scholarly journals First-principles study of the initial oxygen reduction reaction on stoichiometric and reduced CeO2 (111) surfaces as a cathode catalyst for lithium–oxygen batteries

2017 ◽  
Vol 5 (7) ◽  
pp. 3320-3329 ◽  
Author(s):  
Xinyu Li ◽  
Zongbao Li ◽  
Xiaofeng Yang ◽  
Lichao Jia ◽  
Yong Qing Fu ◽  
...  
Keyword(s):  
Oxygen Reduction Reaction ◽  
Oxygen Reduction ◽  
First Principles ◽  
Reduction Reaction ◽  
Cathode Catalyst ◽  
Reduction Reactions ◽  
Oxygen Reduction Reactions ◽  
First Principles Study ◽  
Initial Oxygen ◽  
Lithium Oxygen Batteries

The initial oxygen reduction reactions on stoichiometric and reduced CeO2 (111) surfaces as a cathode catalyst for lithium-oxygen batteries have been investigated by a first-principles method.

scholarly journals Oxygen reduction on zirconium-stabilized-PdO surfaces: a first-principles study

RSC Advances ◽  
2017 ◽  
Vol 7 (65) ◽  
pp. 41057-41062 ◽  
Author(s):  
Xiaofeng Yang ◽  
Zongbao Li ◽  
Xinyu Li ◽  
Ao Wang ◽  
Lichao Jia ◽  
...  
Keyword(s):  
Oxygen Reduction Reaction ◽  
Oxygen Reduction ◽  
First Principles ◽  
Relative Stability ◽  
Reduction Reaction ◽  
First Principles Calculations ◽  
First Principles Study

The oxygen reduction reaction properties on PdO and Zr-doped PdO surfaces, and the relative stability of the concerned surfaces, have been studied by first-principles calculations.

Heteroatom-Doped Nanomaterials/Core–Shell Nanostructures Based Electrocatalysts for Oxygen Reduction Reaction

2021 ◽  
Author(s):  
Saravanan Nagappan ◽  
Malarkodi Duraivel ◽  
Shamim Ahmed Hira ◽  
Kandasamy Prabakar ◽  
Chang-Sik Ha ◽  
...  
Keyword(s):  
Oxygen Reduction Reaction ◽  
Oxygen Reduction ◽  
Environmental Conditions ◽  
Reduction Reaction ◽  
Core Shell ◽  
Reduction Reactions ◽  
Oxygen Reduction Reactions ◽  
Shell Nanostructures ◽  
Doped Nanomaterials

Recently, heteroatom doped core–shell nanostructures (HCSNs) have been widely used as superior electrocatalysts for oxygen reduction reactions (ORRs) owing to their enhanced ORR performance and stability under harsh environmental conditions....

First-principles study of Pd-skin/Pd3Fe(111) electrocatalyst for oxygen reduction reaction

2017 ◽  
Vol 47 (6) ◽  
pp. 747-754 ◽  
Author(s):  
Do Ngoc Son ◽  
Pham Ngoc Thanh ◽  
Nguyen Dinh Quang ◽  
Kaito Takahashi ◽  
My Phuong Pham-Ho
Keyword(s):  
Oxygen Reduction Reaction ◽  
Oxygen Reduction ◽  
First Principles ◽  
Reduction Reaction ◽  
First Principles Study
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