Jin-Cheng Liu

Coverage-Dependent Lateral Interactions Shape the Electrocatalytic Activity of High-Entropy Alloys.

While the rich diversity of surface sites on high-entropy alloys (HEAs) is essential for tuning electrocatalytic activity, the coverage-dependent lateral interactions that shape reactive interfaces are often neglected in theoretical studies. Here, we develop a machine learning interatomic potential (MLIP)-enabled frame...