User menu

Stable hydrogenated graphene edge types: Normal and reconstructed Klein edges

Bibliographic reference Wagner, Philipp ; Ivanovskaya, Viktoria V. ; Melle-Franco, Manuel ; Humbert, Bernard ; Adjizian, Jean Joseph ; et. al. Stable hydrogenated graphene edge types: Normal and reconstructed Klein edges. In: Physical review. B, Condensed matter and materials physics, Vol. 88, no. 9, p. 1 (2013)
Permanent URL http://hdl.handle.net/2078/154511
  1. Nakada Kyoko, Fujita Mitsutaka, Dresselhaus Gene, Dresselhaus Mildred S., Edge state in graphene ribbons: Nanometer size effect and edge shape dependence, 10.1103/physrevb.54.17954
  2. Wakabayashi Katsunori, Fujita Mitsutaka, Ajiki Hiroshi, Sigrist Manfred, Electronic and magnetic properties of nanographite ribbons, 10.1103/physrevb.59.8271
  3. Cançado L. G., Pimenta M. A., Neves B. R. A., Dantas M. S. S., Jorio A., Influence of the Atomic Structure on the Raman Spectra of Graphite Edges, 10.1103/physrevlett.93.247401
  4. Geim A. K., Novoselov K. S., The rise of graphene, 10.1038/nmat1849
  5. Cervantes-Sodi F., Csányi G., Piscanec S., Ferrari A. C., Edge-functionalized and substitutionally doped graphene nanoribbons: Electronic and spin properties, 10.1103/physrevb.77.165427
  6. Wassmann Tobias, Seitsonen Ari P., Saitta A. Marco, Lazzeri Michele, Mauri Francesco, Structure, Stability, Edge States, and Aromaticity of Graphene Ribbons, 10.1103/physrevlett.101.096402
  7. Koskinen Pekka, Malola Sami, Häkkinen Hannu, Self-Passivating Edge Reconstructions of Graphene, 10.1103/physrevlett.101.115502
  8. Girit C. O., Meyer J. C., Erni R., Rossell M. D., Kisielowski C., Yang L., Park C.-H., Crommie M. F., Cohen M. L., Louie S. G., Zettl A., Graphene at the Edge: Stability and Dynamics, 10.1126/science.1166999
  9. Jia Xiaoting, Campos-Delgado Jessica, Terrones Mauricio, Meunier Vincent, Dresselhaus Mildred S., Graphene edges: a review of their fabrication and characterization, 10.1039/c0nr00600a
  10. Ritter Kyle A., Lyding Joseph W., The influence of edge structure on the electronic properties of graphene quantum dots and nanoribbons, 10.1038/nmat2378
  11. Gan Chee Kwan, Srolovitz David J., First-principles study of graphene edge properties and flake shapes, 10.1103/physrevb.81.125445
  12. Wagner Philipp, Ewels Christopher P., Ivanovskaya Viktoria V., Briddon Patrick R., Pateau Amand, Humbert Bernard, Ripple edge engineering of graphene nanoribbons, 10.1103/physrevb.84.134110
  13. Cocchi Caterina, Prezzi Deborah, Ruini Alice, Caldas Marilia J., Molinari Elisa, Optical Properties and Charge-Transfer Excitations in Edge-Functionalized All-Graphene Nanojunctions, 10.1021/jz200472a
  14. Branicio Paulo S, Jhon Mark H, Gan Chee Kwan, Srolovitz David J, Properties on the edge: graphene edge energies, edge stresses, edge warping, and the Wulff shape of graphene flakes, 10.1088/0965-0393/19/5/054002
  15. Ivanovskaya Viktoria V., Zobelli Alberto, Wagner Philipp, Heggie Malcolm I., Briddon Patrick R., Rayson Mark J., Ewels Chris P., Low-Energy Termination of Graphene Edges via the Formation of Narrow Nanotubes, 10.1103/physrevlett.107.065502
  16. Klein D.J., Graphitic polymer strips with edge states, 10.1016/0009-2614(93)e1378-t
  17. Zobelli Alberto, Ivanovskaya Viktoria, Wagner Philipp, Suarez-Martinez Irene, Yaya Abu, Ewels Chris P., A comparative study of density functional and density functional tight binding calculations of defects in graphene, 10.1002/pssb.201100630
  18. Kunstmann Jens, Özdoğan Cem, Quandt Alexander, Fehske Holger, Stability of edge states and edge magnetism in graphene nanoribbons, 10.1103/physrevb.83.045414
  19. Briddon P.R., Jones R., LDA Calculations Using a Basis of Gaussian Orbitals, 10.1002/(sici)1521-3951(200001)217:1<131::aid-pssb131>3.0.co;2-m
  20. Rayson M. J., Briddon P. R., Highly efficient method for Kohn-Sham density functional calculations of500–10 000atom systems, 10.1103/physrevb.80.205104
  21. Briddon P. R., Rayson M. J., Accurate Kohn-Sham DFT with the speed of tight binding: Current techniques and future directions in materials modelling, 10.1002/pssb.201046147
  22. Hartwigsen C., Goedecker S., Hutter J., Relativistic separable dual-space Gaussian pseudopotentials from H to Rn, 10.1103/physrevb.58.3641
  23. Elstner M., Porezag D., Jungnickel G., Elsner J., Haugk M., Frauenheim Th., Suhai S., Seifert G., Self-consistent-charge density-functional tight-binding method for simulations of complex materials properties, 10.1103/physrevb.58.7260
