DOE OSTI · 2582008
Charting the electronic structure for discovering low-cost intermetallic catalysts
Abstract
We utilize electronic-structure-based descriptors to screen stable and active intermetallic catalysts. Several novel catalysts are proposed for HER and ORR reactions and the effectiveness of descriptors has been thoroughly investigated.
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He, Zhengda, Ouyang, Bin (ORCID:0000000281816815). 2024-01-01. Charting the electronic structure for discovering low-cost intermetallic catalysts. https://doi.org/10.1039/d4ta03880k
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