Skip to main content
Top
Published in: International Journal of Mechanics and Materials in Design 3/2012

01-09-2012

Evaluation of the in-plane effective elastic moduli of single-layered graphene sheet

Author: K. Alzebdeh

Published in: International Journal of Mechanics and Materials in Design | Issue 3/2012

Log in

Activate our intelligent search to find suitable subject content or patents.

search-config
loading …

Abstract

In this paper, an equivalent continuum-structural mechanics approach is used to characterize the mechanical behaviour of nanostructured graphene. The in-plane elastic deformation of armchair graphene sheets is simulated by using finite element modelling. The model is based on the assumption that force interaction among carbon atoms can be modelled by load-carrying beams in a representative two-dimensional honeycomb lattice structure. The elastic properties of beam elements are determined by equating the energies of the molecular structure and the continuum beam model subjected to small strain deformation. Then an equivalent continuum technique is adopted to estimate effective elastic moduli from which elastic constants are extracted. A comparison of elastic constants obtained from current modelling concur with results reported in literature. With the multifunctional properties of graphene sheets as manifested in a broad range of industrial applications, determination of their elastic moduli will facilitate a better design of the corresponding materials at macroscopic level.

Dont have a licence yet? Then find out more about our products and how to get one now:

Springer Professional "Wirtschaft+Technik"

Online-Abonnement

Mit Springer Professional "Wirtschaft+Technik" erhalten Sie Zugriff auf:

  • über 102.000 Bücher
  • über 537 Zeitschriften

aus folgenden Fachgebieten:

  • Automobil + Motoren
  • Bauwesen + Immobilien
  • Business IT + Informatik
  • Elektrotechnik + Elektronik
  • Energie + Nachhaltigkeit
  • Finance + Banking
  • Management + Führung
  • Marketing + Vertrieb
  • Maschinenbau + Werkstoffe
  • Versicherung + Risiko

Jetzt Wissensvorsprung sichern!

Springer Professional "Technik"

Online-Abonnement

Mit Springer Professional "Technik" erhalten Sie Zugriff auf:

  • über 67.000 Bücher
  • über 390 Zeitschriften

aus folgenden Fachgebieten:

  • Automobil + Motoren
  • Bauwesen + Immobilien
  • Business IT + Informatik
  • Elektrotechnik + Elektronik
  • Energie + Nachhaltigkeit
  • Maschinenbau + Werkstoffe




 

Jetzt Wissensvorsprung sichern!

