Machine Learning-Assisted Development of Platinum-Free RuNiCo Nanocages for Electrocatalytic Hydrogen Oxidation Reaction in Acidic Media

Through data-driven synthesis involving 24 experiments from 16,384 possible combinations (<1%), we developed two optimal electrocatalysts for the hydrogen oxidation reaction (HOR) in acidic media: PtIrRuNiCo nanowires and Pt-free RuNiCo nanocages. The objective function obtained in the Bayesian optimization (BO) process is highly correlated with the experimental current density for the HOR. The RuNiCo nanocages exhibited higher HOR activity than Ru because of the suppression of the surface oxide formation. Our BO-assisted approach accelerates the development of highly active electrocatalysts without requiring high-throughput synthesis.

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Publication Details

Journal
ACS Applied Energy Materials
Published
2025-09-29
DOI
https://doi.org/10.1021/acsaem.5c02113
Citations
2
Primary Topic
Electrocatalysts for Energy Conversion
Type
article
Field-Weighted Citation Impact
0.73
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article

Machine Learning-Assisted Development of Platinum-Free RuNiCo Nanocages for Electrocatalytic Hydrogen Oxidation Reaction in Acidic Media

Ichizo Yagi, Masaru Kato, Takeshi Watanabe, Colin A. Tadgell et al.
2 citations
ACS Applied Energy Materials
Electrocatalysts for Energy Conversion
0.73
article

Machine Learning-Assisted Development of Platinum-Free RuNiCo Nanocages for Electrocatalytic Hydrogen Oxidation Reaction in Acidic Media

Ichizo Yagi, Masaru Kato, Takeshi Watanabe, Colin A. Tadgell, Sae Dieb, Keitaro Sodeyama, Bohao Du, Koshiro Suzuki, Toshihiko Hoshi
article en
2 citations

Abstract

Through data-driven synthesis involving 24 experiments from 16,384 possible combinations (<1%), we developed two optimal electrocatalysts for the hydrogen oxidation reaction (HOR) in acidic media: PtIrRuNiCo nanowires and Pt-free RuNiCo nanocages. The objective function obtained in the Bayesian optimization (BO) process is highly correlated with the experimental current density for the HOR. The RuNiCo nanocages exhibited higher HOR activity than Ru because of the suppression of the surface oxide formation. Our BO-assisted approach accelerates the development of highly active electrocatalysts without requiring high-throughput synthesis.

ACS Applied Energy MaterialsVol. 8(19)
Hokkaido University (JP), National Institute for Materials Science (JP), Japan Synchrotron Radiation Research Institute (JP), Shanghai Industrial Technology Institute (CN)
Openalex Percentile: Top 28%
Electrocatalysts for Energy Conversion
0.73
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Machine Learning-Assisted Development of Platinum-Free RuNiCo Nanocages for Electrocatalytic Hydrogen Oxidation Reaction in Acidic Media — Ichizo Yagi, Masaru Kato, et al. · ACS Applied Energy Materials (2025) | TGRS Research Map | TGRS