Electrochemical reduction of CO2 by single atom catalyst TM–TCNQ monolayers

Eight novel two-dimensional TM–TCNQ (TM = V–Zn) monolayers as highly efficient and selective electrocatalysts for CO2 reduction have been systematically studied and the underlying detailed reaction mechanisms have been revealed.

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Reaction Mechanisms for the Electrochemical Reduction of CO2 to CO and Formate on the Cu(100) Surface at 298 K from Quantum Mechanics Free Energy Calculations with Explicit Water

Journal of the American Chemical Society ◽

10.1021/jacs.6b08534 ◽

2016 ◽

Vol 138 (42) ◽

pp. 13802-13805 ◽

Cited By ~ 144

Author(s):

Tao Cheng ◽

Hai Xiao ◽

William A. Goddard

Keyword(s):

Free Energy ◽

Quantum Mechanics ◽

Electrochemical Reduction ◽

Reaction Mechanisms ◽

Free Energy Calculations ◽

Energy Calculations ◽

Reduction Of Co2 ◽

Explicit Water

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SnO2-Modified Two-Dimensional CuO for Enhanced Electrochemical Reduction of CO2 to C2H4

ACS Applied Materials & Interfaces ◽

10.1021/acsami.0c09240 ◽

2020 ◽

Vol 12 (32) ◽

pp. 36128-36136 ◽

Cited By ~ 1

Author(s):

Yangchun Lan ◽

Gaoqiang Niu ◽

Fei Wang ◽

Dehu Cui ◽

Zhuofeng Hu

Keyword(s):

Electrochemical Reduction ◽

Two Dimensional ◽

Reduction Of Co2

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Highly stable two-dimensional bismuth metal-organic frameworks for efficient electrochemical reduction of CO2

Applied Catalysis B Environmental ◽

10.1016/j.apcatb.2020.119241 ◽

2020 ◽

Vol 277 ◽

pp. 119241 ◽

Cited By ~ 5

Author(s):

Fang Li ◽

Geun Ho Gu ◽

Changhyeok Choi ◽

Praveen Kolla ◽

Song Hong ◽

...

Keyword(s):

Electrochemical Reduction ◽

Metal Organic Frameworks ◽

Two Dimensional ◽

Metal Organic ◽

Reduction Of Co2

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Highly efficient electrochemical reduction of CO2 into formic acid over lead dioxide in an ionic liquid–catholyte mixture

Green Chemistry ◽

10.1039/c8gc00471d ◽

2018 ◽

Vol 20 (8) ◽

pp. 1765-1769 ◽

Cited By ~ 18

Author(s):

Haoran Wu ◽

Jinliang Song ◽

Chao Xie ◽

Yue Hu ◽

Buxing Han

Keyword(s):

Ionic Liquid ◽

Formic Acid ◽

Electrochemical Reduction ◽

Lead Dioxide ◽

Highly Efficient ◽

Reduction Of Co2

The combination of commercial lead dioxide and ionic liquid based catholytes showed highly efficient electrochemical reduction of CO2 into formic acid.

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Mechanistic Insights into the Electrochemical Reduction of CO2 and N2 on the Regulation of a Boron Nitride Defect-Derived Two-Dimensional Catalyst using Density Functional Theory Calculations

The Journal of Physical Chemistry Letters ◽

10.1021/acs.jpclett.1c01920 ◽

2021 ◽

pp. 7151-7158

Author(s):

Binhao Qin ◽

Yu-Hang Li ◽

Qiao Zhang ◽

Guangxing Yang ◽

Haiyan Wang ◽

...

Keyword(s):

Density Functional Theory ◽

Boron Nitride ◽

Electrochemical Reduction ◽

Density Functional ◽

Density Functional Theory Calculations ◽

Two Dimensional ◽

Functional Theory ◽

Reduction Of Co2

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Energy efficient electrochemical reduction of CO2 to CO using a three-dimensional porphyrin/graphene hydrogel

Energy & Environmental Science ◽

10.1039/c8ee03403f ◽

2019 ◽

Vol 12 (2) ◽

pp. 747-755 ◽

Cited By ~ 39

Author(s):

Jaecheol Choi ◽

Jeonghun Kim ◽

Pawel Wagner ◽

Sanjeev Gambhir ◽

Rouhollah Jalili ◽

...

