CO2 reduction by a Mn electrocatalyst in the presence of a Lewis acid: a DFT study on the reaction mechanism

2019 ◽  
Vol 3 (7) ◽  
pp. 1730-1738
Author(s):  
Miho Isegawa ◽  
Akhilesh K. Sharma
Keyword(s):  
Reaction Mechanism ◽  
Lewis Acid ◽  
Co2 Reduction ◽  
Dft Study

The addition of a Lewis acid (Mg2+) has been shown to improve the efficiency of CO2 reduction by homogeneous electrocatalysts.

Electrochemical CO2 reduction on graphdiyne: a DFT Study

2021 ◽  
Author(s):  
Tianfu Liu ◽  
Qi Wang ◽  
Guoxiong Wang ◽  
Xinhe Bao
Keyword(s):  
Co2 Reduction ◽  
Dft Study ◽  
Physiochemical Properties ◽  
Electrochemical Co2 Reduction

Graphdiyne, a new member of the 2D carbon family, has exhibited interesting physiochemical properties for academic attention. Its π-conjugated structure with unique sp-sp2 bonding shows great potential for electrocatalysis. As...

Ni pincer complex catalytic hydroboration of CO2: a DFT study on the influence of borane reductants on the selective reduction

2021 ◽  
Author(s):  
Nana Ma ◽  
Qingli Xu ◽  
Chenhao Tu ◽  
Wenyue Guo ◽  
Guisheng Zhang
Keyword(s):  
Co2 Reduction ◽  
Selective Reduction ◽  
Dft Study ◽  
Pincer Complex

It has been reported that either the boryl formate (HCOOBR2), bis(boryl)acetal (R2BOCH2OBR2), or methoxy borane (R2BOCH3) product of CO2 reduction is selectively afforded adopting the Nickel (Ni) pincer catalyst by...

Relativistic DFT Study on the Reaction Mechanism of Second-Row Transition Metal Ru with CO2

2006 ◽  
Vol 110 (10) ◽  
pp. 3552-3558 ◽  
Author(s):  
Xian-Yang Chen ◽  
Yi-Xin Zhao ◽  
Shu-Guang Wang
Keyword(s):  
Reaction Mechanism ◽  
Transition Metal ◽  
Dft Study ◽  
Relativistic Dft

Carbonylative Cycloaddition of Allyl Halides and Acetylenes Promoted by Ni(CO)4. A DFT Study on the Reaction Mechanism

2000 ◽  
Vol 19 (18) ◽  
pp. 3516-3526 ◽  
Author(s):  
Jorge J. Carbó ◽  
Carles Bo ◽  
Josep M. Poblet ◽  
Josep M. Moretó
Keyword(s):  
Reaction Mechanism ◽  
Dft Study ◽  
Allyl Halides

New challenges of electrokinetic studies in investigating the reaction mechanism of electrochemical CO2 reduction

2018 ◽  
Vol 6 (29) ◽  
pp. 14043-14057 ◽  
Author(s):  
Chan Woo Lee ◽  
Nam Heon Cho ◽  
Sang Won Im ◽  
Michael Shincheon Jee ◽  
Yun Jeong Hwang ◽  
...  
Keyword(s):  
Reaction Mechanism ◽  
Reaction Mechanisms ◽  
Co2 Reduction ◽  
Electrochemical Co2 Reduction ◽  
New Challenges

New challenges for electrokinetic studies of CO2 reduction are addressed with the suggested reaction mechanisms of CO and HCOO− production.

Lewis acid activated CO2 reduction over a Ni modified Ni–Ge hydroxide driven by visible-infrared light

2019 ◽  
Vol 48 (5) ◽  
pp. 1672-1679 ◽  
Author(s):  
Zhenyu Xin ◽  
Lei Lu ◽  
Bing Wang ◽  
Xiaohui Wang ◽  
Kai Zhu ◽  
...  
Keyword(s):  
Reaction Kinetics ◽  
Lewis Acid ◽  
Light Harvesting ◽  
Co2 Reduction ◽  
Infrared Light

Improvement of light harvesting and reaction kinetics is of great importance for achieving efficient solar-driven CO2 reduction.

Sign in / Sign up

Export Citation Format

Share Document