello, M. D., Boscoboinik, J. A. & Tsapatsis, M. “ZIF-8 Membrane Permselectivity Modification by Manganese(II) Acetylacetonate Vapor Treatment.” Angew. Chem. Int. Ed. Engl., 6, (2021). [DOI:10.1002/anie.202100173].
  • Jain, S. K., Tabassum, T., Li, L., Ren, L., Fan, W., Tsapatsis, M., Caratzoulas, S., Han, S. & Scott, S. L. “P-Site Structural Diversity and Evolution in a Zeosil Catalyst.” J. Am. Chem. Soc., 143, 1968-1983 (2021). [DOI:10.1021/jacs.0c11768].
  • Josephson, T. R., Dauenhauer, P. J., Tsapatsis, M. & Siepmann, J. I. “Adsorption of furan, hexanoic acid, and alkanes in a hierarchical zeolite at reaction conditions: Insights from molecular simulations.” J. Comput. Sci., 48, 11 (2021). [DOI:10.1016/j.jocs.2020.101267].
  • Kumar, G., Ren, L. M., Pang, Y. T., Li, X. Y., Chen, H., Gulbinski, J., Dauenhauer, P. J., Tsapatsis, M. & Abdelrahman, O. A. “Acid Sites of Phosphorus-Modified Zeosils.” ACS Catal., 11, 9933-9948 (2021). [DOI:10.1021/acscatal.1c01588].
  • Lee, S., Patra, A., Christopher, P., Vlachos, D. G. & Caratzoulas, S. “Theoretical Study of Ethylene Hydroformylation on Atomically Dispersed Rh/Al2O3 Catalysts: Reaction Mechanism and Influence of the ReOx Promoter.” ACS Catal., 11, 9506-9518 (2021). [DOI:10.1021/acscatal.1c00705].
  • Li, C., Li, J., Qin, L., Yang, P. P. & Vlachos, D. G. “Recent Advances in the Photocatalytic Conversion of Biomass-Derived Furanic Compounds.” ACS Catal., 11, 11336-11359 (2021). [DOI:10.1021/acscatal.1c02551].
  • Lin, Z., Denny, S. R. & Chen, J. G. “Transition metal carbides and nitrides as catalysts for thermochemical reactions.” Journal of Catalysis, 404, 929-942 (2021). [DOI:10.1016/j.jcat.2021.06.022].
  • Lin, Z. X., Liu, S. Z., Denny, S. R., Porter, W. N., Caratzoulas, S., Boscoboinik, J. A., Vlachos, D. G. & Chen, J. G. “Experimental and Theoretical Insights into the Active Sites on WOx/Pt(111) Surfaces for Dehydrogenation and Dehydration Reactions.” ACS Catal., 11, 8023-8032 (2021). [DOI:10.1021/acscatal.1c01061].
  • Liu, Q., Zhou, L., Fan, D., Guan, M., Ma, Q., Li, S., Ouyang, X., Qiu, X. & Fan, W. “Adsorption-Enhanced Glucan Oligomer Production from Cellulose Hydrolysis over Hyper-Cross-Linked Polymer in Molten Salt Hydrate.” ACS Appl Mater Interfaces, 13, 52082-52091 (2021). [DOI:10.1021/acsami.1c09360].
  • Liu, Q. Y. & Fan, W. “Recent Advances in the Synthesis of Mesoporous Zeolites by Post-synthetic Method , Supramolecular Self-assembly and Mesopore Generation Agent.” Chem. J. Chin. Univ.-Chin., 42, 60-73 (2021). [DOI:10.7503/cjcu20200687].
  • Liu, Q. Y., Luo, S., Fan, W., Ouyang, X. P. & Qiu, X. Q. “Separation of short-chain glucan oligomers from molten salt hydrate and hydrolysis to glucose.” Green Chem, 23, 4114-4124 (2021). [DOI:10.1039/d1gc00851j].
  • Lu, P., Ghosh, S., de Mello, M. D., Kamaluddin, H. S., Li, X. Y., Kumar, G., Duan, X. K., Abeykoon, M., Boscoboinik, J. A., Qi, L., Dai, H., Luo, T. Y., Al-Thabaiti, S., Narasimharao, K., Khan, Z., Rimer, J. D., Bell, A. T., Dauenhauer, P., Mkhoyan, K. A. & Tsapatsis, M. “Few-Unit-Cell MFI Zeolite Synthesized using a Simple Di-quaternary Ammonium Structure-Directing Agent.” Angewandte Chemie-International Edition, 60, 19214-19221 (2021). [DOI:10.1002/anie.202104574].
