Dirac cones in two-dimensional lattices: Janugraphene and chlorographene

Journal of Physical Chemistry Letters

Volumn 4, Issue 15, 2013, Pages 2471-2476

  Ma, Yandong ^a   Dai, Ying ^a   Huang, Baibiao ^a  

^a SHANDONG UNIVERSITY   (China)

Author keywords

chlorographene; density functional theory; Dirac points; janugraphene; rectangular lattices

Indexed keywords

CHLOROGRAPHENE; DIRAC POINT; EXTERNAL ELECTRIC FIELD; JANUGRAPHENE; PHYSICAL MECHANISM; RECTANGULAR LATTICES; TWO-DIMENSIONAL LATTICES; TWO-DIMENSIONAL MATERIALS;

DENSITY FUNCTIONAL THEORY;

TWO DIMENSIONAL;

EID: 84881308236     PISSN: None     EISSN: 19487185     Source Type: Journal    
DOI: 10.1021/jz401099j     Document Type: Article

References (38)

1. Novoselov, K. S.; Geim, A. K.; Morozov, S. V.; Jiang, D.; Zhang, Y.; Dubonos, S. V.; Grigorieva, I. V.; Firsov, A. A. Electric Field Effect in Atomically Thin Carbon Films Science 2004, 306, 666-669
2. 2 Monolayers (X = S, Se) and Their Strain-Induced Tunable Magnetic Properties ACS Nano 2012, 6, 1695-1701
3. 2 Silagraphene and Its One-Dimensional Derivatives: Where Planar Tetracoordinate Silicon Happens J. Am. Chem. Soc. 2011, 133, 900-908
4. Malko, D.; Neiss, C.; Gorling, A. Two-Dimensional Materials with Dirac Cones: Graphynes Containing Heteroatoms Phys. Rev. B 2012, 86, 045443-045448
5. Peng, Q.; Ji, W.; Deb, S. Mechanical Properties of Graphyne Monolayers: A First-Principles Study Phys. Chem. Chem. Phys. 2012, 14, 13385-13391
6. Liu, Y.; Wang, G.; Huang, Q.; Guo, L. W.; Chen, X. L. Structural and Electronic Properties of T Graphene: A Two-Dimensional Carbon Allotrope with Tetrarings Phys. Rev. Lett. 2012, 108, 225505-225510
7. Novoselov, K. S.; Geim, A. K.; Morozov, S. V.; Jiang, D.; Katsnelson, M. I.; Grigorieva, I. V.; Dubonos, S. V.; Firsov, A. A. Two-Dimensional Gas of Massless Dirac Fermions in Graphene Nature 2005, 438, 197-200
8. Ma, Y. D.; Dai, Y.; Guo, M.; Zhu, Y. T.; Huang, B. B. Graphene-Diamond Interface: Gap Opening and Electronic Spin Injection Phys. Rev. B 2012, 85, 235448-235452
9. Song, X. F.; Hu, J. L.; Zeng, H. B. Two-Dimensional Semiconductors: Recent Progress and Future Perspectives J. Mater. Chem. C 2013, 1, 2952-2969
10. Ohta, T.; Bostwick, A.; Seyller, T.; Horn, K.; Rotenberg, E. Controlling the Electronic Structure of Bilayer Graphene Science 2006, 313, 951-954
11. Pletikosic, I.; Kralj, M.; Pervan, P.; Brako, R.; Coraux, J.; N'Diaye, A. T.; Busse, C.; Michely, T. Dirac Cones and Minigaps for Graphene on Ir(111) Phys. Rev. Lett. 2009, 102, 056808-056811
12. 2 Heterobilayers J. Phys. Chem. C 2011, 115, 20237-20241
13. Di Vincenzo, D. P.; Mele, E. J. Self-Consistent Effective-Mass Theory for Intralayer Screening in Graphite Intercalation Compounds Phys. Rev. B 1984, 29, 1685-1694
14. Geim, A. K. Graphene: Status and Prospects Science 2009, 324, 1530-1534
15. Geim, A. K.; Novoselov, K. S. The Rise of Graphene Nat. Mater. 2007, 6, 183-191
16. Blase, X.; Rubio, A.; Louie, S. G.; Cohen, M. L. Quasiparticle Band Structure of Bulk Hexagonal Boron Nitride and Related Systems Phys. Rev. B 1995, 51, 6868-6875
17. Brey, L.; Fertig, H. A. Electronic States of Graphene Nanoribbons Studied with the Dirac Equation Phys. Rev. B 2006, 73, 235411-235415
