Recent advances in the theoretical studies on the electrocatalytic CO2 reduction based on single and double atoms
Y Meng, H Huang, Y Zhang, Y Cao, H Lu, X Li - Frontiers in Chemistry, 2023 - frontiersin.org
Excess of carbon dioxide (CO2) in the atmosphere poses a significant threat to the global
climate. Therefore, the electrocatalytic carbon dioxide reduction reaction (CO2RR) is …
climate. Therefore, the electrocatalytic carbon dioxide reduction reaction (CO2RR) is …
Advanced dual-atom catalysts on graphitic carbon nitride for enhanced hydrogen evolution via water splitting
X Liu, DK Hoang, QAT Nguyen, SG Kim, PC Nam… - Nanoscale, 2024 - pubs.rsc.org
In this comprehensive investigation, we explore the effectiveness of 55 dual-atom catalysts
(DACs) supported on graphitic carbon nitride (gCN) for both alkaline and acidic hydrogen …
(DACs) supported on graphitic carbon nitride (gCN) for both alkaline and acidic hydrogen …
Multi-atomic loaded C 2 N 1 catalysts for CO 2 reduction to CO or formic acid
In recent years, the development of highly active and selective electrocatalysts for the
electrochemical reduction of CO2 to produce CO and formic acid has aroused great interest …
electrochemical reduction of CO2 to produce CO and formic acid has aroused great interest …
Breaking BEP Relationship with Strong CO Binding and Low C–C Coupling Barriers for Ethanol Synthesis on Boron-Doped Graphyne: Bond Order Conservation and …
P Mano, S Namuangruk… - The Journal of Physical …, 2023 - ACS Publications
For CO2 electroreduction to produce C2+ products, many nonmetal catalyst studies have
focused on doping to sp2 and sp3 carbon materials for efficient carbon–carbon (CC) bond …
focused on doping to sp2 and sp3 carbon materials for efficient carbon–carbon (CC) bond …
Design of Bimetallic Boronene Structures Leveraging Neighboring Effects for Efficient Electrocatalytic CO2 Reduction Reaction
Abstract Electrocatalytic CO2 reduction (CO2RR) offers a promising avenue to address
rising atmospheric CO2 levels by producing high‐value chemicals. However, the …
rising atmospheric CO2 levels by producing high‐value chemicals. However, the …
p-block doped semi-metallic xenes as highly selective and efficient transition-metal free single atom catalysts for electrochemical CO reduction
The development of robust and inexpensive catalysts for the electrochemical CO reduction
reaction (CORR) is key for sustainable production of valuable chemicals, yet it remains a …
reaction (CORR) is key for sustainable production of valuable chemicals, yet it remains a …
Novel multi-functional sites in boron-based bi-atom catalysts synergistically boost C–C coupling for efficient CO electroreduction towards ethanol
The electrochemical CO reduction reaction (CORR) is faced by challenges in achieving high-
value-added C2 products due to inefficient C–C bond formation and low selectivity. Using …
value-added C2 products due to inefficient C–C bond formation and low selectivity. Using …
Graphyne supported Co13, Fe13 and Ni13 nano-cluster as efficient electrocatalysts for nitrogen reduction reaction: A first principles study
BK Das, A Banerjee, A Das, KK Chattopadhyay - Catalysis Today, 2023 - Elsevier
A systematic first principles study is carried out to probe into the activity of graphyne
supported Co 13, Fe 13 and Ni 13 nano-clusters (NCs) towards the reduction of nitrogen (N …
supported Co 13, Fe 13 and Ni 13 nano-clusters (NCs) towards the reduction of nitrogen (N …