Systematic study of transition-metal (Fe, Co, Ni, Cu) phthalocyanines as electrocatalysts for oxygen reduction and their evaluation by DFT

RSC Advances ◽  
2016 ◽  
Vol 6 (71) ◽  
pp. 67049-67056 ◽  
Author(s):  
Zhengping Zhang ◽  
Shaoxuan Yang ◽  
Meiling Dou ◽  
Haijing Liu ◽  
Lin Gu ◽  
...  
Keyword(s):  
Transition Metal ◽  
Carbon Black ◽  
Oxygen Reduction Reaction ◽  
Oxygen Reduction ◽  
Systematic Study ◽  
Self Assembly ◽  
Reduction Reaction ◽  
Graphitized Carbon Black ◽  
Metal Phthalocyanines ◽  
Graphitized Carbon

A facile approach is reported to prepare a series of transition-metal phthalocyanines supported on graphitized carbon black (TMPc/GCB, TM: Fe, Co, Ni and Cu) as oxygen reduction reaction electrocatalysts,viaπ–π interaction self-assembly.

Well-defined Fe, Fe3C, and Fe2O3 heterostructures on carbon black: a synergistic catalyst for oxygen reduction reaction

2018 ◽  
Vol 8 (19) ◽  
pp. 4900-4906 ◽  
Author(s):  
Wen Feng ◽  
Min Liu ◽  
Jingjun Liu ◽  
Ye Song ◽  
Feng Wang
Keyword(s):  
Transition Metal ◽  
Carbon Black ◽  
Oxygen Reduction Reaction ◽  
Oxygen Reduction ◽  
Low Cost ◽  
Building Blocks ◽  
Reduction Reaction

Constructing Fe-based composites with a smart heterostructure, by using metallic Fe, Fe3C, Fe2O3 as building blocks, may open a door to rationally designing high-active and low-cost transition metal-based catalysts for the oxygen reduction reaction.

scholarly journals Probing the activity of transition metal M and heteroatom N4 co-doped in vacancy fullerene (M–N4–C64, M = Fe, Co, and Ni) towards the oxygen reduction reaction by density functional theory

RSC Advances ◽  
2021 ◽  
Vol 11 (5) ◽  
pp. 3174-3182
Author(s):  
Siwei Yang ◽  
Chaoyu Zhao ◽  
Ruxin Qu ◽  
Yaxuan Cheng ◽  
Huiling Liu ◽  
...  
Keyword(s):  
Density Functional Theory ◽  
Transition Metal ◽  
Oxygen Reduction Reaction ◽  
Oxygen Reduction ◽  
Density Functional ◽  
Reduction Reaction ◽  
Functional Theory ◽  
Co Doped

In this study, a novel type oxygen reduction reaction (ORR) electrocatalyst is explored using density functional theory (DFT); the catalyst consists of transition metal M and heteroatom N4 co-doped in vacancy fullerene (M–N4–C64, M = Fe, Co, and Ni).

Sign in / Sign up

Export Citation Format

Share Document