Mechanism of thermal conductivity reduction from suspended to supported graphene: A quantitative spectral analysis of phonon scattering

ASME 2011 International Mechanical Engineering Congress and Exposition, IMECE 2011

Volumn 10, Issue PARTS A AND B, 2011, Pages 303-313

  Qiu, Bo ^a   Ruan, Xiulin ^a  

^a PURDUE UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

GRAPHENE; MOLECULAR DYNAMICS; PHONONS; SPECTRUM ANALYSIS; TEMPERATURE DISTRIBUTION; THERMOELECTRICITY;

LATTICE THERMAL CONDUCTIVITY; MOLECULAR DYNAMICS SIMULATIONS; PHONON MEAN FREE PATH; SPECTRAL ENERGY DENSITY; SUSPENDED GRAPHENE; TEMPERATURE DEPENDENCE; THERMAL CONDUCTIVITY REDUCTIONS; THERMAL TRANSPORT;

THERMAL CONDUCTIVITY;

EID: 84869158266     PISSN: None     EISSN: None     Source Type: Conference Proceeding    
DOI: 10.1115/imece2011-62963     Document Type: Conference Paper

References (56)

1. Novoselov, K. S., Geim, A. K., Morozov, S. V., Jiang, D., Zhang, Y., Dubonos, S. V., Grigorieva, I. V., and Firsov, A. A., 2004. "Electric field effect in atomically thin carbon films". Science, 306, p. 666.
2. Bolotin, K. I., Sikes, K. J., Jiang, Z., Klim, M., Fudenberg, G., Hone, J., Kim, P., and Stormer, H. L., 2008. "Ultrahigh electron mobility in suspended graphene". Solid State Comm., 146, p. 351.
3. Geim, A. K., and Novoselov, K. S., 2007. "The rise of graphene". Nature Mater., 6, p. 183.
4. Lee, C., Wei, X., Kysar, J. W., and Hone, J., 2008. "Measurement of the elastic properties and intrinsic strength of monolayer graphene". Science, 321, p. 385.
5. Balandin, A. A., Ghosh, S., Bao, W., Calizo, I., Teweldebrhan, D., Miao, F., and Lau, C. N., 2008. "Superior thermal conductivity of single-layer graphene". Nano Lett., 8, p. 902.
6. Cai, W., Moore, A. L., Zhu, Y., Li, X., Chen, S., Shi, L., and Ruoff, R. S., 2010. "Thermal transport in suspended and supported monolayer graphene grown by chemical vapor deposition". Nano Lett., 10, p. 1645.
7. Teweldebrhan, D., Goyal, V., and Balandin, A. A., 2008. "Superior thermal conductivity of single-layer graphene". Nano Lett., 8, p. 902.
8. Ghosh, S., Bao, W., Nika, D. L., Subrina, S., Pokatilov, E. P., Lau, C. N., and Balandin, A. A., 2010. "Dimensional crossover of thermal transport in few-layer graphene". Nature Materials, 9, p. 555.
9. 3 thin films: a molecular dynamics study". Appl. Phys. Lett., 97, p. 183107.
10. Goodson, K. E., and Ju, Y. S., 1999. "Heat conduction in novel electronic films". Annu. Rev. Mater. Sci., 29, p. 261.
11. Balandin, A. A., 2011. "Thermal properties of graphene, carbon nanotubes and nanostructured carbon materials". Nature Mater., 10, p. 569.
12. Basile, G., Bernardin, C., and Olla, S., 2006. "Momentum conversion model with anomalous thermal conductivity in low dimensional system". Phys. Rev. Lett., 96, p. 204303.
13. Lee, J.-U., Yoon, D., Kim, H., Lee, S. W., and Cheong, H., 2011. "Thermal conductivity of suspended pristine graphene measured by raman spectroscopy". Phys. Rev. B, 83, p. 081419(R).
14. Seol, J. H., Jo, I., Moore, A. L., Lindsay, L., Aitken, Z. H., Pettes, M. T., Li, X., Yao, Z., Huang, R., Broido, D., Mingo, N., Ruoff, R. S., and Shi, L., 2010. "Two-dimensional phonon transport in supported graphene". Science, 328, p. 213.
15. Hu, J., Ruan, X., and Chen, Y. P., 2009. "Thermal conductivity and thermal rectification in graphene nanoribbons: a molecular dynamics study". Nano Lett., 9, p. 2730.
16. Guo, Z., Zhang, D., and Gong, X. G., 2009. "Thermal conductivity of graphene nanoribbons". Appl. Phys. Lett., 95, p. 163103.
17. Lindsay, L., Broido, D. A., and Mingo, N., 2010. "Flexural phonons and thermal transport in graphene". Phys. Rev. B, 82, p. 115427.
18. Tan, Z. W., Wang, J.-S., and Gan, C. K., 2011. "First-principles study of heat transport properties of graphene nanoribbons". Nano Lett., 11, p. 214.
19. Nika, D. L., Pokatilov, E. P., Askerov, A. S., and Balandin, A. A., 2009. "Phonon thermal conduction in graphene: Role of umklapp and edge roughness scattering". Phys. Rev. B, 79, p. 155413.
20. Klemens, P. G., 2000. "Theory of the a-plane thermal conductivity of graphite". J. Wide Bandgap Mater., 7, p. 332.
21. Plimpton, S., 1995. "Fast parallel algorithms for short-range molecular dynamics". J. Comp. Phys., 117, p. 1.
22. Lindsay, L., and Broido, D. A., 2010. "Optimized tersoff and brenner empirical potential parameters for lattice dynamics and phonon thermal transport in carbon nanotubes and graphene". Phys. Rev. B, 81, p. 205441.
23. Tersoff, J., 1989. "Modeling solid-state chemistry: Interatomic potentials for multicomponent systems". Phys. Rev. B, 39, p. 5566.
