Theoretical characterization of reduction dynamics for graphene oxide by alkaline-earth metals

Carbon

Volumn 52, Issue , 2013, Pages 122-127

  Xie, Sheng Yi ^a   Li, Xian Bin ^a   Sun, Y Y ^b   Zhang, Yong Lai ^a   Han, Dong ^a,b   Tian, W Q ^a   Wang, Wen Quan ^a   Zheng, Yi Song ^a   Zhang, S B ^a,b   Sun, Hong Bo ^a  

^a JILIN UNIVERSITY   (China)

^b Rensselaer Polytechnic Institute   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CARBONYL GROUPS; ELECTRON RESERVOIR; ELECTRON TRANSFER; ELEMENTARY PROCESS; FAST KINETICS; FIRST-PRINCIPLES CALCULATION; GO MODEL; GRAPHENE OXIDES; HIGH CHEMICAL POTENTIAL; ON THE GO; OXIDIZED CARBONS; PRISTINE CARBON; RESIDUAL OXYGEN; THERMAL REDUCTION;

CALCULATIONS; COMPUTER SIMULATION; GRAPHENE; OXYGEN;

ELECTRON TRANSITIONS;

EID: 84869506162     PISSN: 00086223     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.carbon.2012.09.012     Document Type: Article

References (47)

