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40 积分 2025-09-18 加入
Exploring effects of reactant’s chemical environments on adsorption and reaction mechanism by global optimization and IR spectrum calculation, using NO oxidation as a case
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Unraveling the minimum pathways of NEC hydrogenation and 12H-NEC dehydrogenation on Ni-based catalysts: Insights into the design of efficient non-noble metal catalysts
32分钟前
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