| Solvation at metal/water interfaces: An ab initio molecular dynamics benchmark of common computational approaches HH Heenen, JA Gauthier, HH Kristoffersen, T Ludwig, K Chan The Journal of Chemical Physics 152 (14), 2020 | 127 | 2020 |
| Solvent–adsorbate interactions and adsorbate-specific solvent structure in carbon dioxide reduction on a stepped Cu surface T Ludwig, JA Gauthier, KS Brown, S Ringe, JK Nørskov, K Chan The Journal of Physical Chemistry C 123 (10), 5999-6009, 2019 | 71 | 2019 |
| Mechanism of bismuth telluride exfoliation in an ionic liquid solvent T Ludwig, L Guo, P McCrary, Z Zhang, H Gordon, H Quan, M Stanton, ... Langmuir 31 (12), 3644-3652, 2015 | 58 | 2015 |
| Modeling potential-dependent electrochemical activation barriers: revisiting the alkaline hydrogen evolution reaction J Li, JH Stenlid, T Ludwig, PS Lamoureux, F Abild-Pedersen Journal of the American Chemical Society 143 (46), 19341-19355, 2021 | 29 | 2021 |
| Atomistic insight into cation effects on binding energies in Cu-catalyzed carbon dioxide reduction T Ludwig, JA Gauthier, CF Dickens, KS Brown, S Ringe, K Chan, ... The Journal of Physical Chemistry C 124 (45), 24765-24775, 2020 | 26 | 2020 |
| Neural network sampling of the free energy landscape for nitrogen dissociation on ruthenium EMY Lee, T Ludwig, B Yu, AR Singh, F Gygi, JK Nørskov, JJ de Pablo The Journal of Physical Chemistry Letters 12 (11), 2954-2962, 2021 | 24 | 2021 |
| Subsurface nitrogen dissociation kinetics in lithium metal from metadynamics T Ludwig, AR Singh, JK Nørskov The Journal of Physical Chemistry C 124 (48), 26368-26378, 2020 | 19 | 2020 |
| Molecular dynamics simulation of bismuth telluride exfoliation mechanisms in different ionic liquid solvents A Abedini, T Ludwig, Z Zhang, CH Turner Langmuir 32 (39), 9982-9992, 2016 | 16 | 2016 |
| Acetonitrile transition metal interfaces from first principles T Ludwig, AR Singh, JK Nørskov The Journal of Physical Chemistry Letters 11 (22), 9802-9811, 2020 | 15 | 2020 |
| Efficient Pd on carbon catalyst for ammonium formate dehydrogenation: Effect of surface oxygen functional groups Z Dong, A Mukhtar, T Ludwig, SA Akhade, SY Kang, B Wood, K Grubel, ... Applied Catalysis B: Environmental 321, 122015, 2023 | 8 | 2023 |
| Nonaqueous Solvent Adsorption on Transition Metal Surfaces with Density Functional Theory: Interaction of N,N-Dimethylformamide (DMF), Tetrahydrofuran (THF … T Ludwig, AR Singh, JK Nørskov The Journal of Physical Chemistry C 125 (40), 21943-21957, 2021 | 4 | 2021 |
| Influence of residual chlorine on Ru/TiO2 active sites during CO2 methanation JM Crawford, BE Petel, MJ Rasmussen, T Ludwig, EM Miller, ... Applied Catalysis A: General 663, 119292, 2023 | 2 | 2023 |
| Silver-decorated palladium on carbon catalyst for enhanced ammonium formate dehydrogenation Z Dong, A Mukhtar, T Ludwig, SA Akhade, W Hu, JZ Hu, K Grubel, ... Catalysis Science & Technology 14 (2), 449-463, 2024 | | 2024 |
| Importance of Chlorine Removal from Ru/TiO2 Methanation Catalysts J Crawford, BE Petel, M Rasmussen, M Griffin, T Ludwig, SH Pang, ... The 28th North American Catalysis Society Meeting, 2023 | | 2023 |
| Insights into Chemical Reactions at Interfaces from Enhanced Sampling and Global Optimization Algorithms T Ludwig Stanford University, 2021 | | 2021 |
| Free Energy Surface of Nitrogen Dissociation on Ru (0001) from First Principles Molecular Dynamics with Enhanced Sampling Methods T Ludwig, E Lee, J Norskov, J De Pablo 2020 Virtual AIChE Annual Meeting, 2020 | | 2020 |
| Theoretical Insight into the Surface Dynamics of Lithium-Mediated Nitrogen Activation T Ludwig, J Norskov 2020 Virtual AIChE Annual Meeting, 2020 | | 2020 |
Jens NorskovTechnical University of DenmarkVerified email at dtu.dk
