2 papers
cond-mat.mtrl-sci2025
Fine-Tuning Bulk-oriented Universal Interatomic Potentials for Surfaces: Accuracy, Efficiency, and Forgetting Control
Jaekyun Hwang, Taehun Lee, Yonghyuk Lee +1
Accurate prediction of surface energies and stabilities is essential for materials design, yet first-principles calculations remain computationally expensive and most existing inte…
cond-mat.mtrl-sci2024
Machine-Learning-Accelerated Surface Exploration of Reconstructed BiVO(010) and Characterization of Their Aqueous Interfaces
Yonghyuk Lee, Taehun Lee
Understanding the semiconductor-electrolyte interface in photoelectrochemical (PEC) systems is crucial for optimizing stability and reactivity. Despite the challenges in establishi…