Carbon nitride derivatives as photocatalysts for the CO2 reduction reaction: computational study

2021 ◽  
Vol 23 (5) ◽  
pp. 3401-3406
Author(s):  
Siru Li ◽  
Yu Tian ◽  
Likai Yan ◽  
Zhongmin Su
Keyword(s):  
Carbon Nitride ◽  
Computational Study ◽  
Co2 Reduction ◽  
Environmental Problems ◽  
Reduction Reaction ◽  
Photocatalytic Reduction ◽  
Energy Crisis ◽  
Promising Strategy ◽  
Co2 Reduction Reaction

Photocatalytic reduction of CO2 to hydrocarbons is considered to be a promising strategy to solve the energy crisis and environmental problems.

Theoretical Insights into CO2 Reduction Reaction on CuPc/Graphene Single-Atomic Catalyst

2022 ◽  
Author(s):  
Zhiguo Yan ◽  
Pin Xia ◽  
Ling Huang ◽  
Haiquan Xu ◽  
Heqing Fu ◽  
...  
Keyword(s):  
Co2 Emission ◽  
Co2 Reduction ◽  
Reduction Reaction ◽  
Promising Strategy ◽  
Co2 Reduction Reaction

Excessive CO2 emission has caused severe greenhouse problems. CO2 reduction reaction (CO2RR) is considered to be a promising strategy to effectively reduce CO2 emission, which not only captures CO2 in...

A highly efficient Z-scheme B-doped g-C3N4/SnS2 photocatalyst for CO2 reduction reaction: a computational study

2018 ◽  
Vol 6 (42) ◽  
pp. 21056-21063 ◽  
Author(s):  
Yue-Lin Wang ◽  
Yu Tian ◽  
Zhong-Ling Lang ◽  
Wei Guan ◽  
Li-Kai Yan
Keyword(s):  
Photocatalytic Activity ◽  
Computational Study ◽  
Co2 Reduction ◽  
Reduction Reaction ◽  
Highly Efficient ◽  
Co2 Reduction Reaction

The CO2 reduction reaction on Z-scheme B-doped g-C3N4/SnS2 was investigated by DFT, exhibiting a highly efficient photocatalytic activity.

Copper Dimer Supported on a C2N Layer as an Efficient Electrocatalyst for CO2 Reduction Reaction: A Computational Study

2018 ◽  
Vol 122 (34) ◽  
pp. 19712-19721 ◽  
Author(s):  
Jia Zhao ◽  
Jingxiang Zhao ◽  
Fengyu Li ◽  
Zhongfang Chen
Keyword(s):  
Computational Study ◽  
Co2 Reduction ◽  
Reduction Reaction ◽  
Co2 Reduction Reaction

Graphene Supported Tungsten Carbide as Catalyst for Electrochemical Reduction of CO2

2019 ◽  
Author(s):  
Sahithi Ananthaneni ◽  
Rees Rankin
Keyword(s):  
Tungsten Carbide ◽  
Electrochemical Reduction ◽  
Low Cost ◽  
Co2 Reduction ◽  
Platinum Group Metal ◽  
Reduction Reaction ◽  
Metal Carbides ◽  
Depth Study ◽  
Reduction Of Co2 ◽  
Co2 Reduction Reaction

<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>

An Insight into Anchoring of Cobalt Phthalocyanines onto Carbon: Efficiency of the CO2 Reduction Reaction

2021 ◽  
Vol 4 (2) ◽  
pp. 1442-1448
Author(s):  
Jing-Jing Ma ◽  
Hong-Lin Zhu ◽  
Yue-Qing Zheng ◽  
Miao Shui
Keyword(s):  
Co2 Reduction ◽  
Reduction Reaction ◽  
Carbon Efficiency ◽  
Cobalt Phthalocyanines ◽  
Co2 Reduction Reaction ◽  
Insight Into

Three-dimensional porous copper-decorated bismuth-based nanofoam for boosting electrochemical reduction of CO2 to formate

2021 ◽  
Author(s):  
Yingchun Zhang ◽  
Changsheng Cao ◽  
Xintao Wu ◽  
Qi-Long Zhu
Keyword(s):  
Current Density ◽  
High Current Density ◽  
Three Dimensional ◽  
Co2 Reduction ◽  
Reduction Reaction ◽  
High Current ◽  
Porous Copper ◽  
Reduction Of Co2 ◽  
Co2 Reduction Reaction ◽  
Wide Potential

Bismuth (Bi)-based nanomaterials are considered as the promising electrocatalysts for electrocatalytic CO2 reduction reaction (CO2RR), but it is challenging to achieve high current density and selectivity in a wide potential...

Tandem catalysis in electrochemical CO2 reduction reaction

Nano Research ◽  
2021 ◽  
Author(s):  
Yating Zhu ◽  
Xiaoya Cui ◽  
Huiling Liu ◽  
Zhenguo Guo ◽  
Yanfeng Dang ◽  
...  
Keyword(s):  
Co2 Reduction ◽  
Reduction Reaction ◽  
Tandem Catalysis ◽  
Electrochemical Co2 Reduction ◽  
Co2 Reduction Reaction
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