  • Lusardi, M. & Davis, M. E. “Sulfonic Acid-Functionalized Zeolite Beta: Bronsted Acid Catalysts for Reactions Involving Liquid Water.” ACS Sustain. Chem. Eng., 9, 17120-17127 (2021). [DOI:10.1021/acssuschemeng.1c06401].
  • Miao, Y. R., Lee, D. T., de Mello, M. D., Abdel-Rahman, M. K., Corkery, P., Boscoboinik, J. A., Fairbrother, D. H. & Tsapatsis, M. “Electron beam induced modification of ZIF-8 membrane permeation properties.” Chem. Commun., 57, 5250-5253 (2021). [DOI:10.1039/d1cc00252j].
  • Sadula, S., Quiroz, N. R., Athaley, A., Ebikade, E. O., Ierapetritou, M., Vlachos, D. G. & Saha, B. “One-step lignocellulose depolymerization and saccharification to high sugar yield and less condensed isolated lignin.” Green Chem, 23, 1200-1211 (2021). [DOI:10.1039/d0gc04119j].
  • Saha, B., Vlachos, D. “Synthesis of (hemi)cellulosic Lubricant Base Oils via Catalytic Coupling and Deoxygenation Pathways.” Green Chemistry, 23, 4905-5232 (2021). [DOI:10.1039/D1GC00429H].
  • Wang, Y. F., Kalscheur, J., Su, Y. Q., Hensen, E. J. M. & Vlachos, D. G. “Real-time dynamics and structures of supported subnanometer catalysts via multiscale simulations.” Nat. Commun., 12, 9 (2021). [DOI:10.1038/s41467-021-25752-8].
  • Xu, Y. X., de Mello, M. D., Zhou, C., Sharma, S., Karagoz, B., Head, A. R., Darbari, Z., Waluyo, I., Hunt, A., Stacchiola, D. J., Manzi, S., Boscoboinik, A. M., Pereyra, V. D. & Boscoboinik, J. A. Xenon “Xenon Trapping in Metal-Supported Silica Nanocages.” Small, 17, 10 (2021). [DOI:10.1002/smll.202103661].
  • Zhuang, Z. B., Giles, S. A., Jenness, G. R., Abbasi, R., Chen, X., Wang, B., Vlachos, D. G. & Yan, Y. S. “Oxygen Evolution on Iron Oxide Nanoparticles: The Impact of Crystallinity and Size on the Overpotential.” J. Electrochem. Soc., 168, 10 (2021). [DOI:10.1149/1945-7111/abef47].
  • Nguyen, T., Zheng, W., Celik, F., Tsilomelekis, G. “CO2-assisted Ethane Oxidative Dehydrogenation over MoOx Catalysts Supported on Reducible CeO2–TiO2.” Catalysis Science & Technology, 11, 5687-5974 (2021). [DOI:10.1039/D1CY00362C].
  • Shetty, M., Walton, A., Gathmann, S., Ardagh, M.A., Gopeesingh, J., Resasco, J., Birol, T., Zhang, Q., Tsapatsis, M., Vlachos, D., Christopher, P., Frisbie, C.D., Abdelrahman, O., Dauenhauer, P. “The Catalytic Mechanics of Dynamic Surfaces: Stimulating Methods for Promoting Catalytic Resonance.” ACS Catalysis, 10, 12666-12695 (2020). [DOI:10.1021/acscatal.0c03336].
  • Ebikade, E. O.; Wang, Y. F.; Samulewicz, N.; Hasa, B.; Vlachos, D. “Active learning-driven quantitative synthesis-structure-property relations for improving performance and revealing active sites of nitrogen-doped carbon for the hydrogen evolution reaction.” React. Chem. Eng., 5, 2134-2147 (2020). [DOI:10.1039/d0re00243g].
  • Shetty, M.; Ardagh, M. A.; Pang, Y. T.; Abdelrahman, O. A.; Dauenhauer, P. J. “Electric-Field-Assisted Modulation of Surface Thermochemistry.” ACS Catal., 10, 12867-12880 (2020). [DOI:10.1021/acscatal.0c02124].
  • Gulbinski, J.; Ren, L. M.; Vattipalli, V.; Chen, H. Y.; Delaney, J.; Bai, P.; Dauenhauer, P.; Tsapatsis, M.; Abdelrahman, O. A.; Fan, W. “Role of Silica Support in Phosphoric Acid Catalyzed Production of p-Xylene from 2,5-Dimethylfuran and Ethylene.” Industrial & Engineering Chemistry Research, 59, 22049-22056 (2020). [DOI:10.1021/acs.iecr.0c04493].
