First-Principles Study of Nitrogen-, Boron-Doped Graphene and Co-Doped Graphene as the Potential Catalysts in Nonaqueous Li–O2 Batteries

H. R. Jiang; T. S. Zhao; L. Shi; P. Tan; L. An

doi:10.1021/acs.jpcc.6b00136

First-Principles Study of Nitrogen-, Boron-Doped Graphene and Co-Doped Graphene as the Potential Catalysts in Nonaqueous Li–O2 Batteries

The Journal of Physical Chemistry C ◽

10.1021/acs.jpcc.6b00136 ◽

2016 ◽

Vol 120 (12) ◽

pp. 6612-6618 ◽

Cited By ~ 100

Author(s):

H. R. Jiang ◽

T. S. Zhao ◽

L. Shi ◽

P. Tan ◽

L. An

Keyword(s):

First Principles ◽

First Principles Study ◽

Boron Doped ◽

Doped Graphene ◽

Co Doped

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Hydrogen storage on bare Cu atom and Cu-functionalized boron-doped graphene: A first principles study

International Journal of Hydrogen Energy ◽

10.1016/j.ijhydene.2016.10.031 ◽

2017 ◽

Vol 42 (7) ◽

pp. 4233-4243 ◽

Cited By ~ 29

Author(s):

Omar Faye ◽

Ubong Eduok ◽

Jerzy Szpunar ◽

Barbara Szpunar ◽

Almoustapha Samoura ◽

...

Keyword(s):

Hydrogen Storage ◽

First Principles ◽

First Principles Study ◽

Boron Doped ◽

Doped Graphene

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Efficient hydrogen storage in boron doped graphene decorated by transition metals – A first-principles study

Carbon ◽

10.1016/j.carbon.2014.02.048 ◽

2014 ◽

Vol 73 ◽

pp. 132-140 ◽

Cited By ~ 80

Author(s):

Santhanamoorthi Nachimuthu ◽

Po-Jung Lai ◽

Jyh-Chiang Jiang

Keyword(s):

Transition Metals ◽

Hydrogen Storage ◽

First Principles ◽

First Principles Study ◽

Boron Doped ◽

Doped Graphene

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First-principles study on the enhancement of lithium storage capacity in boron doped graphene

Applied Physics Letters ◽

10.1063/1.3259650 ◽

2009 ◽

Vol 95 (18) ◽

pp. 183103 ◽

Cited By ~ 94

Author(s):

Xianlong Wang ◽

Zhi Zeng ◽

Hyojun Ahn ◽

Guoxiu Wang

Keyword(s):

First Principles ◽

Storage Capacity ◽

Lithium Storage ◽

First Principles Study ◽

Boron Doped ◽

Doped Graphene

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A first principles study on aluminium-sulfur co-doped graphene as an electro-catalyst for oxygen reduction reaction in a PEM fuel cell

10.1063/5.0066645 ◽

2021 ◽

Author(s):

Christabel Ngetich ◽

Evan Wanjiru ◽

Kabini Karanja ◽

Patrick Kareru ◽

James Mutua

Keyword(s):

Fuel Cell ◽

Oxygen Reduction Reaction ◽

Oxygen Reduction ◽

First Principles ◽

Pem Fuel Cell ◽

Reduction Reaction ◽

First Principles Study ◽

Doped Graphene ◽

Co Doped

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A first-principles study of calcium-decorated, boron-doped graphene for high capacity hydrogen storage

Carbon ◽

10.1016/j.carbon.2010.12.023 ◽

2011 ◽

Vol 49 (5) ◽

pp. 1561-1567 ◽

Cited By ~ 148

Author(s):

Elham Beheshti ◽

Alireza Nojeh ◽

Peyman Servati

Keyword(s):

Hydrogen Storage ◽

First Principles ◽

High Capacity ◽

First Principles Study ◽

Boron Doped ◽

Doped Graphene

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First-principles study of the electronic and optical properties of nitrogen and gold co-doped graphene

Superlattices and Microstructures ◽

10.1016/j.spmi.2019.106363 ◽

2020 ◽

Vol 139 ◽

pp. 106363

Author(s):

Jian-Ning Zhang ◽

Ling Ma ◽

Min Zhang ◽

Liang-Cai Ma ◽

Jian-Min Zhang

Keyword(s):

Optical Properties ◽

First Principles ◽

Electronic And Optical Properties ◽

First Principles Study ◽

Doped Graphene ◽

Co Doped

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First principles study on the stability and thermodynamic properties of N Au co-doped graphene

Diamond and Related Materials ◽

10.1016/j.diamond.2020.107704 ◽

2020 ◽

Vol 103 ◽

pp. 107704 ◽

Cited By ~ 1

Author(s):

Jianning Zhang ◽

Ling Ma ◽

Min Zhang ◽

Jianmin Zhang

Keyword(s):

Thermodynamic Properties ◽

First Principles ◽

First Principles Study ◽

Doped Graphene ◽

The Stability ◽

Co Doped

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A First Principles study on Boron-doped Graphene decorated by Ni-Ti-Mg atoms for Enhanced Hydrogen Storage Performance

Scientific Reports ◽

10.1038/srep16797 ◽

2015 ◽

Vol 5 (1) ◽

Cited By ~ 27

Author(s):

Santhanamoorthi Nachimuthu ◽

Po-Jung Lai ◽

Ermias Girma Leggesse ◽

Jyh-Chiang Jiang

Keyword(s):

Hydrogen Storage ◽

First Principles ◽

Storage Performance ◽

First Principles Study ◽

Boron Doped ◽

Doped Graphene ◽

Hydrogen Storage Performance

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First principles study on copper and iridium co-doped SrTiO3 for shifting the optical absorption into visible region

SN Applied Sciences ◽

10.1007/s42452-020-03851-3 ◽

2020 ◽

Vol 2 (12) ◽

Author(s):

Meenakshi Sravani Bandaru ◽

Sudhanshu Choudhary

Keyword(s):

Optical Absorption ◽

First Principles ◽

Visible Region ◽

First Principles Study ◽

Co Doped

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First principles study of structural, electronic and vibrational properties of heavily boron-doped diamond

Physics Letters A ◽

10.1016/j.physleta.2009.05.008 ◽

2009 ◽

Vol 373 (29) ◽

pp. 2494-2500 ◽

Cited By ~ 24

Author(s):

Li Niu ◽

Jia-Qi Zhu ◽

Xiao Han ◽

Man-Lin Tan ◽

Wei Gao ◽

...

Keyword(s):

First Principles ◽

Vibrational Properties ◽

Boron Doped Diamond ◽

First Principles Study ◽

Boron Doped

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