Hydrogen Adsorption of Mg-Doped Graphene Oxide: A First-Principles Study

Chu Chen; Jun Zhang; Bei Zhang; Hai Ming Duan

doi:10.1021/jp308271b

Hydrogen Adsorption of Mg-Doped Graphene Oxide: A First-Principles Study

The Journal of Physical Chemistry C ◽

10.1021/jp308271b ◽

2013 ◽

Vol 117 (9) ◽

pp. 4337-4344 ◽

Cited By ~ 45

Author(s):

Chu Chen ◽

Jun Zhang ◽

Bei Zhang ◽

Hai Ming Duan

Keyword(s):

Graphene Oxide ◽

First Principles ◽

Hydrogen Adsorption ◽

First Principles Study ◽

Doped Graphene ◽

Mg Doped

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First-principles study on hydrogen adsorption on nitrogen doped graphene

Physica E Low-dimensional Systems and Nanostructures ◽

10.1016/j.physe.2016.12.012 ◽

2017 ◽

Vol 88 ◽

pp. 115-124 ◽

Cited By ~ 41

Author(s):

Rafique Muhammad ◽

Yong Shuai ◽

He-Ping Tan

Keyword(s):

First Principles ◽

Hydrogen Adsorption ◽

Nitrogen Doped ◽

First Principles Study ◽

Nitrogen Doped Graphene ◽

Doped Graphene

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The Journal of Chemical Physics ◽

10.1063/1.3503654 ◽

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pp. 154706 ◽

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Author(s):

Miao Miao Wu ◽

Qian Wang ◽

Qiang Sun ◽

Puru Jena ◽

Yoshiyuki Kawazoe

Keyword(s):

First Principles ◽

Hydrogen Adsorption ◽

First Principles Study ◽

Metal Doped

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physica status solidi (b) ◽

10.1002/pssb.201147131 ◽

2011 ◽

Vol 249 (1) ◽

pp. 185-189 ◽

Cited By ~ 9

Author(s):

Zhen-Kun Tang ◽

Ling-Ling Wang ◽

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Xiao-Fei Li ◽

Wen-Zhi Xiao ◽

...

Keyword(s):

First Principles ◽

Ferromagnetic Coupling ◽

First Principles Study ◽

Mg Doped

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N‐doped and P‐doped graphene on MgO (111): A first‐principles study

Advanced Engineering Materials ◽

10.1002/adem.202100762 ◽

2021 ◽

Author(s):

Dongbo Li ◽

Yinjie Shen ◽

Ping Yang

Keyword(s):

First Principles ◽

First Principles Study ◽

Doped Graphene

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First-principles study of B, C, N and F doped graphene-like MgO monolayer

Physica E Low-dimensional Systems and Nanostructures ◽

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Vol 81 ◽

pp. 7-13 ◽

Cited By ~ 11

Author(s):

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Min Huang ◽

Wenjing Cheng ◽

Fuling Tang

Keyword(s):

First Principles ◽

First Principles Study ◽

Doped Graphene

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Structural, chemical bonding and optoelectronic properties of Mg doped zinc chalcogenides: A first principles study

Materials Science in Semiconductor Processing ◽

10.1016/j.mssp.2014.09.016 ◽

2014 ◽

Vol 26 ◽

pp. 681-689 ◽

Cited By ~ 23

Author(s):

Naeem Ullah ◽

G. Murtaza ◽

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Jan Rehman ◽

Haleem Ud Din ◽

...

Keyword(s):

Chemical Bonding ◽

First Principles ◽

Optoelectronic Properties ◽

First Principles Study ◽

Mg Doped

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Detection of 2,4-dinitrotoluene by graphene oxide: first principles study

Materials Research Express ◽

10.1088/2053-1591/aac1e1 ◽

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pp. 056404 ◽

Cited By ~ 1

Author(s):

Hassan Abdollahi ◽

Akbar Kari ◽

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Keyword(s):

Graphene Oxide ◽

First Principles ◽

First Principles Study

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REGULAR ARTICLE: Nitrogen and Hydrogen Adsorption on the Pyrite FeS2 (100) surface: First-Principles Study

Communications in Computational Chemistry ◽

10.4208/cicc.2017.v5.n3.3 ◽

2017 ◽

Vol 5 (3) ◽

pp. 78-85

Author(s):

Xiaolong Hu

Keyword(s):

First Principles ◽

Hydrogen Adsorption ◽

First Principles Study

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Hydrogen adsorption on L12-Al3X(X = Zr, Sc) surface and its diffusion in the bulk: A first-principles study

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10.1016/j.vacuum.2020.109680 ◽

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Vol 182 ◽

pp. 109680

Author(s):

Yu Liu ◽

XieYi Zhang ◽

Zheng-Bing Xiao ◽

YuanChun Huang

Keyword(s):

First Principles ◽

Hydrogen Adsorption ◽

First Principles Study

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Improving hydrogen evolution reaction performance by combining ditungsten carbide and nitrogen-doped graphene: A first-principles study

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10.1016/j.carbon.2020.10.003 ◽

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Vol 172 ◽

pp. 122-131

Author(s):

Bo Zhang ◽

Xiuli Fu ◽

Li Song ◽

Xiaojun Wu

Keyword(s):

Hydrogen Evolution ◽

Hydrogen Evolution Reaction ◽

First Principles ◽

Nitrogen Doped ◽

First Principles Study ◽

Nitrogen Doped Graphene ◽

Doped Graphene ◽

Reaction Performance

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