  • Lansford, J. L.; Vlachos, D. G. “Spectroscopic Probe Molecule Selection Using Quantum Theory, First-Principles Calculations, and Machine Learning.” ACS Nano, 14, 17295-17307 (2020). [DOI:10.1021/acsnano.0c07408].
  • Qi, J.; Resasco, J.; Robatjazi, H.; Alvarez, I. B.; Abdelrahman, O.; Dauenhauer, P.; Christopher, P. “Dynamic Control of Elementary Step Energetics via Pulsed Illumination Enhances Photocatalysis on Metal Nanoparticles.” ACS Energy Lett., 5, 3518-3525 (2020). [DOI:10.1021/acsenergylett.0c01978].
  • Naik, A. V.; Joseph, K. E.; Shetty, M.; Ardagh, M. A.; Dauenhauer, P. J. “Kinetics of 2-Methylfuran Acylation with Fatty Acid Anhydrides for Biorenewable Surfactants.” ACS Sustain. Chem. Eng., 8, 18616-18625 (2020). [DOI:10.1021/acssuschemeng.0c06847].
  • Cho, H. J.; Xu, B. J. “Enabling Selective Tandem Reactions via Catalyst Architecture Engineering.” Trends Chem., 2, 929-941 (2020). [DOI:10.1016/j.trechm.2020.08.002].
  • Ebikade, O. E.; Samulewicz, N.; Xuan, S. Q.; Sheehan, J. D.; Wu, C. Q.; Vlachos, D. G. “Reductive catalytic fractionation of agricultural residue and energy crop lignin and application of lignin oil in antimicrobials.” Green Chem., 22, 7435-7447 (2020). [DOI:10.1039/d0gc02781b].
  • Wang, Y. F.; Su, Y. Q.; Hensen, E. J. M.; Vlachos, D. G. “Finite-Temperature Structures of Supported Subnanometer Catalysts Inferred via Statistical Learning and Genetic Algorithm-Based Optimization.” ACS Nano, 14, 13995-14007 (2020). [DOI:10.1021/acsnano.0c06472].
  • Lee, J. D.; Wang, C.; Jin, T.; Gorte, R. J.; Murray, C. B. “Engineering the composition of bimetallic nanocrystals to improve hydrodeoxygenation selectivity for 2-acetylfuran.” Applied Catalysis A: General, 606, 117808 (2020). [DOI:10.1016/j.apcata.2020.117808].
  • Liu, S. B.; Bhattacharjee, R.; Li, S.; Danielson, A.; Mazal, T.; Saha, B.; Vlachos, D. G. “Thiol-promoted catalytic synthesis of high-performance furan-containing lubricant base oils from biomass derived 2-alkylfurans and ketones.” Green Chem., 22, 7896-7906 (2020). [DOI:10.1039/d0gc01897j].
  • Resasco, J.; Christopher, P. “Atomically Dispersed Pt-group Catalysts: Reactivity, Uniformity, Structural Evolution, and Paths to Increased Functionality.” J. Phys. Chem. Lett., 11, 10114-10123 (2020). [DOI:10.1021/acs.jpclett.0c02904].
  • Metavarayuth, K.; Ejegbavwo, O.; McCarver, G.; Myrick, M. L.; Makris, T. M.; Vogiatzis, K. D.; Senanayake, S. D.; Manley, O. M.; Ebrahim, A. M.; Frenkel, A. I.; Hwang, S.; Rajeshkumar, T.; Jimenez, J. D.; Chen, K. X.; Shustova, N. B.; Chen, D. A. “Direct Identification of Mixed-Metal Centers in Metal-Organic Frameworks: Cu-3(BTC)(2) Transmetalated with Rh2+ Ions.” J. Phys. Chem. Lett., 11, 8138-8144 (2020). [DOI:10.1021/acs.jpclett.0c02539].
  • Eads, C. N.; Zhong, J.-Q.; Kim, D.; Akter, N.; Chen, Z.; Norton, A. M.; Lee, V.; Kelber, J. A.; Tsapatsis, M.; Boscoboinik, J. A.; Sadowski, J. T.; Zahl, P.; Tong, X.; Stacchiola, D. J.; Head, A. R.; Tenney, S. A. “Multi-modal Surface Analysis of Porous Films Under Operando Conditions.” AIP Adv., 10, 11 (2020). [DOI:10.1063/5.0006220].
  • Rowland, C. A., Lorzing, G. R., Bhattacharjee, R., Caratzoulas, S., Yap, G. P. A. & Bloch, E. D. “Design and Synthesis of Aryl-functionalized Carbazole-based Porous Coordination Cages.” Chem. Commun., 56, 9352-9355 (2020). [DOI:10.1039/d0cc03910a].
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