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DOE OSTI · 3013026

Adjusting the Criteria for Hydrogen Evolution by Single-Atom Catalysts

Kim, Mansu [Northwestern Univ., Evanston, IL (United States)] (ORCID:0000000201736058)·Kim, Sohui [Sungkyunkwan Univ., Suwon (Republic of Korea)]·Wang, Xijun [Northwestern Univ., Evanston, IL (United States)]·Snurr, Randall Q. [Northwestern Univ., Evanston, IL (United States)] (ORCID:0000000329259246)·Hupp, Joseph T. [Northwestern Univ., Evanston, IL (United States)] (ORCID:0000000339829812)·Whang, Dongmok [Sungkyunkwan Univ., Suwon (Republic of Korea)] (ORCID:0000000251646624)
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Abstract

Downsizing noble metal catalysts is essential for improving atomic efficiency in sustainable energy applications. Typically, strategies focus on anchoring atomically scaled catalysts onto heteroatom-rich substrates, but these interactions can unintentionally alter the electronic structure of the catalyst, complicating the hydrogen evolution reaction (HER) mechanism. This study focuses on elucidating the interfacial mechanism of HER using structurally well-defined platinum single-atom (Pt SA) electrocatalysts. Unlike chemically reduced SAs, electrochemically deposited Pt SA catalysts do not rely on strong support interactions. As a result, these isolated Pt atoms can potentially achieve the theoretical maximum hydrogen production efficiency. This work introduces electrocatalysts composed solely of true SA sites, clarifying previous ambiguities surrounding the concept of SA electrocatalysis.

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Kim, Mansu [Northwestern Univ., Evanston, IL (United States)] (ORCID:0000000201736058), Kim, Sohui [Sungkyunkwan Univ., Suwon (Republic of Korea)], Wang, Xijun [Northwestern Univ., Evanston, IL (United States)], Snurr, Randall Q. [Northwestern Univ., Evanston, IL (United States)] (ORCID:0000000329259246), Hupp, Joseph T. [Northwestern Univ., Evanston, IL (United States)] (ORCID:0000000339829812), Whang, Dongmok [Sungkyunkwan Univ., Suwon (Republic of Korea)] (ORCID:0000000251646624). 2025-08-28. Adjusting the Criteria for Hydrogen Evolution by Single-Atom Catalysts. https://doi.org/10.1021/jacs.5c12309

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