https://www.selleckchem.com/pr....oducts/ecc5004-azd50
For the electrochemical reduction of CO2, CO is a crucial single-carbon product and a major intermediate to multicarbon products. Direct dimerization of CO is the most charming channel to C2 products, although the corresponding kinetic energy barrier causes a huge gap compared with other alternative pathways. The effective CO migration among multiple catalytic sites is predominant but has not been fully explored during the C-C bond formation and further protonation processes. Herein, the entirely planar global-minimum Ni2B5 mono
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