Progress in Accurate Chemical Kinetic Modeling, Simulations, and Parameter Estimation for Heterogeneous Catalysis von Matera, Sebastian, Schneider, William F, Heyden, Andreas, Savara, Aditya

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The 2020 plasma catalysis roadmap von Bogaerts, Annemie, Tu, Xin, Whitehead, J Christopher, Centi, Gabriele, Lefferts, Leon, Guaitella, Olivier, Azzolina-Jury, Federico, Kim, Hyun-Ha, Murphy, Anthony B, Schneider, William F, Nozaki, Tomohiro, Hicks, Jason C, Rousseau, Antoine, Thevenet, Frederic, Khacef, Ahmed, Carreon, Maria

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Rationalizing the light-induced phase separation of mixed halide organic–inorganic perovskites von Draguta, Sergiu, Sharia, Onise, Yoon, Seog Joon, Brennan, Michael C., Morozov, Yurii V., Manser, Joseph S., Kamat, Prashant V., Schneider, William F., Kuno, Masaru

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Solvation and Mobilization of Copper Active Sites in Zeolites by Ammonia: Consequences for the Catalytic Reduction of Nitrogen Oxides von Paolucci, Christopher, Di Iorio, John R, Schneider, William F, Gounder, Rajamani

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Beyond fossil fuel-driven nitrogen transformations von Chen, Jingguang G, Crooks, Richard M, Seefeldt, Lance C, Bren, Kara L, Bullock, R Morris, Darensbourg, Marcetta Y, Holland, Patrick L, Hoffman, Brian, Janik, Michael J, Jones, Anne K, Kanatzidis, Mercouri G, King, Paul, Lancaster, Kyle M, Lymar, Sergei V, Pfromm, Peter, Schneider, William F, Schrock, Richard R

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Role of Molecular Modeling in the Development of CO2–Reactive Ionic Liquids von Sheridan, Quintin R, Schneider, William F, Maginn, Edward J

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Catalysis in a Cage: Condition-Dependent Speciation and Dynamics of Exchanged Cu Cations in SSZ-13 Zeolites von Paolucci, Christopher, Parekh, Atish A, Khurana, Ishant, Di Iorio, John R, Li, Hui, Albarracin Caballero, Jonatan D, Shih, Arthur J, Anggara, Trunojoyo, Delgass, W. Nicholas, Miller, Jeffrey T, Ribeiro, Fabio H, Gounder, Rajamani, Schneider, William F

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Catalysis Enabled by Plasma Activation of Strong Chemical Bonds: A Review von Mehta, Prateek, Barboun, Patrick, Go, David B, Hicks, Jason C, Schneider, William F

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Isolation of the Copper Redox Steps in the Standard Selective Catalytic Reduction on Cu-SSZ-13 von Paolucci, Christopher, Verma, Anuj A., Bates, Shane A., Kispersky, Vincent F., Miller, Jeffrey T., Gounder, Rajamani, Delgass, W. Nicholas, Ribeiro, Fabio H., Schneider, William F.

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Plasma-Catalytic Ammonia Synthesis beyond the Equilibrium Limit von Mehta, Prateek, Barboun, Patrick M, Engelmann, Yannick, Go, David B, Bogaerts, Annemie, Schneider, William F, Hicks, Jason C

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Equimolar CO2 Absorption by Anion-Functionalized Ionic Liquids von Gurkan, Burcu E, de la Fuente, Juan C, Mindrup, Elaine M, Ficke, Lindsay E, Goodrich, Brett F, Price, Erica A, Schneider, William F, Brennecke, Joan F

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Observation and rationalization of nitrogen oxidation enabled only by coupled plasma and catalyst von Ma, Hanyu, Sharma, Rakesh K., Welzel, Stefan, van de Sanden, Mauritius C. M., Tsampas, Mihalis N., Schneider, William F.

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Experimental and Computational Interrogation of Fast SCR Mechanism and Active Sites on H‑Form SSZ-13 von Li, Sichi, Zheng, Yang, Gao, Feng, Szanyi, Janos, Schneider, William F

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Adsorption Energy Correlations at the Metal–Support Boundary von Mehta, Prateek, Greeley, Jeffrey, Delgass, W. Nicholas, Schneider, William F

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The impact of transition metal catalysts on macroscopic dielectric barrier discharge (DBD) characteristics in an ammonia synthesis plasma catalysis reactor von Herrera, Francisco A, Brown, Gabriel H, Barboun, Patrick, Turan, Nazli, Mehta, Prateek, Schneider, William F, Hicks, Jason C, Go, David B

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Distinguishing Plasma Contributions to Catalyst Performance in Plasma-Assisted Ammonia Synthesis von Barboun, Patrick, Mehta, Prateek, Herrera, Francisco A, Go, David B, Schneider, William F, Hicks, Jason C

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Consequences of exchange-site heterogeneity and dynamics on the UV-visible spectrum of Cu-exchanged SSZ-13 von Li, Hui, Paolucci, Christopher, Khurana, Ishant, Wilcox, Laura N, Göltl, Florian, Albarracin-Caballero, Jonatan D, Shih, Arthur J, Ribeiro, Fabio H, Gounder, Rajamani, Schneider, William F

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Tracking Iodide and Bromide Ion Segregation in Mixed Halide Lead Perovskites during Photoirradiation von Yoon, Seog Joon, Draguta, Sergiu, Manser, Joseph S, Sharia, Onise, Schneider, William F, Kuno, Masaru, Kamat, Prashant V

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Density Functional Theory Comparison of Water Dissociation Steps on Cu, Au, Ni, Pd, and Pt von Phatak, Abhijit A, Delgass, W. Nicholas, Ribeiro, Fabio H, Schneider, William F

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Comparison of cluster expansion fitting algorithms for interactions at surfaces von Herder, Laura M., Bray, Jason M., Schneider, William F.

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