Skip to contents Xu, Zhongnan; Rossmeisl, Jan; Kitchin, John R. A Linear Response DFT+U Study of Trends in the Oxygen Evolution Activity of Transition Metal Rutile Dioxides Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2015 Published in: The Journal of Physical Chemistry C Karamad, Mohammadreza; Tripkovic, Vladimir; Rossmeisl, Jan Intermetallic Alloys as CO Electroreduction Catalysts—Role of Isolated Active Sites Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2014 Published in: ACS Catalysis Zawadzki, Paweł; Jacobsen, Karsten Wedel; Rossmeisl, Jan Electronic hole localization in rutile and anatase TiO2 – Self-interaction correction in Δ-SCF DFT Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Elsevier BV, 2011 Published in: Chemical Physics Letters Zawadzki, Paweł; Rossmeisl, Jan; Jacobsen, Karsten Wedel Electronic hole transfer in rutile and anatase TiO2: Effect of a delocalization error in the density functional theory on the charge transfer barrier height Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Physical Society (APS), 2011 Published in: Physical Review B Cepitis, Ritums; Ivaništšev, Vladislav; Rossmeisl, Jan; Kongi, Nadezda Bypassing the scaling relations in oxygen electrocatalysis with geometry-adaptive catalysts Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Royal Society of Chemistry (RSC), 2024 Published in: Catalysis Science & Technology Mints, Vladislav A.; Svane, Katrine L.; Rossmeisl, Jan; Arenz, Matthias Exploring the High-Entropy Oxide Composition Space: Insights through Comparing Experimental with Theoretical Models for the Oxygen Evolution Reaction Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2024 Published in: ACS Catalysis Schlegel, Nicolas; Bagger, Alexander; Rossmeisl, Jan; Arenz, Matthias Elucidating the Reaction Pathway of Glucose Electrooxidation to Its Valuable Products: The Influence of Mass Transport and Electrode Potential on the Product Distribution Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2023 Published in: The Journal of Physical Chemistry C Ivanistsev, Vladislav; Cepitis, Ritums; Kongi, Nadezda; Rossmeisl, Jan Surface Curvature Effect on Dual-Atom Site Electrocatalysis Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. The Electrochemical Society, 2023 Published in: ECS Meeting Abstracts Cepitis, Ritums; Kongi, Nadezda; Rossmeisl, Jan; Ivaništšev, Vladislav Surface Curvature Effect on Dual-Atom Site Oxygen Electrocatalysis Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2023 Published in: ACS Energy Letters Yan, Dengxin; Kristoffersen, Henrik H.; Castelli, Ivano E.; Rossmeisl, Jan Bridging the Catalyst Reactivity Gap between Au and Cu for the Reverse Water–Gas Shift Reaction Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2022 Published in: The Journal of Physical Chemistry C Bagger, Alexander; Christensen, Oliver; Ivaništšev, Vladislav; Rossmeisl, Jan Catalytic CO2/CO Reduction: Gas, Aqueous, and Aprotic Phases Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2022 Published in: ACS Catalysis Yan, Dengxin; Kristoffersen, Henrik H.; Pedersen, Jack K.; Rossmeisl, Jan Rationally Tailoring Catalysts for the CO Oxidation Reaction by Using DFT Calculations Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2022 Published in: ACS Catalysis Divanis, Spyridon; Frandsen, Adrian Malthe; Kutlusoy, Tugce; Rossmeisl, Jan Lifting the discrepancy between experimental results and the theoretical predictions for the catalytic activity of RuO2(110) towards oxygen evolution reaction Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Royal Society of Chemistry (RSC), 2021 Published in: Physical Chemistry Chemical Physics Bagger, Alexander; Wan, Hao; Stephens, Ifan E. L.; Rossmeisl, Jan Role of Catalyst in Controlling N2 Reduction Selectivity: A Unified View of Nitrogenase and Solid Electrodes Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2021 Published in: ACS Catalysis Wan, Hao; Jiao, Yan; Bagger, Alexander; Rossmeisl, Jan Three-Dimensional Carbon Electrocatalysts for CO2 or CO Reduction Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2021 Published in: ACS Catalysis Löffler, Tobias; Ludwig, Alfred; Rossmeisl, Jan; Schuhmann, Wolfgang Was macht Hochentropie‐Legierungen zu außergewöhnlichen Elektrokatalysateuren? Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Wiley, 2021 Published in: Angewandte Chemie Löffler, Tobias; Ludwig, Alfred; Rossmeisl, Jan; Schuhmann, Wolfgang What Makes High‐Entropy Alloys Exceptional Electrocatalysts? Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Wiley, 2021 Published in: Angewandte Chemie International Edition Wan, Hao; Jensen, Anders W.; Escudero-Escribano, María; Rossmeisl, Jan Insights in the Oxygen Reduction Reaction: From Metallic Electrocatalysts to Diporphyrins Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2020 Published in: ACS Catalysis Wan, Hao; Østergaard, Thomas Mandal; Arnarson, Logi; Rossmeisl, Jan Climbing the 3D Volcano for the Oxygen Reduction Reaction Using Porphyrin Motifs Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2019 Published in: ACS Sustainable Chemistry & Engineering Holst-Olesen, Kaspar; Silvioli, Luca; Rossmeisl, Jan; Arenz, Matthias Enhanced Oxygen Reduction Reaction on Fe/N/C Catalyst in Acetate Buffer Electrolyte Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2019 Published in: ACS Catalysis
