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Electrocatalytic CO₂ Reduction Reaction: Formulas for Calculating Key Activity Rating Indices

Products of Electrochemical CO₂ Reduction

Through electrocatalysis, CO₂ can be converted into high-value chemicals such as CO, CH₄, HCOOH, C₂H₄, C₂H₅OH, etc[1].

The variety of products in the CO₂ reduction reaction results from the different numbers of electrons required during the reaction. Therefore, the calculation methods for different product yields in the CO₂ reduction reaction are closely related to the transferred number of electrons during the reaction process.

A table has been compiled to clarify the specific products in the CO₂ reduction reaction and their corresponding transferred electron numbers, as shown in Table 1.

Table 1. CO₂ reduction to various products and corresponding electrode reactions[2]

CO2 reduction to various products and corresponding electrode reactions

PLS-MECF series double-chamber alkaline electrolysis cell

Key Activity Rating Indices for Electrochemical CO₂ Reduction

1. Faradaic Efficiency

Faradaic efficiency refers to the percentage of the charge consumed for the target product compared to the total charge consumed in the reaction, describing the selectivity of products in the electrocatalytic reaction[3].

For the Faradaic efficiency of gaseous products, the calculation method is as follows[4]:

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For the Faradaic efficiency of liquid products, the calculation method is as follows[5]:

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Electrode

 

2. Local Current Density

Local current density (jproduct) refers to the current density required for the target product. The formula is as follows[6]:

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3. Cathodic Energy Efficiency

Cathodic Energy Efficiency (CEE) refers to the percentage of chemical energy contained in the reduced product compared to the total input electrical energy. The formula is as follows[7]:

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4. Turnover Frequency

Turnover Frequency (TOF), i.e., the number of conversions per active site per unit time, is calculated as follows[8]:

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The information above is sourced from literature, and the editor has compiled it. Corrections are welcome if there are any errors!

References

[1]    She Xiaojie, Shik Chi Edman Tsang*, Shu Ping Lauet.al., Challenges and opportunities of electrocatalytic CO2 reduction to chemicals and fuels[J]. Angewandte Chemie International Edition 2022, 22: 49.

[2]    Liu Lizhen, Huang Hongwei*, Ma Tianyi*, et. al., Surface sites engineering on semiconductors to boost photocatalytic CO2 reduction[J]. Nano Energy2020, 75, 104959.

[3]    Kempler, P.A.*, Nielander, A.C. Reliable reporting of Faradaic efficiencies for electrocatalysis research[J]. Nature Communications2023, 14: 1158.

[4]    Li Shoujie, Chen Wei*, Sun Yuhan*, et. al., Hierarchical micro/nanostructured silver hollow fiber boosts electroreduction of carbon dioxide[J]. Nature Communications2022, 3038, 13.

[5]    Peng Chen, Yang Songtao, Zheng Gengfenget.al., Surface Co-modification of halide anions and potassium cations promotes high-rate CO2-to-Ethanol electrosynthesis[J]. Advanced Materials, 2022, 34, 2204476.

[6]    Wang Genxiang, Chen Junxiang, Dai Liminget.al., Electrocatalysis for CO2 conversion: from fundamentals to value-added products[J]. Chemical Society Reviews, 2021,50, 4993.

[7]    Lai Wenchuan, Lin Zhiqun*, Huang Hongwenet.al., Design strategies for markedly enhancing energy efficiency in the electrocatalytic CO2 reduction reaction[J]. Energy Environ. Sci., 2022, 15: 3603.

[8]    Fan Zhaozhong, Luo Ruichong, Hou Junganget.al., Oxygen-bridged Indium-Nickel atomic pair as dual-metal active sites enabling synergistic electrocatalytic CO2 reduction[J]. Angewandte Chemie International Edition 2023, 135, e202216326.

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