Density functional theory calculations for the oxygen dissociation on nitrogen and transition metal doped graphenes

Chemical Physics Letters

Volumn 586, Issue , 2013, Pages 104-107

  Zheng, Yongping ^a   Xiao, Wei ^a,b   Cho, Maenghyo ^a   Cho, Kyeongjae ^a,c  

^a Seoul National University   (South Korea)

^b State Nuclear Power Research Institute   (China)

^c The University of Texas at Dallas   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

BINDING ENERGY; DISSOCIATION; DOPING (ADDITIVES); GAS ADSORPTION; GRAPHENE; NICKEL; NITROGEN; TRANSITION METALS;

3D TRANSITION METALS; CO AND NI; DISSOCIATION BARRIER; DOPING ATOMS; NITROGEN DOPED GRAPHENE; NUDGED ELASTIC BAND; ORR CATALYSTS; OXYGEN ADSORPTION;

DENSITY FUNCTIONAL THEORY;

EID: 84885643478     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2013.09.016     Document Type: Article

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