The doping effect on the catalytic activity of graphene for oxygen evolution reaction in a lithium–air battery: a first-principles study

2015 ◽  
Vol 17 (22) ◽  
pp. 14605-14612 ◽  
Author(s):  
Xiaodong Ren ◽  
Beizhou Wang ◽  
Jinzhen Zhu ◽  
Jianjun Liu ◽  
Wenqing Zhang ◽  
...  
Keyword(s):  
Catalytic Activity ◽  
Oxygen Evolution ◽  
First Principles ◽  
Oxygen Evolution Reaction ◽  
Catalytic Effect ◽  
Doping Effect ◽  
First Principles Study ◽  
Air Battery ◽  
B Doping

B,P-codoped graphene has synergetic catalytic effect on O2 evolution of B-doping and Li+ desorption of P-doping.

Electrocatalytic Performance of Mn-adsorbed g-C3N4: A First-Principles Study

2021 ◽  
Author(s):  
Liu Guo ◽  
Rui Li ◽  
Jiawei Jiang ◽  
Ji-Jun Zou ◽  
Wenbo Mi
Keyword(s):  
Transition Metal ◽  
Oxygen Evolution ◽  
Active Center ◽  
Metal Atom ◽  
First Principles ◽  
Oxygen Evolution Reaction ◽  
Single Atom ◽  
Transition Metal Atom ◽  
First Principles Study ◽  
Magnetic Elements

Single-atom catalysts with magnetic elements as the active center have been widely exploited for efficient oxygen evolution reaction (OER) electrocatalyst. Here, different contents of transition metal atom Mn adsorbed on...

Iron incorporation affecting the structure and boosting catalytic activity of β-Co(OH)2: exploring the reaction mechanism of ultrathin two-dimensional carbon-free Fe3O4-decorated β-Co(OH)2nanosheets as efficient oxygen evolution electrocatalysts

2017 ◽  
Vol 5 (15) ◽  
pp. 6849-6859 ◽  
Author(s):  
Fengzhan Sun ◽  
Linbo Li ◽  
Guo Wang ◽  
Yuqing Lin
Keyword(s):  
Catalytic Activity ◽  
Reaction Mechanism ◽  
Oxygen Evolution ◽  
First Principles ◽  
Oxygen Evolution Reaction ◽  
First Principles Calculation ◽  
Two Dimensional ◽  
Iron Incorporation

Ultrathin two-dimensional Fe3O4-decorated β-Co(OH)2nanosheets are synthesized for oxygen evolution reaction and reaction mechanism is explored by first principles calculation.

First-Principles Study of Oxygen Evolution Reaction on the Oxygen-Containing Species Covered CoII-Exposing Co3O4 (100) Surface

2015 ◽  
Vol 145 (5) ◽  
pp. 1169-1176 ◽  
Author(s):  
Pengxiang Zhang ◽  
Yue Dong ◽  
Yongli Kou ◽  
Zuoyin Yang ◽  
Yaping Li ◽  
...  
Keyword(s):  
Oxygen Evolution ◽  
First Principles ◽  
Oxygen Evolution Reaction ◽  
First Principles Study
Sign in / Sign up

Export Citation Format

Share Document