Dynamics and Reactions of Molecular Ru Catalysts at Carbon Nanotube–Water Interfaces von Zhan, Shaoqi, Ahlquist, Mårten S. G

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Highly efficient and robust molecular water oxidation catalysts based on ruthenium complexes von Wang, Lei, Duan, Lele, Wang, Ying, Ahlquist, Mårten S G, Sun, Licheng

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O-O bond formation via radical coupling in a dinuclear iron water oxidation catalyst with high catalytic activity von Li, Ge, Ahlquist, Mårten S G

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Removing the Barrier in O–O Bond Formation Via the Combination of Intramolecular Radical Coupling and the Oxide Relay Mechanism von de Gracia Triviño, Juan Angel, Ahlquist, Mårten S. G.

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Aggregation and Significant Difference in Reactivity Therein: Blocking the CO2‑to-CH3OH Reaction von Chen, Xiaoyu, Wei, Dongli, Ahlquist, Mårten S. G

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Impact of BMI on clinical outcomes of NOAC therapy in daily care - Results of the prospective Dresden NOAC Registry (NCT01588119) von Tittl, L., Endig, S., Marten, S., Reitter, A., Beyer-Westendorf, I., Beyer-Westendorf, J.

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Understanding the Enhanced Catalytic CO2 Reduction upon Adhering Cobalt Porphyrin to Carbon Nanotubes and the Inverse Loading Effect von Chen, Xiaoyu, Hu, Xin-Ming, Daasbjerg, Kim, Ahlquist, Mårten S. G

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Nonbonded Zr4+ and Hf4+ Models for Simulations of Condensed Phase Metal–Organic Frameworks von Su, Hao, Ahlquist, Mårten S. G

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Why Is There a Barrier in the Coupling of Two Radicals in the Water Oxidation Reaction? von Fan, Ting, Zhan, Shaoqi, Ahlquist, Mårten S. G

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Computational comparison of Ru(bda)(py) 2 and Fe(bda)(py) 2 as water oxidation catalysts von Li, Ge, Ahlquist, Mårten S G

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Intermolecular O–O Bond Formation between High-Valent Ru–oxo Species von Liu, Tianqi, Zhan, Shaoqi, Zhang, Biaobiao, Wang, Linqin, Shen, Nannan, Ahlquist, Mårten S. G., Fan, Xiaolei, Sun, Licheng

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Theoretical Investigation of a Parallel Catalytic Cycle in CO2 Hydrogenation by (PNP)IrH3 von Osadchuk, Irina, Tamm, Toomas, Ahlquist, Mårten S. G

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Deconstructing the Enhancing Effect on CO2 Activation in the Electric Double Layer with EVB Dynamic Reaction Modeling von Chen, Xiaoyu, Ahlquist, Mårten S. G

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Utilizing the Surface Electrostatic Potential to Predict the Interactions of Pt and Ni Nanoparticles with Lewis Acids and Basesσ-Lumps and σ‑Holes Govern the Catalytic Activities... von Li, Ge, Stenlid, Joakim H, Ahlquist, Mårten S. G, Brinck, Tore

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Molecular engineering for efficient and selective iron porphyrin catalysts for electrochemical reduction of CO2 to CO von Ambre, Ram B, Daniel, Quentin, Fan, Ting, Chen, Hong, Zhang, Biaobiao, Wang, Lei, Ahlquist, Mårten S G, Duan, Lele, Sun, Licheng

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Electron-Poor Iridium Pincer Complexes as Dehydrogenation Catalysts: Investigations into Deactivation through Formation of N2, CO, and Hydride Complexes von Spangenberg, Alice, Kovalenko, Oleksandr O., Ahlquist, Mårten S. G., Wendt, Ola F.

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Hydrophobic/Hydrophilic Directionality Affects the Mechanism of Ru-Catalyzed Water Oxidation Reaction von Zhan, Shaoqi, Zhang, Biaobiao, Sun, Licheng, Ahlquist, Mårten S. G

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Nucleophilic Attack by OH2 or OH–: A Detailed Investigation on pH-Dependent Performance of a Ru Catalyst von Wang, Ying, Zhan, Shaoqi, Ahlquist, Mårten S. G

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Scaling Relationships for Binding Energies of Transition Metal Complexes von Wang, Ying, Montoya, Joseph H., Tsai, Charlie, Ahlquist, Mårten S. G., Nørskov, Jens K., Studt, Felix

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Water Oxidation Catalyzed by Mononuclear Ruthenium Complexes with a 2,2′-Bipyridine-6,6′-dicarboxylate (bda) Ligand: How Ligand Environment Influences the Catalytic Behavior von Staehle, Robert, Tong, Lianpeng, Wang, Lei, Duan, Lele, Fischer, Andreas, Ahlquist, Mårten S. G, Sun, Licheng, Rau, Sven

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