Publications of Yonghyuk Lee

Journal Article (7)

2025
Journal Article
van der Merwe, Marianne, Yonghyuk Lee, Romualdus Enggar Wibowo, Tathiana Kokumai, Anna Efimenko, Mauricio D. Arce, Catalina E. Jimenez, Benjamin Howchen, Rosario Suarez Anzorena, Ilaria Lucentini, Carlos Escudero, Götz Schuck, Zdravko Kochovski, Marco Favaro, David E. Starr, Karsten Reuter, Christoph Scheurer, Marcus Bär and Raul Garcia-Diez: Unravelling the mechanistic complexity of the oxygen evolution reaction and Ir dissolution in highly dimensional amorphous hydrous iridium oxides.
2024
Journal Article
Masliuk, Liudmyla, Kyeonghyeon Nam, Maxwell W. Terban, Yonghyuk Lee, Pierre Kube, Daniel Delgado Muñoz, Frank Girgsdies, Karsten Reuter, Robert Schlögl, Annette Trunschke, Christoph Scheurer, Mirijam Zobel and Thomas Lunkenbein: Linking Bulk and Surface Structures in Complex Mixed Oxides.
2023
Journal Article
Lee, Yonghyuk, Jakob Timmermann, Chiara Panosetti, Christoph Scheurer and Karsten Reuter: Staged Training of Machine-Learning Potentials from Small to Large Surface Unit Cells: Efficient Global Structure Determination of the RuO2(100)-c(2 × 2) Reconstruction and (410) Vicinal.
Journal Article
Panosetti, Chiara, Yonghyuk Lee, Artem Samtsevych and Christoph Scheurer: Black box vs gray box: Comparing GAP and GPrep-DFTB for ruthenium and ruthenium oxide.
Journal Article
Yoo, Su-Hyun, Leonardo Shoji Aota, Sangyong Shin, Ayman A. El-Zoka, Phil Woong Kang, Yonghyuk Lee, Hyunjoo Lee, Se-Ho Kim and Baptiste Gault: Dopant Evolution in Electrocatalysts after Hydrogen Oxidation Reaction in an Alkaline Environment.
2022
Journal Article
Lee, Yonghyuk, Christoph Scheurer and Karsten Reuter: Epitaxial Core-Shell Oxide Nanoparticles: First-Principles Evidence for Increased Activity and Stability of Rutile Catalysts for Acidic Oxygen Evolution.
2021
Journal Article
Timmermann, Jakob, Yonghyuk Lee, Carsten Staacke, Johannes Margraf, Christoph Scheurer and Karsten Reuter: Data-Efficient Iterative Training of Gaussian Approximation Potentials: Application to Surface Structure Determination of Rutile IrO2 and RuO2.

Thesis - PhD (1)

2022
Thesis - PhD
Lee, Yonghyuk: Discoveries in Ruthenium Oxide-Based Catalysts: From Morphology Control for Water Electrolysis to Surface Structure Determination via Machine-Learning.
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