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Machine-learning-accelerated Density Functional Theory Screening of Cu-based High-Entropy Alloys for Carbon Dioxide Reduction to Ethylene

Meena Rittiruam,Pisit Khamloet, Sirapat Tiwtusthada,Annop Ektarawong,Tinnakorn Saelee,Chayanon Atthapak,Patcharaporn Khajondetchairit,Bjorn Alling,Piyasan Praserthdam,Supareak Praserthdam

APPLIED SURFACE SCIENCE（2025）

Cited 0|Views6
Key words
Alloys,Density functional theory calculations,Machine learning, C2+product,Electrocatalysis CO2 reduction reaction
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