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Discovering high-entropy electrocatalysts through a batch-alloy targeting approach
Hui-Feng Zhao1, Li Li1,2, Tao Zhang3
1Wuhan National High Magnetic Field Center & School of Physic, Huazhong University of Science and Technology, Wuhan 430074, China.
Science Advances
|July 11, 2025
Summary
Discovering high-entropy materials for catalysis is challenging due to vast composition options. A new "batch-alloy targeting" method efficiently identifies active and stable electrocatalysts for oxygen evolution reactions (OERs).
Area of Science:
- Materials Science
- Catalysis
- Electrochemistry
Background:
- High-entropy materials offer vast compositional possibilities but designing functional ones is complex.
- Electrocatalytic oxygen evolution reactions (OERs) are critical for energy applications but require efficient and stable catalysts.
Purpose of the Study:
- To introduce an efficient method for exploring the compositional space of high-entropy materials.
- To identify high-performance electrocatalysts for OERs using a novel approach.
Main Methods:
- Developed a "batch-alloy targeting" strategy to create a library of stable alloy phases.
- Used surface restructuring as an indicator to assess OER activity and identify optimal compositions.
- Fused potentially active elements into a rough-guess alloy for rapid screening.
Main Results:
- Successfully identified and developed a nanoscale phase-separated alloy with high OER activity and stability.
- Demonstrated the effectiveness of the batch-alloy targeting approach in accelerating materials discovery.
- Achieved a balance between experimental efficiency and thermodynamic equilibrium in high-entropy material exploration.
Conclusions:
- The batch-alloy targeting method provides an efficient and rapid route for designing high-entropy functional materials.
- This approach significantly simplifies the exploration of complex compositional landscapes for catalysis.
- The developed methodology can be broadly applied to discover novel high-entropy materials for various applications.

