The role of oxygen and water on molybdenum nanoclusters for electro catalytic ammonia production

por Howalt, Jakob G, Vegge, Tejs
Publicado 2014

MultiXC-QM9: Large dataset of molecular and reaction energies from multi-level quantum chemical methods

por Nandi, Surajit, Vegge, Tejs, Bhowmik, Arghya
Publicado 2023

Metal‐Doped PdH(111) Catalysts for CO(2) Reduction

por Ai, Changzhi, Vegge, Tejs, Hansen, Heine Anton
Publicado 2022

OH formation and H(2) adsorption at the liquid water–Pt(111) interface

por Kristoffersen, Henrik H., Vegge, Tejs, Hansen, Heine Anton
Publicado 2018

Neural network potentials for accelerated metadynamics of oxygen reduction kinetics at Au–water interfaces

por Yang, Xin, Bhowmik, Arghya, Vegge, Tejs, Hansen, Heine Anton
Publicado 2023

Phase-Field Investigation of Lithium Electrodeposition at Different Applied Overpotentials and Operating Temperatures

por Jeon, Joonyeob, Yoon, Gil Ho, Vegge, Tejs, Chang, Jin Hyun
Publicado 2022

Transition1x - a dataset for building generalizable reactive machine learning potentials

por Schreiner, Mathias, Bhowmik, Arghya, Vegge, Tejs, Busk, Jonas, Winther, Ole
Publicado 2022

Modeling of Ion Agglomeration in Magnesium Electrolytes and its Impacts on Battery Performance

por Drews, Janina, Danner, Timo, Jankowski, Piotr, Vegge, Tejs, García Lastra, Juan Maria, Liu, Runyu, Zhao‐Karger, Zhirong, Fichtner, Maximilian, Latz, Arnulf
Publicado 2020

Multi‐Electron Reactions Enabled by Anion‐Based Redox Chemistry for High‐Energy Multivalent Rechargeable Batteries

por Li, Zhenyou, Vinayan, Bhaghavathi P., Jankowski, Piotr, Njel, Christian, Roy, Ananyo, Vegge, Tejs, Maibach, Julia, Lastra, Juan Maria García, Fichtner, Maximilian, Zhao‐Karger, Zhirong
Publicado 2020

Dual Role of Mo(6)S(8) in Polysulfide Conversion and Shuttle for Mg–S Batteries

por Wang, Liping, Jankowski, Piotr, Njel, Christian, Bauer, Werner, Li, Zhenyou, Meng, Zhen, Dasari, Bosubabu, Vegge, Tejs, Lastra, Juan Maria García, Zhao‐Karger, Zhirong, Fichtner, Maximilian
Publicado 2022

Modeling of Electron‐Transfer Kinetics in Magnesium Electrolytes: Influence of the Solvent on the Battery Performance

por Drews, Janina, Jankowski, Piotr, Häcker, Joachim, Li, Zhenyou, Danner, Timo, García Lastra, Juan Maria, Vegge, Tejs, Wagner, Norbert, Friedrich, K. Andreas, Zhao‐Karger, Zhirong, Fichtner, Maximilian, Latz, Arnulf
Publicado 2021

Cation insertion to break the activity/stability relationship for highly active oxygen evolution reaction catalyst

por Yang, Chunzhen, Rousse, Gwenaëlle, Louise Svane, Katrine, Pearce, Paul E., Abakumov, Artem M., Deschamps, Michael, Cibin, Giannantonio, Chadwick, Alan V., Dalla Corte, Daniel Alves, Anton Hansen, Heine, Vegge, Tejs, Tarascon, Jean-Marie, Grimaud, Alexis
Publicado 2020

Artificial Intelligence Applied to Battery Research: Hype or Reality?

por Lombardo, Teo, Duquesnoy, Marc, El-Bouysidy, Hassna, Årén, Fabian, Gallo-Bueno, Alfonso, Jørgensen, Peter Bjørn, Bhowmik, Arghya, Demortière, Arnaud, Ayerbe, Elixabete, Alcaide, Francisco, Reynaud, Marine, Carrasco, Javier, Grimaud, Alexis, Zhang, Chao, Vegge, Tejs, Johansson, Patrik, Franco, Alejandro A.
Publicado 2021