Keyword(s):

Electrochemical Reduction ◽

Energy Efficient ◽

Three Dimensional ◽

Iron Porphyrin ◽

Highly Efficient ◽

Low Overpotential ◽

Reduction Of Co2

A 3D iron porphyrin/graphene hydrogel electrocatalyst affords highly efficient, durable and selective CO2 reduction to CO at a low overpotential.

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Highly efficient electrochemical reduction of CO2 to CH4 in an ionic liquid using a metal–organic framework cathode

Chemical Science ◽

10.1039/c5sc03291a ◽

2016 ◽

Vol 7 (1) ◽

pp. 266-273 ◽

Cited By ~ 121

Author(s):

Xinchen Kang ◽

Qinggong Zhu ◽

Xiaofu Sun ◽

Jiayin Hu ◽

Jianling Zhang ◽

...

Keyword(s):

Ionic Liquid ◽

Ionic Liquids ◽

Electrochemical Reduction ◽

Metal Organic Framework ◽

Selective Reduction ◽

Highly Efficient ◽

Metal Organic ◽

Reduction Of Co2 ◽

Organic Framework

It has been discovered that Zn metal-organic framework (Zn-MOF) electrodes and ionic liquids are an excellent combination for the efficient and selective reduction of CO2 to CH4.

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Electrochemical reduction of CO2 on graphene supported transition metals – towards single atom catalysts

Physical Chemistry Chemical Physics ◽

10.1039/c7cp00915a ◽

2017 ◽

Vol 19 (18) ◽

pp. 11436-11446 ◽

Cited By ~ 51

Author(s):

Haiying He ◽

Yesukhei Jagvaral

Keyword(s):

Transition Metals ◽

Electrochemical Reduction ◽

Single Atom ◽

Single Atoms ◽

Computational Screening ◽

Reduction Of Co2

Graphene supported single atoms show improved reactivity towards electrochemical CO2 reduction with the best candidates identified for producing CH4 by computational screening.

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Two-Dimensional Transition Metal Porphyrin Sheets as a Promising Single-Atom-Catalyst for Dinitrogen Electrochemical Reduction to Ammonia: A Theoretical Study

The Journal of Physical Chemistry C ◽

10.1021/acs.jpcc.9b10294 ◽

2019 ◽

Vol 124 (2) ◽

pp. 1492-1499 ◽

Cited By ~ 6

Author(s):

Shiqiang Liu ◽

Yawei Liu ◽

Xiaoping Gao ◽

Yujia Tan ◽

Zhiwen Cheng ◽

...

Keyword(s):

Transition Metal ◽

Electrochemical Reduction ◽

Theoretical Study ◽

Single Atom ◽

Two Dimensional ◽

Metal Porphyrin

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Theoretical study of the electrochemical reduction of CO2 on cerium dioxide supported palladium single atoms and nanoparticles

Physical Chemistry Chemical Physics ◽

10.1039/d1cp03835d ◽

2021 ◽

Author(s):

Yan nv Guo ◽

haiyan zhu ◽

He Zhao ◽

Qinfu Zhao ◽

Caihua Zhou ◽

...

Keyword(s):

Electrochemical Reduction ◽

Cerium Dioxide ◽

Theoretical Study ◽

Catalytic Performance ◽

Single Atom ◽

Pd Nanoparticle ◽

Single Atoms ◽

Nanoparticle Clusters ◽

Supported Palladium ◽

Reduction Of Co2

Pd/CeO2 catalysts show superior catalytic performance owing to their optimal cycling activity and stability. In this study, single-atom Pd and eight-atoms Pd nanoparticle clusters were supported on the surface of...

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