Theoretical understanding of the electrochemical reaction barrier: a kinetic study of CO2 reduction reaction on copper electrodes

2020 ◽  
Vol 22 (17) ◽  
pp. 9607-9615 ◽  
Author(s):  
Shu-Ting Gao ◽  
Shi-Qin Xiang ◽  
Jun-Lin Shi ◽  
Wei Zhang ◽  
Liu-Bin Zhao

The electrochemical reduction of CO2 is a promising route for converting intermittent renewable energy into storable fuels and useful chemical products.

2019 ◽  
Author(s):  
Sahithi Ananthaneni ◽  
Rees Rankin

<div>Electrochemical reduction of CO2 to useful chemical and fuels in an energy efficient way is currently an expensive and inefficient process. Recently, low-cost transition metal-carbides (TMCs) are proven to exhibit similar electronic structure similarities to Platinum-Group-Metal (PGM) catalysts and hence can be good substitutes for some important reduction reactions. In this work, we test graphenesupported WC (Tungsten Carbide) nanocluster as an electrocatalyst for the CO2 reduction reaction. Specifically, we perform DFT studies to understand various possible reaction mechanisms and determine the lowest thermodynamic energy landscape of CO2 reduction to various products such as CO, HCOOH, CH3OH, and CH4. This in-depth study of reaction energetics could lead to improvements and develop more efficient electrocatalysts for CO2 reduction.<br></div>


Catalysts ◽  
2019 ◽  
Vol 9 (7) ◽  
pp. 604
Author(s):  
Sahithi Ananthaneni ◽  
Zachery Smith ◽  
Rees B. Rankin

Electrochemical reduction of CO2 to useful chemical and fuels in an energy efficient way is currently an expensive and inefficient process. Recently, low-cost transition metal-carbides (TMCs) have been proven to exhibit similar electronic structure similarities to Platinum-Group-Metal (PGM) catalysts and hence, can be good substitutes for some important reduction reactions. In this work, we test graphene-supported WC (Tungsten Carbide) nanoclusters as an electrocatalyst for the CO2 reduction reaction. Specifically, we perform density functional theory (DFT) studies to understand various possible reaction mechanisms and determine the lowest thermodynamic energy landscape of CO2 reduction to various products, such as CO, HCOOH, CH3OH, and CH4. This in-depth study of reaction energetics could lead to improvements and development of more efficient electrocatalysts for CO2 reduction.


Author(s):  
Lara G. Puppin ◽  
Luís F. da Silva ◽  
Marcelo Carmo ◽  
Hamilton Varela ◽  
Osmando F. Lopes

AbstractCO2 electrochemical reduction reaction (CO2RR) is an attractive strategy for closing the anthropogenic carbon cycle and storing intermittent renewable energy. Tin-based electrocatalysts exhibit remarkable properties for reducing CO2 into HCOOH. However, the effects of morphology and oxidation state of tin-based electrocatalysts on the performance of CO2 reduction have not been well-described. We evaluate the oxidation state and particle size of SnOx for CO2 reduction. SnOx was effective for converting CO2 into formic acid, reaching a maximum selectivity of 69%. The SnO exhibited high activity for CO2RR compared to SnO2 electrocatalysts. A pre-reduction step of a SnO2 electrocatalyst increased its CO2 reduction performance, confirming that Sn2+ is more active than Sn4+ sites. The microsized SnO2 is more effective for converting CO2 into formic acid than nanosized SnO2, likely due to the impurities of nanosized SnO2. We illuminated the role played by both SnOx particle size and oxidation state on CO2RR performance. Graphic abstract


Author(s):  
Nael Yasri ◽  
Tareq Al-Attas ◽  
Jinguang Hu ◽  
Md Golam Kibria

Developing catalysts that exhibit high efficiencies for the electrochemical CO2 reduction reaction (CO2RR) in aqueous media is vital in both aspects of the healthier environment and for the practical implementation...


Author(s):  
Sreekanth Narayanaru ◽  
Gopinathan M. Anilkumar ◽  
Masaki Ito ◽  
Takanori Tamaki ◽  
Takeo Yamaguchi

Electrochemical reduction of CO2 to formate on SnPd–NCF. The adsorbed bicarbonate ion promotes the protonation of CO2˙− to HCO2−.


Author(s):  
Jingfu He ◽  
Chenghui Wu ◽  
Yanming Li ◽  
Changli Li

CO2 reduction reaction (CO2RR) is one of the most promising methods to alleviate the global challenge of climate change and energy supply. Metal catalysts such as copper, gold, silver, tin,...


Author(s):  
Chenbao Lu ◽  
Kaiyue Jiang ◽  
Diana Tranca ◽  
Ning Wang ◽  
Hui Zhu ◽  
...  

Single-atom catalysts (SACs) have been rapidly rising as emerging materials in the field of energy conversion, especially for CO2 reduction reaction. However, the selectivity and running current are still beyond...


2019 ◽  
Author(s):  
Sahithi Ananthaneni ◽  
Rees Rankin

<div>Electrochemical reduction of CO2 to useful chemical and fuels in an energy efficient way is currently an expensive and inefficient process. Recently, low-cost transition metal-carbides (TMCs) are proven to exhibit similar electronic structure similarities to Platinum-Group-Metal (PGM) catalysts and hence can be good substitutes for some important reduction reactions. In this work, we test graphenesupported WC (Tungsten Carbide) nanocluster as an electrocatalyst for the CO2 reduction reaction. Specifically, we perform DFT studies to understand various possible reaction mechanisms and determine the lowest thermodynamic energy landscape of CO2 reduction to various products such as CO, HCOOH, CH3OH, and CH4. This in-depth study of reaction energetics could lead to improvements and develop more efficient electrocatalysts for CO2 reduction.<br></div>


Author(s):  
Wei-Jia Wang ◽  
Kai-Hong Chen ◽  
Zhi-Wen Yang ◽  
Bo-Wen Peng ◽  
Liang-Nian He

Significant efforts have been devoted to photochemical CO2 reduction reaction (CO2RR) as a significant pathway for the development of renewable energy systems. However, competitive hydrogen evolution reaction (HER) greatly impedes...


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