news

Jul 08, 2026 Our paper using machine learning interatomic potentials to reveal how Ru cluster size reshapes the interfacial water structure governing alkaline hydrogen evolution has been published in Energy & Environmental Science, where I contributed as co-first author.
May 04, 2026 Our paper on oxygen electrode reaction kinetics for reversible solid oxide cells has been published in Nature Energy, featuring large-scale simulations powered by CatBench-selected MLIPs.
Apr 03, 2026 Our paper on angular relational knowledge distillation for accelerating machine learning interatomic potentials has been published in npj Computational Materials.
Nov 18, 2025 Our paper on designing realistic single atom catalysts through machine learning interatomic potentials has been published in ACS Energy Letters.
Nov 17, 2025 I am thrilled to announce that our first-author paper “CatBench framework for benchmarking machine learning interatomic potentials in adsorption energy predictions for heterogeneous catalysis” has been published in Cell Reports Physical Science!
Jun 05, 2025 I have been selected as a recipient of the Presidential Science Scholarship of South Korea for PhD students. I will continue to work hard on my research with this great honor.
May 08, 2025 Our research on understanding the oxygen evolution reaction mechanism in Ruthenium Oxide has been published in Chem as a first-author paper!
Jun 02, 2024 Our review paper titled “Rise of machine learning potentials in heterogeneous catalysis: Developments, applications, and prospects” has been published in Chemical Engineering Journal.
Jan 01, 2024 Our paper on theoretical tuning of metal-nitrogen doped carbon catalysts for selective chlorine-evolution reaction has been published in Catalysis Today.
Mar 01, 2023 Our research on catalyst deactivation mechanism in non-oxidative dehydrogenation using DFT and kinetic Monte Carlo has been published in Catalysis Today.