Rational design of non-noble-metal-based alloy catalysts for hydrogen activation: a density functional theory study

Danyang Li, Zhili Chen, Kui Ren, Shuang Zhao, Haoxiang Xu & Dapeng Cao
The alloying of precious metals with non-noble metals in the active components for hydrogen activation during regeneration of the solid acid catalyst in hydrogenation conditions, can reduce the cost of the catalyst and improve the catalytic efficiency of precious metals. However, it lacks a theoretical method to guide the development of non-noble-metal-based alloy catalysts. In this work, the dependence of hydrogen adsorption and dissociation of alloy models on various non-noble-metal bases has been investigated by...
1 citation reported since publication in 2022.
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