1. A.H. Castro Neto, F. Guinea, N.M.R. Peres, K.S. Novoselov, and A.K. Geim The electronic properties of graphene Rev Mod Phys 81 2009 109 162
2. A.K. Geim Graphene: status and prospects Science 324 2009 1530 1534
3. F. Schwierz Graphene transistors Nat Nanotechnol 5 2010 487 496
4. K.S. Novoselov, A.K. Geim, S.V. Morozov, D. Jiang, Y. Zhang, and S.V. Dubonos Electric field effect in atomically thin carbon films Science 306 2004 666 669 (Pubitemid 39440910)
5. C. Berger, Z.M. Song, T.B. Li, X.B. Li, A.Y. Ogbazghi, and R. Feng Ultrathin epitaxial graphite: 2D electron gas properties and a route toward graphene-based nanoelectronics J Phys Chem B 108 2004 19912 19916 (Pubitemid 40079151)
6. K.V. Emtsev, A. Bostwick, K. Horn, J. Jobst, G.L. Kellogg, and L. Ley Towards wafer-size graphene layers by atmospheric pressure graphitization of silicon carbide Nat Mater 8 2009 203 207
7. P.W. Sutter, J.I. Flege, and E.A. Sutter Epitaxial graphene on ruthenium Nat Mater 7 2008 406 411 (Pubitemid 351585230)
8. I. Pletikosić, M. Kralj, P. Pervan, R. Brako, J. Coraux, and A.T. N'Diaye Dirac cones and minigaps for graphene on Ir(111) Phys Rev Lett 102 2009 056808-1 056808-4
9. X.S. Li, W.W. Cai, J.B. An, S. Kim, J. Nah, and D.X. Yang Large-area synthesis of high-quality and uniform graphene films on copper foils Science 324 2009 1312 1314
10. L.B. Gao, W.C. Ren, H.L. Xu, L. Jin, Z.X. Wang, and T. Ma Repeated growth and bubbling transfer of graphene with millimetre-size single-crystal grains using platinum Nat Commun 3 2012 699 705
11. S. Gilje, S. Han, M.S. Wang, K.L. Wang, and R.B. Kaner A chemical route to graphene for device applications Nano Lett 7 2007 3394 3398 (Pubitemid 350216034)
12. D.R. Dreyer, S. Park, C.W. Bielawski, and R.S. Ruoff The chemistry of graphene oxide Chem Soc Rev 39 2010 228 240
13. X. Wang, L.J. Zhi, and K. Müllen Transparent, conductive graphene electrodes for dye-sensitized solar cells Nano Lett 8 2008 323 327 (Pubitemid 351177822)
14. H.C. Schniepp, J.L. Li, M.J. McAllister, H. Sai, M. Herrera-Alonso, and D.H. Adamson Functionalized single graphene sheets derived from splitting graphite oxide J Phys Chem B 110 2006 8535 8539 (Pubitemid 43798555)
15. Y. Zhou, Q.L. Bao, L.A. Tang, Y.L. Zhong, and K.P. Loh Hydrothermal dehydration for the "green" reduction of exfoliated graphene oxide to graphene and demonstration of tunable optical limiting properties Chem Mater 21 2009 2950 2956
16. Y.W. Zhu, M.D. Stoller, W.W. Cai, A. Velamakanni, R.D. Piner, and D. Chen Exfoliation of graphite oxide in propylene carbonate and thermal reduction of the resulting graphene oxide platelets ACS Nano 4 2010 1227 1233
17. S. Stankovich, D.A. Dikin, R.D. Piner, K.A. Kohlhaas, A. Kleinhammes, and Y.Y. Jia Synthesis of graphene-based nanosheets via chemical reduction of exfoliated graphite oxide Carbon 45 2007 1558 1565 (Pubitemid 46829016)
18. H.J. Shin, K.K. Kim, A. Benayad, S.M. Yoon, H.K. Park, and I.S. Jung Efficient reduction of graphite oxide by sodium borohydride and its effect on electrical conductance Adv Funct Mater 19 2009 1987 1992
19. Z.S. Wu, W.C. Ren, L.B. Gao, B.L. Liu, C.B. Jiang, and H.M. Cheng Synthesis of high-quality graphene with a pre-determined number of layers Carbon 47 2009 493 499
20. S.F. Pei, J.P. Zhao, J.H. Du, W.C. Ren, and H.M. Cheng Direct reduction of graphene oxide films into highly conductive and flexible graphene films by hydrohalic acids Carbon 48 2010 4466 4474
21. J.P. Zhao, S.F. Pei, W.C. Ren, L.B. Gao, and H.M. Cheng Efficient preparation of large-area graphene oxide sheets for transparent conductive films ACS Nano 4 2010 5245 5252
22. I.K. Moon, J.H. Lee, R.S. Ruoff, and H.Y. Lee Reduced graphene oxide by chemical graphitization Nat Commun 1 2010 73 78
23. Y.L. Zhang, L. Guo, S. Wei, Y.Y. He, H. Xia, and Q.D. Chen Direct imprinting of microcircuits on graphene oxides film by femtosecond laser reduction Nano Today 5 2010 15 20
24. Y.L. Zhang, Q.D. Chen, H. Xia, and H.B. Sun Designable 3D nanofabrication by femtosecond laser direct writing Nano Today 5 2010 435 448
25. Z.J. Fan, K. Wang, J. Yan, T. Wei, L.J. Zhi, and J. Feng Facile synthesis of graphene nanosheets via Fe reduction of exfoliated graphite oxide ACS Nano 5 2011 191 198
26. X.G. Mei, and J.Y. Ouyang Ultrasonication-assisted ultrafast reduction of graphene oxide by zinc powder at room temperature Carbon 49 2011 5389 5397
27. A. Bagri, C. Mattevi, M. Acik, Y.J. Chabal, M. Chhowalla, and V.B. Shenoy Structural evolution during the reduction of chemically derived graphene oxide Nat Chem 2 2010 581 587
28. T.L. Chan, D. West, and S.B. Zhang Limits on passivating defects in semiconductors: the case of Si edge dislocations Phys Rev Lett 107 2011 035503-1 035503-4
29. J.E. House Inorganic chemistry 2008 Elsevier Oxford
30. G. Kress, and J. Furthmüller Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set Phys Rev B 54 1996 11169-1 11169-18
31. D.M. Bylander, and L. Kleinman Energy fluctuations induced by the Nosé thermostat Phys Rev B 46 1992 13756-1 13756-6
32. K.V. Zakharchenko, A. Fasolino, J.H. Los, and M.I. Katsnelson Melting of graphene: from two to one dimension J Phys: Condens Matter 23 2011 202202 202205
33. L. Wang, Y.Y. Sun, K. Lee, D. West, Z.F. Chen, and J.J. Zhao Stability of graphene oxide phases from first-principles calculations Phys Rev B 82 2010 161406-1(R)-161406-4(R)
34. J.A. Yan, L.D. Xian, and M.Y. Chou Structural and electronic properties of oxidized graphene Phys Rev Lett 103 2009 086802-1 086802-4
35. D.W. Boukhvalov, and M.I. Katsnelson Modeling of graphite oxide J Am Chem Soc 130 2008 10697 10701
36. N. Lu, Y. Huang, H.B. Li, Z.Y. Li, and J.L. Yang First principles nuclear magnetic resonance signatures of graphene oxide J Chem Phys 133 2010 034502-1 034502-7
37. 13C-labeled graphite oxide Science 321 2008 1815 1817
38. W. Gao, L.B. Alemany, L.J. Ci, and P.M. Ajayan New insights into the structure and reduction of graphite oxide Nat Chem 1 2009 403 408
39. I. Jung, D.A. Field, N.J. Clark, Y.W. Zhu, D.X. Yang, and R.D. Piner Reduction kinetics of graphene oxide determined by electrical transport measurements and temperature programmed desorption J Phys Chem C 113 2009 18480 18486
40. L. Pauling The nature of the chemical bond. IV. The energy of single bonds and the relative electronegativity of atoms J Am Chem Soc 54 1932 3570 3582
41. 2 ISIJ Int 47 2007 25 31 (Pubitemid 46616482)
42. F.G. Jones, and M. Tokunaga Low temperature coefficient cobalt-rare earth magnets IEEE Trans Magn 12 1976 968 970
43. 3 J Alloys Compd 230 1995 46 52
44. G.Z. Chen, D.J. Fray, and T.W. Farthing Direct electrochemical reduction of titanium dioxide to titanium in molten calcium chloride Nature 407 2000 361 364
45. M. Acik, G. Lee, C. Mattevi, M. Chhowalla, K. Cho, and Y.J. Chabal Unusual infrared-absorption mechanism in thermally reduced graphene oxide Nat Mater 9 2010 840 845
46. 2 J Power Sources 159 2006 116 119 (Pubitemid 44301634)
47. M.C. Kim, G.S. Hwang, and R.S. Ruoff Epoxide reduction with hydrazine on graphene: a first principles study J Chem Phys 131 2009 064704-1 064704-5