  24. Aradi B., Hourahine B., Frauenheim Th., DFTB+, a Sparse Matrix-Based Implementation of the DFTB Method†, 10.1021/jp070186p
  25. Lu Y. H., Wu R. Q., Shen L., Yang M., Sha Z. D., Cai Y. Q., He P. M., Feng Y. P., Effects of edge passivation by hydrogen on electronic structure of armchair graphene nanoribbon and band gap engineering, 10.1063/1.3103551
  26. Perdew John P., Wang Yue, Accurate and simple analytic representation of the electron-gas correlation energy, 10.1103/physrevb.45.13244
  27. Perdew John P., Burke Kieron, Ernzerhof Matthias, Generalized Gradient Approximation Made Simple, 10.1103/physrevlett.77.3865
  28. Lee Hosik, Son Young-Woo, Park Noejung, Han Seungwu, Yu Jaejun, Magnetic ordering at the edges of graphitic fragments: Magnetic tail interactions between the edge-localized states, 10.1103/physrevb.72.174431
  29. Son Young-Woo, Cohen Marvin L., Louie Steven G., Half-metallic graphene nanoribbons, 10.1038/nature05180
  30. Lee Geunsik, Cho Kyeongjae, Electronic structures of zigzag graphene nanoribbons with edge hydrogenation and oxidation, 10.1103/physrevb.79.165440
  31. Yazyev Oleg V, Emergence of magnetism in graphene materials and nanostructures, 10.1088/0034-4885/73/5/056501
  32. Chia Cheng-Ing, Crespi Vincent H., Stabilizing the Zigzag Edge: Graphene Nanoribbons with Sterically Constrained Terminations, 10.1103/physrevlett.109.076802
  33. Celebi Kemal, Cole Matthew T., Choi Jong Won, Wyczisk Frederic, Legagneux Pierre, Rupesinghe Nalin, Robertson John, Teo Kenneth B. K., Park Hyung Gyu, Evolutionary Kinetics of Graphene Formation on Copper, 10.1021/nl303934v
  34. Treier Matthias, Pignedoli Carlo Antonio, Laino Teodoro, Rieger Ralph, Müllen Klaus, Passerone Daniele, Fasel Roman, Surface-assisted cyclodehydrogenation provides a synthetic route towards easily processable and chemically tailored nanographenes, 10.1038/nchem.891
  35. Zhang Wenhua, Wu Ping, Li Zhenyu, Yang Jinlong, First-Principles Thermodynamics of Graphene Growth on Cu Surfaces, 10.1021/jp2006827
  36. M. W. Chase, J. Phys. Chem. Ref. Data Monograph, 9, 1 (1998)
  37. Li X., Cai W., An J., Kim S., Nah J., Yang D., Piner R., Velamakanni A., Jung I., Tutuc E., Banerjee S. K., Colombo L., Ruoff R. S., Large-Area Synthesis of High-Quality and Uniform Graphene Films on Copper Foils, 10.1126/science.1171245
  38. Efficient growth of high-quality graphene films on Cu foils by ambient pressure chemical vapor deposition, 10.1063/1.3512865
  39. Celebi K., Cole M. T., Teo K. B. K., Park H. G., Observations of Early Stage Graphene Growth on Copper, 10.1149/2.005201esl
  40. Murdock Adrian T., Koos Antal, Britton T. Ben, Houben Lothar, Batten Tim, Zhang Tong, Wilkinson Angus J., Dunin-Borkowski Rafal E., Lekka Christina E., Grobert Nicole, Controlling the Orientation, Edge Geometry, and Thickness of Chemical Vapor Deposition Graphene, 10.1021/nn3049297
  41. Tapasztó Levente, Dobrik Gergely, Lambin Philippe, Biró László P., Tailoring the atomic structure of graphene nanoribbons by scanning tunnelling microscope lithography, 10.1038/nnano.2008.149
  42. Fasoli A., Colli A., Lombardo A., Ferrari A. C., Fabrication of graphene nanoribbons via nanowire lithography : Fabrication of graphene nanoribbons via nanowire lithography, 10.1002/pssb.200982356
  43. Kosynkin Dmitry V., Higginbotham Amanda L., Sinitskii Alexander, Lomeda Jay R., Dimiev Ayrat, Price B. Katherine, Tour James M., Longitudinal unzipping of carbon nanotubes to form graphene nanoribbons, 10.1038/nature07872
  44. Jiao Liying, Zhang Li, Wang Xinran, Diankov Georgi, Dai Hongjie, Narrow graphene nanoribbons from carbon nanotubes, 10.1038/nature07919
  45. Paiva M. Conceição, Xu Wei, Fernanda Proença M., Novais Rui M., Lægsgaard Erik, Besenbacher Flemming, Unzipping of Functionalized Multiwall Carbon Nanotubes Induced by STM, 10.1021/nl100240n
  46. Melle-Franco Manuel, Marcaccio Massimo, Paolucci Demis, Paolucci Francesco, Georgakilas Vasilios, Guldi Dirk M., Prato Maurizio, Zerbetto Francesco, Cyclic Voltammetry and Bulk Electronic Properties of Soluble Carbon Nanotubes, 10.1021/ja039918r
  47. Zhang Xiaowei, Yazyev Oleg V., Feng Juanjuan, Xie Liming, Tao Chenggang, Chen Yen-Chia, Jiao Liying, Pedramrazi Zahra, Zettl Alex, Louie Steven G., Dai Hongjie, Crommie Michael F., Experimentally Engineering the Edge Termination of Graphene Nanoribbons, 10.1021/nn303730v
  48. Xie Liming, Jiao Liying, Dai Hongjie, Selective Etching of Graphene Edges by Hydrogen Plasma, 10.1021/ja107071g