Literature
go back to reference ANSYS, Inc.: Theory manual, SAS IP Inc. (2003) ANSYS, Inc.: Theory manual, SAS IP Inc. (2003)
go back to reference Bao, W.X., Zhu, C.C., Cui, W.Z.: Simulation of Young’s modulus of single-walled carbon nanotubes by molecular dynamics. Phys. Rev. B 352, 156–163 (2004) Bao, W.X., Zhu, C.C., Cui, W.Z.: Simulation of Young’s modulus of single-walled carbon nanotubes by molecular dynamics. Phys. Rev. B 352, 156–163 (2004)
go back to reference Blakslee, O.L., Proctor, D.G., Seldin, E.J., Spence, G.B., Weng, T.: Elastic constants of compression-annealed pyrolytic graphite. J. Appl. Phys. 41, 3373–3382 (1970)CrossRef Blakslee, O.L., Proctor, D.G., Seldin, E.J., Spence, G.B., Weng, T.: Elastic constants of compression-annealed pyrolytic graphite. J. Appl. Phys. 41, 3373–3382 (1970)CrossRef
go back to reference Chang, T., Gao, H.: Size-dependent elastic properties of a single-walled carbon nanotube via a molecular mechanics model. J. Mech. Phys. Solid 51, 1059–1074 (2003)MATHCrossRef Chang, T., Gao, H.: Size-dependent elastic properties of a single-walled carbon nanotube via a molecular mechanics model. J. Mech. Phys. Solid 51, 1059–1074 (2003)MATHCrossRef
go back to reference Cho, J., Luo, J.J., Daniel, I.M.: Mechanical characterization of graphite/epoxy nanocomposites by multi-scale analysis. Compos. Sci. Technol. 67, 2399–2407 (2007)CrossRef Cho, J., Luo, J.J., Daniel, I.M.: Mechanical characterization of graphite/epoxy nanocomposites by multi-scale analysis. Compos. Sci. Technol. 67, 2399–2407 (2007)CrossRef
go back to reference Cornell, W.D., Cieplak, P., Bayly, C.I., Cloud, I.R., Merz Jr, K.M., Ferguson, S.D., et al.: A second generation force field for the simulation of proteins, nucleic acids and organic molecules. J. Am. Chem. Soc. 117(19), 5179–5197 (1995)CrossRef Cornell, W.D., Cieplak, P., Bayly, C.I., Cloud, I.R., Merz Jr, K.M., Ferguson, S.D., et al.: A second generation force field for the simulation of proteins, nucleic acids and organic molecules. J. Am. Chem. Soc. 117(19), 5179–5197 (1995)CrossRef
go back to reference Fukushima, H., Drzal, L.T.: Graphite nanoplatelets as reinforcement for polymers: Structural and electrical properties. In: Proceedings of the American Society for Composites, 17th Technical Conference, pp. 21–23 (2002) Fukushima, H., Drzal, L.T.: Graphite nanoplatelets as reinforcement for polymers: Structural and electrical properties. In: Proceedings of the American Society for Composites, 17th Technical Conference, pp. 21–23 (2002)
go back to reference Gao, Y., Hao, P.: Mechanical properties of monolayer graphene under tensile and compressive loading. Phys. E 41, 1561–1566 (2009)CrossRef Gao, Y., Hao, P.: Mechanical properties of monolayer graphene under tensile and compressive loading. Phys. E 41, 1561–1566 (2009)CrossRef
go back to reference Hammasizadeh, A., Mahzoon, M., Hadi, E., Khandan, R.: A method for developing the equivalent continuum model of a single layer graphene sheet. Thin solid Film 516, 7636–7640 (2008)CrossRef Hammasizadeh, A., Mahzoon, M., Hadi, E., Khandan, R.: A method for developing the equivalent continuum model of a single layer graphene sheet. Thin solid Film 516, 7636–7640 (2008)CrossRef
go back to reference Huang, Y., Wu, J., Hwang, K.C.: Thickness of graphene and single-wall carbon nanotubes. Phys. Rev. B 74(24), 245413-1-0 (2006)CrossRef Huang, Y., Wu, J., Hwang, K.C.: Thickness of graphene and single-wall carbon nanotubes. Phys. Rev. B 74(24), 245413-1-0 (2006)CrossRef
go back to reference Kudin, K.N., Scuseria, G.E., Yakobson, B.I.: C2F, BN, and C nanoshell elasticity from ab intio computations. Phys. Rev. B 64(23), 1–10 (2000) Kudin, K.N., Scuseria, G.E., Yakobson, B.I.: C2F, BN, and C nanoshell elasticity from ab intio computations. Phys. Rev. B 64(23), 1–10 (2000)
go back to reference Lee, C., Wei, X., Kysar, J.W., Hone, J.: Measurement of the elastic properties and intrinsic strength of monolayer graphene. Science 321(5887), 358–388 (2008)CrossRef Lee, C., Wei, X., Kysar, J.W., Hone, J.: Measurement of the elastic properties and intrinsic strength of monolayer graphene. Science 321(5887), 358–388 (2008)CrossRef
go back to reference Li, C., Chou, T.W.: A structural mechanics approach for the analysis of carbon nanotubes. Int. J. Solid Struct. 40, 2487–2499 (2003)CrossRef Li, C., Chou, T.W.: A structural mechanics approach for the analysis of carbon nanotubes. Int. J. Solid Struct. 40, 2487–2499 (2003)CrossRef
go back to reference Meo, M., Rossi, M.: Prediction of Young’s modulus of single wall carbon nanotubes by molecular-mechanics based finite element modelling. Compos. Sci. Technol. 66, 1597–1605 (2006)CrossRef Meo, M., Rossi, M.: Prediction of Young’s modulus of single wall carbon nanotubes by molecular-mechanics based finite element modelling. Compos. Sci. Technol. 66, 1597–1605 (2006)CrossRef
go back to reference Ni, Z., Bu, H., Zou, M., Yia, H., Bi, K., Ni, Z.: Atomistic simulations of mechanical properties of graphene sheets from molecular dynamics. Phys. B 352, 156–163 (2004)CrossRef Ni, Z., Bu, H., Zou, M., Yia, H., Bi, K., Ni, Z.: Atomistic simulations of mechanical properties of graphene sheets from molecular dynamics. Phys. B 352, 156–163 (2004)CrossRef
