New insights into electrocatalytic ozone generation via splitting of water over PbO2 electrode: A DFT study
Chemical Physics Letters(2016)
摘要
•Mechanisms for ozone production via splitting of water identified by DFT modelling.•H2O adsorbed onto the electrode was oxidized to form surface OH then O.•Eley–Rideal style interaction between O2 and surface O to form O3.•A different reaction pathway via an O3H intermediate was less favoured.
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关键词
Electrochemical ozone production,Density Functional Theory,Advanced oxidation technology,Lead oxide,Activation energy,Reaction pathway
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