Research Article
Study on the Adsorption and Activation Behaviours of Carbon Dioxide over Copper Cluster (Cu4) and Alumina-Supported Copper Catalyst (Cu4/Al2O3) by means of Density Functional Theory
Table 5
The bond orders (B.O) and the binding energy of C–O (Ebind, kJ·mol−1).
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Note: the total bond order between atoms of CO2 and copper atoms. |