go back to reference Odegard, G.M., Gates, T.S., Nicholson, L.M., Wise, K.E.: Equivalent-continuum modelling of nano-structured materials. Compos. Sci. Technol. 62, 1869–1880 (2002)CrossRef Odegard, G.M., Gates, T.S., Nicholson, L.M., Wise, K.E.: Equivalent-continuum modelling of nano-structured materials. Compos. Sci. Technol. 62, 1869–1880 (2002)CrossRef
go back to reference Pozrikidis, C.: Mechanics of hexagonal atomic lattices. Int. J. Solid Struct. 45, 732–745 (2008)MATHCrossRef Pozrikidis, C.: Mechanics of hexagonal atomic lattices. Int. J. Solid Struct. 45, 732–745 (2008)MATHCrossRef
go back to reference Rappe, A.K., Casewit, C.J., Colwell, K.S., Goddard III, W.A., Skiff, W.M.: UFF, a full periodic table force field for molecular mechanics and molecular dynamics simulations. J. Am. Chem. Soc. 114(25), 10024–10035 (1992)CrossRef Rappe, A.K., Casewit, C.J., Colwell, K.S., Goddard III, W.A., Skiff, W.M.: UFF, a full periodic table force field for molecular mechanics and molecular dynamics simulations. J. Am. Chem. Soc. 114(25), 10024–10035 (1992)CrossRef
go back to reference Reddy, C.D., Rajendran, S., Liew, K.M.: Equilibrium configuration and continuum elastic properties of finite sized graphene. Nanotechnology 17, 864–870 (2006)CrossRef Reddy, C.D., Rajendran, S., Liew, K.M.: Equilibrium configuration and continuum elastic properties of finite sized graphene. Nanotechnology 17, 864–870 (2006)CrossRef
go back to reference Sakhaee-Pour, A.: Elastic properties of single-layered graphene sheet. Solid State Commun. 148, 91–95 (2009)CrossRef Sakhaee-Pour, A.: Elastic properties of single-layered graphene sheet. Solid State Commun. 148, 91–95 (2009)CrossRef
go back to reference Scarpa, F., Adhikari, S., Phani, A.S.: Effective elastic mechanical properties of single layer graphene sheets. Nanotechnology 20, 650–709 (2009)CrossRef Scarpa, F., Adhikari, S., Phani, A.S.: Effective elastic mechanical properties of single layer graphene sheets. Nanotechnology 20, 650–709 (2009)CrossRef
go back to reference Spence, G.B.: Proceeding of the fifth conference on carbon, London (1961) Spence, G.B.: Proceeding of the fifth conference on carbon, London (1961)
go back to reference Stankovich, S., Dikin, D.A., Dommett, G.H.B., Kohlhaas, K.M., Zimmey, E.J., Stach, E.A., Piner, R.D., Nguyen, S.T., Ruoff, R.S.: Graphene-based composite materials. Nature 442, 282–286 (2006)CrossRef Stankovich, S., Dikin, D.A., Dommett, G.H.B., Kohlhaas, K.M., Zimmey, E.J., Stach, E.A., Piner, R.D., Nguyen, S.T., Ruoff, R.S.: Graphene-based composite materials. Nature 442, 282–286 (2006)CrossRef
go back to reference Tsai, J.L., Tu, J.-F.: Characterizing mechanical properties of graphite using molecular dynamics simulation. Mater. Des. 31, 194–199 (2010)CrossRef Tsai, J.L., Tu, J.-F.: Characterizing mechanical properties of graphite using molecular dynamics simulation. Mater. Des. 31, 194–199 (2010)CrossRef
go back to reference Tserpes, K.I., Papanikos, P.: Finite element modelling of single-walled carbon nanotubes. Compos. Part B Eng. 36, 466–477 (2005)CrossRef Tserpes, K.I., Papanikos, P.: Finite element modelling of single-walled carbon nanotubes. Compos. Part B Eng. 36, 466–477 (2005)CrossRef
go back to reference Tu, Z., Ou-Yang, Z.: Single-walled and multi-walled carbon nanotubes viewed as elastic tubes with the effective Young’s moduli dependent on layer number. Phys. Rev. B 65, 233407–233410 (2002)CrossRef Tu, Z., Ou-Yang, Z.: Single-walled and multi-walled carbon nanotubes viewed as elastic tubes with the effective Young’s moduli dependent on layer number. Phys. Rev. B 65, 233407–233410 (2002)CrossRef
go back to reference Yakobson, B.I., Brabec, C.J., Bernholc, J.: Nanomechanics of nanotubes: Instabilities beyond linear response. Phys. Rev. Lett. 76(14), 2511–2514 (1996)CrossRef Yakobson, B.I., Brabec, C.J., Bernholc, J.: Nanomechanics of nanotubes: Instabilities beyond linear response. Phys. Rev. Lett. 76(14), 2511–2514 (1996)CrossRef
go back to reference Zaeri, M.M., Ziaei-Rad, S., Vahedi, A., Karimzadeh, F.: Mechanical modelling of carbon nanomaterials form nanotubes to buckpaper. Carbon 48, 3916–3930 (2010)CrossRef Zaeri, M.M., Ziaei-Rad, S., Vahedi, A., Karimzadeh, F.: Mechanical modelling of carbon nanomaterials form nanotubes to buckpaper. Carbon 48, 3916–3930 (2010)CrossRef
go back to reference Zhou, J., Huang, R.: Internal lattice relaxation of single-layer graphene under in-plane deformation. J. Mech. Phys. Solid 56, 1609–1623 (2008)MATHCrossRef Zhou, J., Huang, R.: Internal lattice relaxation of single-layer graphene under in-plane deformation. J. Mech. Phys. Solid 56, 1609–1623 (2008)MATHCrossRef
Metadata
Title
Evaluation of the in-plane effective elastic moduli of single-layered graphene sheet
Author
K. Alzebdeh
Publication date
01-09-2012
Publisher
Springer Netherlands
Published in
International Journal of Mechanics and Materials in Design / Issue 3/2012
Print ISSN: 1569-1713
Electronic ISSN: 1573-8841
DOI
https://doi.org/10.1007/s10999-012-9193-7

Other articles of this Issue 3/2012

International Journal of Mechanics and Materials in Design 3/2012 Go to the issue

Premium Partners