메뉴 건너뛰기




Volumn 6, Issue 9, 2016, Pages 7015-7021

Dissociation of O2 and its reactivity on O/S doped graphene

Author keywords

[No Author keywords available]

Indexed keywords

CARBON; DENSITY FUNCTIONAL THEORY; DISSOCIATION; DOPING (ADDITIVES); GRAPHENE; MOLECULAR OXYGEN; OXIDATION; SULFUR DIOXIDE;

EID: 84977493576     PISSN: None     EISSN: 20462069     Source Type: Journal    
DOI: 10.1039/c5ra16789b     Document Type: Article
Times cited : (25)

References (40)
  • 1
    • 84893913676 scopus 로고    scopus 로고
    • Desulfurization performance of iron supported on activated carbon
    • X. Liu J. Guo Y. Chu D. Luo H. Yin M. Sun R. Yavuz Desulfurization performance of iron supported on activated carbon Fuel 2014 123 93 100
    • (2014) Fuel , vol.123 , pp. 93-100
    • Liu, X.1    Guo, J.2    Chu, Y.3    Luo, D.4    Yin, H.5    Sun, M.6    Yavuz, R.7
  • 4
    • 48049109396 scopus 로고    scopus 로고
    • Sulfur dioxide adsorption by activated carbons having different textural and chemical properties
    • N. Karatepe I. Orbak R. Yavuz A. Ozyuguran Sulfur dioxide adsorption by activated carbons having different textural and chemical properties Fuel 2008 87 3207 3215
    • (2008) Fuel , vol.87 , pp. 3207-3215
    • Karatepe, N.1    Orbak, I.2    Yavuz, R.3    Ozyuguran, A.4
  • 8
    • 84924266667 scopus 로고    scopus 로고
    • 2 and NO by epoxy groups on graphene oxides: The role of the hydroxyl group
    • 2 and NO by epoxy groups on graphene oxides: the role of the hydroxyl group RSC Adv. 2015 5 22802 22810
    • (2015) RSC Adv. , vol.5 , pp. 22802-22810
    • Cen, W.1    Hou, M.2    Liu, J.3    Yuan, S.4    Liu, Y.5    Chu, Y.6
  • 10
    • 79551579706 scopus 로고    scopus 로고
    • Adsorption of nitrogen oxides on graphene and graphene oxides: Insights from density functional calculations
    • S. Tang Z. Cao Adsorption of nitrogen oxides on graphene and graphene oxides: Insights from density functional calculations Phys. Chem. Chem. Phys. 2011 134 044710
    • (2011) Phys. Chem. Chem. Phys. , vol.134 , pp. 044710
    • Tang, S.1    Cao, Z.2
  • 11
    • 84933046812 scopus 로고    scopus 로고
    • Adsorption and oxidation of NO on graphene oxides: A dispersion corrected density functional theory investigation
    • M. Hou W. Cen H. Zhang J. Liu H. Yin F. Wei Adsorption and oxidation of NO on graphene oxides: A dispersion corrected density functional theory investigation Appl. Surf. Sci. 2015 339 55 61
    • (2015) Appl. Surf. Sci. , vol.339 , pp. 55-61
    • Hou, M.1    Cen, W.2    Zhang, H.3    Liu, J.4    Yin, H.5    Wei, F.6
  • 12
    • 84881093321 scopus 로고    scopus 로고
    • Nitrogen-doped graphene prepared by a transfer doping approach for the oxygen reduction reaction application
    • Z. Mo R. Zheng H. Peng H. Liang S. Liao Nitrogen-doped graphene prepared by a transfer doping approach for the oxygen reduction reaction application J. Power Sources 2014 245 801 807
    • (2014) J. Power Sources , vol.245 , pp. 801-807
    • Mo, Z.1    Zheng, R.2    Peng, H.3    Liang, H.4    Liao, S.5
  • 13
    • 84872360926 scopus 로고    scopus 로고
    • Nitrogen-doped graphene as catalysts and catalyst supports for oxygen reduction in both acidic and alkaline solutions
    • J. Bai Q. Zhu Z. Lv H. Dong J. Yu L. Dong Nitrogen-doped graphene as catalysts and catalyst supports for oxygen reduction in both acidic and alkaline solutions Int. J. Hydrogen Energy 2013 38 1413 1418
    • (2013) Int. J. Hydrogen Energy , vol.38 , pp. 1413-1418
