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Mechanistic Insights into Zn-Promoted CO₂ Electroreduction on α-CuZn Alloys in Aprotic Media

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DataCite Commons2026-02-02 更新2026-05-04 收录
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https://radar.kit.edu/radar/de/dataset/55853f8gc1b5xbu8
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资源简介:
CO and CO₂ adsorption dataset containing optimized geometries, adsorption energies, and grand-canonical chemical potentials for CO and CO₂ on Cu and Cu₃Zn surfaces. All calculations were performed using VASPsol under applied surface charges to simulate electrochemical conditions.
提供机构:
Karlsruhe Institute of Technology
创建时间:
2026-01-23
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