fig4

Computational advances in electrochemical CO<sub>2</sub> reduction: design of copper-based and atomically dispersed catalysts, interfacial dynamics, and machine learning

Figure 4. Size effect exhibited by small Cu nanoclusters. (A) Ball models of spherical Cu NPs with 2.2 and 6.9 nm diameters. Surface atoms are colour-coded according to their first-neighbour CN: CN < 8 (grey), CN = 8 (blue), CN = 9 (red), CN > 9 (green); (B) Population (relative ratio) of surface atoms with a specific CN as a function of particle diameter. (A and B) Reproduced with permission from Ref.[84], Copyright © 2014 American Chemical Society; (C) Size-dependent selectivity for main products. Reproduced with permission from Ref.[85], Copyright © 2016 American Chemical Society. NPs: Nanoparticles: CN: coordination number.

Chemical Synthesis
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