    • Bai, J.1    Zhu, Q.2    Lv, Z.3    Dong, H.4    Yu, J.5    Dong, L.6
  • 14
    • 84969158448 scopus 로고    scopus 로고
    • Sulfur-dopend graphene derived from cycled lithium-sulfur batteries as a metal-free electrocatalyst for the oxygen reduction reaction
    • Z. Ma S. Dou A. Shen L. Tao L. Dai S. Wang Sulfur-dopend graphene derived from cycled lithium-sulfur batteries as a metal-free electrocatalyst for the oxygen reduction reaction Angew. Chem., Int. Ed. 2015 54 1888 1892
    • (2015) Angew. Chem., Int. Ed. , vol.54 , pp. 1888-1892
    • Ma, Z.1    Dou, S.2    Shen, A.3    Tao, L.4    Dai, L.5    Wang, S.6
  • 15
    • 84859993188 scopus 로고    scopus 로고
    • BCN Graphene as efficient metal-free electrocatalyst for the oxygen reduction reaction
    • S. Wang L. Zhang Z. Xia A. Roy D. Chang J. B. Baek L. Dai BCN Graphene as efficient metal-free electrocatalyst for the oxygen reduction reaction Angew. Chem., Int. Ed. 2012 51 4209 4212
    • (2012) Angew. Chem., Int. Ed. , vol.51 , pp. 4209-4212
    • Wang, S.1    Zhang, L.2    Xia, Z.3    Roy, A.4    Chang, D.5    Baek, J.B.6    Dai, L.7
  • 16
    • 84899547407 scopus 로고    scopus 로고
    • N-doped graphene as catalysts for oxygen reduction and oxygen evolution reactions: Theoretical considerations
    • M. Li L. Zhang Q. Xu J. Niu Z. Xia N-doped graphene as catalysts for oxygen reduction and oxygen evolution reactions: Theoretical considerations J. Catal. 2014 314 66 72
    • (2014) J. Catal. , vol.314 , pp. 66-72
    • Li, M.1    Zhang, L.2    Xu, Q.3    Niu, J.4    Xia, Z.5
  • 17
    • 84883500512 scopus 로고    scopus 로고
    • Nitrogen-doped graphene/carbon nanotube self-assembly for efficient oxygen reduction reaction in acid media
    • C. H. Choi M. W. Chung H. C. Kwon J. H. Chung S. I. Woo Nitrogen-doped graphene/carbon nanotube self-assembly for efficient oxygen reduction reaction in acid media Appl. Catal., B 2014 144 760 766
    • (2014) Appl. Catal., B , vol.144 , pp. 760-766
    • Choi, C.H.1    Chung, M.W.2    Kwon, H.C.3    Chung, J.H.4    Woo, S.I.5
  • 18
    • 79958739975 scopus 로고    scopus 로고
    • Mechanisms of oxygen reduction reaction on nitrogen-hoped graphene for fuel cells
    • L. Zhang Z. Xia Mechanisms of oxygen reduction reaction on nitrogen-hoped graphene for fuel cells J. Phys. Chem. C 2011 115 11170 11176
    • (2011) J. Phys. Chem. C , vol.115 , pp. 11170-11176
    • Zhang, L.1    Xia, Z.2
  • 19
    • 84865743353 scopus 로고    scopus 로고
    • N-doped graphene/carbon composite as non-precious metal electrocatalyst for oxygen reduction reaction
    • Q. Liu H. Zhang H. Zhong S. Zhang S. Chen N-doped graphene/carbon composite as non-precious metal electrocatalyst for oxygen reduction reaction Electrochim. Acta 2012 81 313 320
    • (2012) Electrochim. Acta , vol.81 , pp. 313-320
    • Liu, Q.1    Zhang, H.2    Zhong, H.3    Zhang, S.4    Chen, S.5
  • 20
    • 84861119018 scopus 로고    scopus 로고
    • Effect of microstructure of nitrogen-doped graphene on oxygen reduction activity in fuel cells
    • L. Zhang J. Niu L. Dai Z. Xia Effect of microstructure of nitrogen-doped graphene on oxygen reduction activity in fuel cells Langmuir 2012 28 7542 7550
    • (2012) Langmuir , vol.28 , pp. 7542-7550
    • Zhang, L.1    Niu, J.2    Dai, L.3    Xia, Z.4
  • 21
    • 59849084114 scopus 로고    scopus 로고
    • Nitrogen-doped carbon nanotube arrays with high electrocatalytic activity for oxygen
