Finding Correlations of the Oxygen Reduction Reaction Activity of Transition Metal Catalysts with Parameters Obtained from Quantum Mechanics

2013 ◽  
Vol 117 (50) ◽  
pp. 26598-26607 ◽  
Author(s):  
Ted H. Yu ◽  
Timo Hofmann ◽  
Yao Sha ◽  
Boris V. Merinov ◽  
Deborah J. Myers ◽  
...  
Keyword(s):  
Quantum Mechanics ◽  
Transition Metal ◽  
Oxygen Reduction Reaction ◽  
Oxygen Reduction ◽  
Reduction Reaction ◽  
Metal Catalysts ◽  
Transition Metal Catalysts ◽  
Oxygen Reduction Reaction Activity

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.

Effect of transition metal (M: Fe, Co or Mn) for the oxygen reduction reaction with non-precious metal catalysts in acid medium

2014 ◽  
Vol 39 (10) ◽  
pp. 5309-5318 ◽  
Author(s):  
C. Domínguez ◽  
F.J. Pérez-Alonso ◽  
M. Abdel Salam ◽  
J.L. Gómez de la Fuente ◽  
S.A. Al-Thabaiti ◽  
...  
Keyword(s):  
Transition Metal ◽  
Oxygen Reduction Reaction ◽  
Oxygen Reduction ◽  
Acid Medium ◽  
Precious Metal ◽  
Reduction Reaction ◽  
Metal Catalysts ◽  
Precious Metal Catalysts
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