Fast prediction of oxygen reduction reaction activity on carbon nanotubes with a localized geometric descriptor

2020 ◽  
Vol 22 (2) ◽  
pp. 890-895 ◽  
Author(s):  
Kunran Yang ◽  
Jeremie Zaffran ◽  
Bo Yang
Keyword(s):  
Carbon Nanotubes ◽  
Structural Optimization ◽  
Oxygen Reduction Reaction ◽  
Oxygen Reduction ◽  
Reduction Reaction ◽  
Oxygen Reduction Reaction Activity ◽  
Orr Activity ◽  
Fast Prediction

By using the pyramidalization angle as a localized geometric descriptor for oxygen reduction reaction (ORR) activity of carbon nanotubes (CNTs), we show the ORR activity of these systems can be readily predicted with mere structural optimization of CNTs.

scholarly journals Correction: Fast prediction of oxygen reduction reaction activity on carbon nanotubes with a localized geometric descriptor

2021 ◽  
Vol 23 (7) ◽  
pp. 4454-4454
Author(s):  
Kunran Yang ◽  
Jeremie Zaffran ◽  
Bo Yang
Keyword(s):  
Carbon Nanotubes ◽  
Oxygen Reduction Reaction ◽  
Oxygen Reduction ◽  
Chem Phys ◽  
Reduction Reaction ◽  
Oxygen Reduction Reaction Activity ◽  
Fast Prediction ◽  
Phys Chem Chem Phys

Correction for ‘Fast prediction of oxygen reduction reaction activity on carbon nanotubes with a localized geometric descriptor’ by Kunran Yang et al., Phys. Chem. Chem. Phys., 2020, 22, 890–895, DOI: 10.1039/C9CP04885E.

An efficient cluster model to describe the oxygen reduction reaction activity of metal catalysts: a combined theoretical and experimental study

2018 ◽  
Vol 20 (41) ◽  
pp. 26675-26680 ◽  
Author(s):  
Liting Cui ◽  
Haining Wang ◽  
Sian Chen ◽  
Jin Zhang ◽  
Yan Xiang ◽  
...  
Keyword(s):  
Experimental Study ◽  
Oxygen Reduction Reaction ◽  
Oxygen Reduction ◽  
Cluster Model ◽  
Dft Calculation ◽  
Reduction Reaction ◽  
Metal Catalysts ◽  
Oxygen Reduction Reaction Activity ◽  
Metal Atoms ◽  
Orr Activity

An efficient model containing only 7 metal atoms was proposed to describe the ORR activity of metal catalysts by DFT calculation.

Synthesis of nano-TaOx oxygen reduction reaction catalysts on multi-walled carbon nanotubes connected via a decomposition of oxy-tantalum phthalocyanine

2015 ◽  
Vol 17 (12) ◽  
pp. 7643-7647 ◽  
Author(s):  
A. Ishihara ◽  
M. Chisaka ◽  
Y. Ohgi ◽  
K. Matsuzawa ◽  
S. Mitsushima ◽  
...  
Keyword(s):  
Carbon Nanotubes ◽  
Thermal Decomposition ◽  
Oxygen Reduction Reaction ◽  
Oxygen Reduction ◽  
Reduction Reaction ◽  
Acidic Media ◽  
Multi Walled Carbon Nanotubes ◽  
Orr Activity ◽  
Walled Carbon Nanotubes

Nano-TaOx particles were supported on MWCNTs via a thermal decomposition of oxy-tantalum phthalocyanine. The ORR activity solely-originated from nano-TaOx was above 0.9 V versus RHE with larger currents than conventional micro-TaOx in acidic media.

Can Boron and Nitrogen Co-doping Improve Oxygen Reduction Reaction Activity of Carbon Nanotubes?

2013 ◽  
Vol 135 (4) ◽  
pp. 1201-1204 ◽  
Author(s):  
Yu Zhao ◽  
Lijun Yang ◽  
Sheng Chen ◽  
Xizhang Wang ◽  
Yanwen Ma ◽  
...  
Keyword(s):  
Carbon Nanotubes ◽  
Oxygen Reduction Reaction ◽  
Oxygen Reduction ◽  
Reduction Reaction ◽  
Oxygen Reduction Reaction Activity ◽  
Co Doping

Porous calcium–manganese oxide/carbon nanotube microspheres as efficient oxygen reduction catalysts for rechargeable zinc–air batteries

2021 ◽  
Author(s):  
Nguk Neng Tham ◽  
Xiaoming Ge ◽  
Aishui Yu ◽  
Bing Li ◽  
Yun Zong ◽  
...  
Keyword(s):  
Carbon Nanotubes ◽  
Carbon Nanotube ◽  
Oxygen Reduction Reaction ◽  
Porous Structure ◽  
Oxygen Reduction ◽  
Reduction Reaction ◽  
Oxygen Reduction Reaction Activity ◽  
Oxygen Reduction Catalysts ◽  
Reduction Catalysts ◽  
Zinc Air Batteries

CaMnO3−δ/carbon nanotubes show excellent oxygen reduction reaction activity benefitting from their unique porous structure and synergistic coupling between CaMnO3−δ and carbon nanotubes.

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