    • K. Gong F. Du Z. Xia M. Durstock L. Dai Nitrogen-doped carbon nanotube arrays with high electrocatalytic activity for oxygen Science 2009 323 760 763
    • (2009) Science , vol.323 , pp. 760-763
    • Gong, K.1    Du, F.2    Xia, Z.3    Durstock, M.4    Dai, L.5
  • 23
    • 84856206017 scopus 로고    scopus 로고
    • Sulfur-doped graphene as an efficient metal-free cathode catalyst for oxygen reduction
    • Z. Yang Z. Yao G. Li G. Fang H. Nie L. Zheng X. Zhou X. Chen S. Huang Sulfur-doped graphene as an efficient metal-free cathode catalyst for oxygen reduction ACS Nano 2012 6 205 211
    • (2012) ACS Nano , vol.6 , pp. 205-211
    • Yang, Z.1    Yao, Z.2    Li, G.3    Fang, G.4    Nie, H.5    Zheng, L.6    Zhou, X.7    Chen, X.8    Huang, S.9
  • 24
    • 84887425991 scopus 로고    scopus 로고
    • Edge-selectively sulfurized graphene nanoplatelets as efficient metal-free electrocatalysts for oxygen reduction reaction: The electron spin effect
    • I. Y. Jeon S. Zhang L. Zhang H. J. Choi J. M. Seo Z. Xia L. Dai J. B. Baek Edge-selectively sulfurized graphene nanoplatelets as efficient metal-free electrocatalysts for oxygen reduction reaction: The electron spin effect Adv. Mater. 2013 25 6138 6145
    • (2013) Adv. Mater. , vol.25 , pp. 6138-6145
    • Jeon, I.Y.1    Zhang, S.2    Zhang, L.3    Choi, H.J.4    Seo, J.M.5    Xia, Z.6    Dai, L.7    Baek, J.B.8
  • 25
    • 84868592668 scopus 로고    scopus 로고
    • Sulfur and nitrogen dual-doped mesoporous graphene electrocatalyst for oxygen reduction with synergistically enhanced performance
    • J. Liang Y. Jiao M. Jaroniec S. Qiao Sulfur and nitrogen dual-doped mesoporous graphene electrocatalyst for oxygen reduction with synergistically enhanced performance Angew. Chem., Int. Ed. 2012 51 11496 11500
    • (2012) Angew. Chem., Int. Ed. , vol.51 , pp. 11496-11500
    • Liang, J.1    Jiao, Y.2    Jaroniec, M.3    Qiao, S.4
  • 26
    • 84874850369 scopus 로고    scopus 로고
    • Two-step boron and nitrogen doping in graphene for an enhanced synergistic catalysis
    • Y. Zheng Y. Jiao L. Ge M. Jaroniec S. Qiao Two-step boron and nitrogen doping in graphene for an enhanced synergistic catalysis Angew. Chem., Int. Ed. 2013 52 3110 3116
    • (2013) Angew. Chem., Int. Ed. , vol.52 , pp. 3110-3116
    • Zheng, Y.1    Jiao, Y.2    Ge, L.3    Jaroniec, M.4    Qiao, S.5
  • 28
    • 84902192589 scopus 로고    scopus 로고
    • Water splitting over graphene-based catalysts: Ab initio calculations
    • D. W. Boukhvalov Y. W. Son R. S. Ruoff Water splitting over graphene-based catalysts: Ab initio calculations ACS Catal. 2014 4 2016 2021
    • (2014) ACS Catal. , vol.4 , pp. 2016-2021
    • Boukhvalov, D.W.1    Son, Y.W.2    Ruoff, R.S.3
  • 29
    • 84867842356 scopus 로고    scopus 로고
    • Graphene oxide: An ideal support for gold nanocatalysts
    • M. Yang M. Zhou A. Zhang C. Zhang Graphene oxide: An ideal support for gold nanocatalysts J. Phys. Chem. C 2012 116 22336 22340
    • (2012) J. Phys. Chem. C , vol.116 , pp. 22336-22340
    • Yang, M.1    Zhou, M.2    Zhang, A.3    Zhang, C.4
  • 30
    • 0030190741 scopus 로고    scopus 로고
    • Efficiency of ab initio total energy calculations for metals and semiconductors using a plane-wave basis set
    • G. Kresse J. Furthmuller Efficiency of ab initio total energy calculations for metals and semiconductors using a plane-wave basis set Comput. Mater. Sci. 1996 6 15 50
    • (1996) Comput. Mater. Sci. , vol.6 , pp. 15-50
    • Kresse, G.1    Furthmuller, J.2
  • 31