18. Zhang, L. M.; Yu, J. W.; Yang, M. M.; Xie, Q.; Peng, H. L.; Liu, Z. F. Janus Graphene from Asymmetric Two-Dimensional Chemistry Nat. Commun. 2013, 4, 1443-1449
19. Li, B.; Zhou, L.; Wu, D.; Peng, H.; Yan, K.; Zhou, Y.; Liu, Z. F. Photochemical Chlorination of Graphene ACS Nano 2011, 5, 5957-5961
20. Wu, J.; Xie, L.; Li, Y.; Wang, H.; Ouyang, Y.; Guo, J.; Dai, H. Controlled Chlorine Plasma Reaction for Noninvasive Graphene Doping J. Am. Chem. Soc. 2011, 133, 19668-19671
21. Gopalakrishnan, K.; Subrahmanyam, K. S.; Kumar, P.; Govindaraj, A.; Rao, C. N. R. Reversible Chemical Storage of Halogens in Few-Layer Graphene RSC Adv. 2012, 2, 1605-1608
22. Sahin, H.; Ciraci, S. Chlorine Adsorption on Graphene: Chlorographene J. Phys. Chem. C 2012, 116, 24075-24083
23. Ijas, M.; Havu, P.; Harju, A. Fracturing Graphene by Chlorination: A Theoretical Viewpoint Phys. Rev. B 2012, 85, 035440-035449
24. Yang, M.; Zhou, L.; Wang, J.; Liu, Z.; Liu, Z. Evolutionary Chlorination of Graphene: From Charge-Transfer Complex to Covalent Bonding and Non-Bonding J. Phys. Chem. C 2012, 116, 844-850
25. Malko, D.; Neiss, C.; Vines, F.; Gorling, A. Competition for Graphene: Graphynes with Direction-Dependent Dirac Cones Phys. Rev. Lett. 2012, 108, 086804-086807
26. Hass, J.; de Heer, W. A.; Conrad, E. H. The Growth and Morphology of Epitaxial Multilayer Graphene J. Phys.: Condens. Matter 2008, 20, 323202-323228
27. Cahangirov, S.; Topsakal, M.; Akturk, E.; Sahin, H.; Ciraci, S. Two- and One-Dimensional Honeycomb Structures of Silicon and Germanium Phys. Rev. Lett. 2009, 102, 236804-236807
28. Zhang, Y. B.; Tang, T. T.; Girit, C.; Zhao, H.; Martin, M. C.; Zettl, A.; Crommie, M. F.; Shen, Y. R.; Wang, F. Direct Observation of a Widely Tunable Bandgap in Bilayer Graphene Nature 2009, 459, 820-823
29. Kou, L. Z.; Li, C.; Zhang, Z. H.; Guo, W. L. Tuning Magnetism in Zigzag ZnO Nanoribbons by Transverse Electric Fields ACS Nano 2010, 4, 2124-2128
30. Lee, Y.-L.; Kim, S.; Park, C.; Ihm, J.; Son, Y.-W. Controlling Half-Metallicity of Graphene Nanoribbons by Using a Ferroelectric Polymer ACS Nano 2010, 4, 1345-1350
31. Hod, O.; Scuseria, G. E. Half-Metallic Zigzag Carbon Nanotube Dots ACS Nano 2008, 2, 2243-2249
32. Li, Y. F.; Li, F. Y.; Chen, Z. F. Graphane/Fluorographene Bilayer: Considerable C-H···F-C Hydrogen Bonding and Effective Band Structure Engineering J. Am. Chem. Soc. 2012, 134, 11269-11275
33. Kresse, G.; Furthmuller, J. Efficiency of ab-Initio Total Energy Calculations for Metals and Semiconductors Using a Plane-Wave Basis Set Comput. Mater. Sci. 1996, 6, 15-50
34. Kresse, G.; Furthmuller, J. Efficient Iterative Schemes for ab Initio Total-Energy Calculations Using a Plane-Wave Basis Set Phys. Rev. B 1996, 54, 11169-11186
35. Ceperley, D. M.; Alder, B. J. Ground State of the Electron Gas by a Stochastic Method Phys. Rev. Lett. 1980, 45, 566-569
36. Blöchl, P. E. Projector Augmented-Wave Method Phys. Rev. B 1994, 50, 17953-17979
37. Monkhorst, H. J.; Pack, J. D. Special Points for Brillouin-Zone Integrations Phys. Rev. B 1976, 13, 5188-5192
38. Makov, G.; Payne, M. C. Periodic Boundary Conditions in ab Initio Calculations Phys. Rev. B 1995, 51, 4014-4022