What Atomic Positions Determines Reactivity of a Surface? Long‐Range, Directional Ligand Effects in Metallic Alloys

por Clausen, Christian M., Batchelor, Thomas A. A., Pedersen, Jack K., Rossmeisl, Jan
Publicado 2021

Complex‐Solid‐Solution Electrocatalyst Discovery by Computational Prediction and High‐Throughput Experimentation

por Batchelor, Thomas A. A., Löffler, Tobias, Xiao, Bin, Krysiak, Olga A., Strotkötter, Valerie, Pedersen, Jack K., Clausen, Christian M., Savan, Alan, Li, Yujiao, Schuhmann, Wolfgang, Rossmeisl, Jan, Ludwig, Alfred
Publicado 2021

Bayesian Optimization of High‐Entropy Alloy Compositions for Electrocatalytic Oxygen Reduction

por Pedersen, Jack K., Clausen, Christian M., Krysiak, Olga A., Xiao, Bin, Batchelor, Thomas A. A., Löffler, Tobias, Mints, Vladislav A., Banko, Lars, Arenz, Matthias, Savan, Alan, Schuhmann, Wolfgang, Ludwig, Alfred, Rossmeisl, Jan
Publicado 2021