    • 2442537377 scopus 로고    scopus 로고
    • Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set
    • G. Kresse J. Furthmuller Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set Phys. Rev. B: Condens. Matter Mater. Phys. 1996 54 11169 11186
    • (1996) Phys. Rev. B: Condens. Matter Mater. Phys. , vol.54 , pp. 11169-11186
    • Kresse, G.1    Furthmuller, J.2
  • 32
    • 4243943295 scopus 로고    scopus 로고
    • Generalized gradient approximation made simple
    • J. P. Perdew K. Burke M. Ernzerhof Generalized gradient approximation made simple Phys. Rev. Lett. 1996 77 3865 3868
    • (1996) Phys. Rev. Lett. , vol.77 , pp. 3865-3868
    • Perdew, J.P.1    Burke, K.2    Ernzerhof, M.3
  • 33
    • 0011236321 scopus 로고    scopus 로고
    • From ultrasoft pseudopotentials to the projector augmented-wave method
    • G. Kresse D. Joubert From ultrasoft pseudopotentials to the projector augmented-wave method Phys. Rev. B: Condens. Matter Mater. Phys. 1999 59 1758 1775
    • (1999) Phys. Rev. B: Condens. Matter Mater. Phys. , vol.59 , pp. 1758-1775
    • Kresse, G.1    Joubert, D.2
  • 34
    • 33750559983 scopus 로고    scopus 로고
    • Semiempirical GGA-type density functional constructed with a long-range dispersion correction
    • S. Grimme Semiempirical GGA-type density functional constructed with a long-range dispersion correction J. Comput. Chem. 2006 27 1787 1799
    • (2006) J. Comput. Chem. , vol.27 , pp. 1787-1799
    • Grimme, S.1
  • 36
    • 0038102778 scopus 로고    scopus 로고
    • Infrared spectroscopy of carbon materials: A quantum chemical study of model compounds
    • E. Fuente J. A. Menendez M. A. Diez D. Suarez M. A. Montes-Moran Infrared spectroscopy of carbon materials: A quantum chemical study of model compounds J. Phys. Chem. B 2003 107 6350 6359
    • (2003) J. Phys. Chem. B , vol.107 , pp. 6350-6359
    • Fuente, E.1    Menendez, J.A.2    Diez, M.A.3    Suarez, D.4    Montes-Moran, M.A.5
  • 37
    • 1242329035 scopus 로고    scopus 로고
    • Improved tangent estimate in the nudged elastic band method for finding minimum energy paths and saddle points
    • G. Henkelman H. Jonsson Improved tangent estimate in the nudged elastic band method for finding minimum energy paths and saddle points J. Chem. Phys. 2000 113 9978 9985
    • (2000) J. Chem. Phys. , vol.113 , pp. 9978-9985
    • Henkelman, G.1    Jonsson, H.2
  • 38
    • 0034513054 scopus 로고    scopus 로고
    • A climbing image nudged elastic band method for finding saddle points and minimum energy paths
    • G. Henkelman B. P. Uberuaga H. Jonsson A climbing image nudged elastic band method for finding saddle points and minimum energy paths J. Chem. Phys. 2000 113 9901 9904
    • (2000) J. Chem. Phys. , vol.113 , pp. 9901-9904
    • Henkelman, G.1    Uberuaga, B.P.2    Jonsson, H.3
  • 39
    • 79958734851 scopus 로고    scopus 로고
    • 2 and NO adsorption on heteroatom-doped graphene including the van der Waals interaction
    • 2 and NO adsorption on heteroatom-doped graphene including the van der Waals interaction J. Phys. Chem. C 2011 115 10971 10978
    • (2011) J. Phys. Chem. C , vol.115 , pp. 10971-10978
    • Pramanik, A.1    Kang, H.S.2
  • 40
    • 0000819359 scopus 로고
    • Potentials of physical adsorption
    • G. Vidali G. Ihm Potentials of physical adsorption Surf. Sci. Rep. 1991 12 133 181
    • (1991) Surf. Sci. Rep. , vol.12 , pp. 133-181
    • Vidali, G.1    Ihm, G.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.