Xu, Zhongnan; Rossmeisl, Jan; Kitchin, John R. A Linear Response DFT+U Study of Trends in the Oxygen Evolution Activity of Transition Metal Rutile Dioxides Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2015 Published in: The Journal of Physical Chemistry C
Karamad, Mohammadreza; Tripkovic, Vladimir; Rossmeisl, Jan Intermetallic Alloys as CO Electroreduction Catalysts—Role of Isolated Active Sites Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2014 Published in: ACS Catalysis
Zawadzki, Paweł; Jacobsen, Karsten Wedel; Rossmeisl, Jan Electronic hole localization in rutile and anatase TiO2 – Self-interaction correction in Δ-SCF DFT Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Elsevier BV, 2011 Published in: Chemical Physics Letters
Zawadzki, Paweł; Rossmeisl, Jan; Jacobsen, Karsten Wedel Electronic hole transfer in rutile and anatase TiO2: Effect of a delocalization error in the density functional theory on the charge transfer barrier height Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Physical Society (APS), 2011 Published in: Physical Review B
Cepitis, Ritums; Ivaništšev, Vladislav; Rossmeisl, Jan; Kongi, Nadezda Bypassing the scaling relations in oxygen electrocatalysis with geometry-adaptive catalysts Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Royal Society of Chemistry (RSC), 2024 Published in: Catalysis Science & Technology
Mints, Vladislav A.; Svane, Katrine L.; Rossmeisl, Jan; Arenz, Matthias Exploring the High-Entropy Oxide Composition Space: Insights through Comparing Experimental with Theoretical Models for the Oxygen Evolution Reaction Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2024 Published in: ACS Catalysis
Schlegel, Nicolas; Bagger, Alexander; Rossmeisl, Jan; Arenz, Matthias Elucidating the Reaction Pathway of Glucose Electrooxidation to Its Valuable Products: The Influence of Mass Transport and Electrode Potential on the Product Distribution Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2023 Published in: The Journal of Physical Chemistry C
Ivanistsev, Vladislav; Cepitis, Ritums; Kongi, Nadezda; Rossmeisl, Jan Surface Curvature Effect on Dual-Atom Site Electrocatalysis Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. The Electrochemical Society, 2023 Published in: ECS Meeting Abstracts
Cepitis, Ritums; Kongi, Nadezda; Rossmeisl, Jan; Ivaništšev, Vladislav Surface Curvature Effect on Dual-Atom Site Oxygen Electrocatalysis Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2023 Published in: ACS Energy Letters
Yan, Dengxin; Kristoffersen, Henrik H.; Castelli, Ivano E.; Rossmeisl, Jan Bridging the Catalyst Reactivity Gap between Au and Cu for the Reverse Water–Gas Shift Reaction Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2022 Published in: The Journal of Physical Chemistry C
Bagger, Alexander; Christensen, Oliver; Ivaništšev, Vladislav; Rossmeisl, Jan Catalytic CO2/CO Reduction: Gas, Aqueous, and Aprotic Phases Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2022 Published in: ACS Catalysis
Yan, Dengxin; Kristoffersen, Henrik H.; Pedersen, Jack K.; Rossmeisl, Jan Rationally Tailoring Catalysts for the CO Oxidation Reaction by Using DFT Calculations Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2022 Published in: ACS Catalysis
Divanis, Spyridon; Frandsen, Adrian Malthe; Kutlusoy, Tugce; Rossmeisl, Jan Lifting the discrepancy between experimental results and the theoretical predictions for the catalytic activity of RuO2(110) towards oxygen evolution reaction Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Royal Society of Chemistry (RSC), 2021 Published in: Physical Chemistry Chemical Physics
Bagger, Alexander; Wan, Hao; Stephens, Ifan E. L.; Rossmeisl, Jan Role of Catalyst in Controlling N2 Reduction Selectivity: A Unified View of Nitrogenase and Solid Electrodes Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2021 Published in: ACS Catalysis
Wan, Hao; Jiao, Yan; Bagger, Alexander; Rossmeisl, Jan Three-Dimensional Carbon Electrocatalysts for CO2 or CO Reduction Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2021 Published in: ACS Catalysis
Löffler, Tobias; Ludwig, Alfred; Rossmeisl, Jan; Schuhmann, Wolfgang Was macht Hochentropie‐Legierungen zu außergewöhnlichen Elektrokatalysateuren? Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Wiley, 2021 Published in: Angewandte Chemie
Löffler, Tobias; Ludwig, Alfred; Rossmeisl, Jan; Schuhmann, Wolfgang What Makes High‐Entropy Alloys Exceptional Electrocatalysts? Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Wiley, 2021 Published in: Angewandte Chemie International Edition
Wan, Hao; Jensen, Anders W.; Escudero-Escribano, María; Rossmeisl, Jan Insights in the Oxygen Reduction Reaction: From Metallic Electrocatalysts to Diporphyrins Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2020 Published in: ACS Catalysis
Wan, Hao; Østergaard, Thomas Mandal; Arnarson, Logi; Rossmeisl, Jan Climbing the 3D Volcano for the Oxygen Reduction Reaction Using Porphyrin Motifs Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2019 Published in: ACS Sustainable Chemistry & Engineering
Holst-Olesen, Kaspar; Silvioli, Luca; Rossmeisl, Jan; Arenz, Matthias Enhanced Oxygen Reduction Reaction on Fe/N/C Catalyst in Acetate Buffer Electrolyte Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2019 Published in: ACS Catalysis
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