24. Rappe, A. K., Casewit, C. J., Colwell, K. S., Goddard, W. A., and Skiff, W. M., 1992. "Uff, a full periodic table force field for molecular mechanics and molecular dynamics simulations". J. Am. Chem. Soc., 114, p. 10024.
25. Vallabhaneni, A. K., Qiu, B., Hu, J., Chen, Y. P., and Ruan, X., 2011. "Interfacial thermal conductance of vertical graphene nanoribbon on a silicon substrate". in preparation.
26. Orellana, W., 2008. "Stability and bonding properties of finite single-walled carbon nanotubes adsorbed on si(001)". Appl. Phys. Lett., 92, p. 093109.
27. Thomas, J. A., Turney, J. E., Iutzi, R. M., Amon, C. H., and McGaughey, A. J. H., 2010. "Predicting phonon dispersion relations and lifetimes from the spectral energy density". Phys. Rev. B, 81, p. 081411.
28. Ladd, A. J. C., Moran, B., and Hoover, W. G., 1986. "Lattice thermal conductivity: A comparison of molecular dynamics and anharmonic lattice dynamics". Phys. Rev. B, 34, p. 5058.
29. McGaughey, A. J. H., and Kaviany, M., 2004. "Quantitative validation of the boltzmann transport equation phonon thermal conductivity model under the single-mode relaxation time approximation". Phys. Rev. B., 69, p. 094303.
30. Turney, J. E., Landry, E. S., McGaughey, A. J. H., and Amon, C. H., 2009. "Predicting phonon properties and thermal conductivity from anharmonic lattice dynamics calculations and molecular dynamics simulations". Phys. Rev. B, 79, p. 064301.
31. Henry, A. S., and Chen, G., 2008. "Spectral phonon transport properties of silicon based on molecular dynamics simulations and lattice dynamics". J. Comput. Theor. Nanosci., 5, p. 1.
32. Henry, A. S., and Chen, G., 2009. "Anomalous heat conduction in polyethylene chains: Theory and molecular dynamics simulations". Phys. Rev. B, 79, p. 144305.
33. de. Koker, N., 2009. "Thermal conductivity of mgo peri-clase from equilibrium first principles molecular dynamics". Phys. Rev. Lett., 103, p. 125902.
34. Shiomi, J., and Maruyama, S., 2006. "Non-fourier heat conduction in a single-walled carbon nanotube: Classical molecular dynamics simulations". Phys. Rev. B, 73, p. 205420.
35. Turney, J. E., Thomas, J. A., McGaughey, A. J. H., and Amon, C. H., 2011. "Predicting phonon properties from molecular dynamics simulation using the spectral energy density". ASME/JSME 9th Thermal Engineering Joint Conference, pp. AJTEC2011-44315.
36. Ashcroft, N. W., and Mermin, N. D., 1976. Solid State Physics. Brooks Cole.
37. Wang, Z. K., Lim, H. S., Ng, S. C., Ozyilmaz, B., and Kuok, M. H., 2008. "Brillouin scattering study of low-frequency bulk acoustic phonons in multilayer graphene". Carbon, 46, p. 2133.
38. Wang, Z., Xie, R., Bui, C. T., Liu, D., Ni, X., Li, B., and Thong, J. T. L., 2011. "Thermal transport in suspended and supported few-layer graphene". Nano Lett., 11, p. 113.
39. Kang, K., Abdula, D., Cahill, D. G., and Shim, M., 2010. "Lifetimes of optical phonons in graphene and graphite by time-resolved incoherent anti-stokes raman scattering". Phys. Rev. B, 81, p. 165405.
40. Wang, H., Strait, J. H., George, P. A., Shivaraman, S., Shields, V. B., Chandrashekhar, M., Hwang, J., Rana, F., Spencer, M. G., Ruiz-Vargas, C. S., and Park, J., 2010. "Ultrafast relaxation dynamics of hot optical phonons in graphene". Appl. Phys. Lett., 96, p. 081917.
41. Calizo, I., Bao, W., Miao, F., Lau, C. N., and Balandin, A. A., 2007. "The effect of substrates on the raman spectrum of graphene: Grapheneon-sapphire and graphene-on-glass". Appl. Phys. Lett., 91, p. 201904.
42. Faugeras, C., Faugeras, B., Orlita, M., Potemski, M., Nair, R. R., and Geim, A. K., 2010. "Thermal conductivity of graphene in corbino membrane geometry". ACS Nano, 4, p. 1889.
43. Singh, D., Murthy, J. Y., and Fisher, T. S., 2011. "Mechanism of thermal conductivity reduction in few-layer graphene". arXiv:1104.4964v1.
44. McQuarrie, D. A., 2000. Statistical Mechanics. University Science Books, Sausalito.
45. Mingo, N., and Broido, D. A., 2005. "Length dependence of carbon nanotube thermal conductivity and the problem of long waves". Nano Lett., 5, p. 1221.
46. Berber, S., Kwon, Y.-K., and Tomanek, D., 2000. "Heat conduction in novel electronic films". Phys. Rev. Lett., 84, p. 4613.
47. Lukes, J. R., and Zhong, H., 2007. "Thermal conductivity of individual single-wall carbon nanotubes". J. Heat Transfer, 129, p. 705.
48. Yu, C., Shi, L., Yao, Z., Li, D., and Majumdar, A., 2005. "Thermal conductance and thermopower of an individual single-wall carbon nanotube". Nano Lett., 5, p. 1842.
49. Lindsay, L., Broido, D. A., and Mingo, N., 2010. "Diameter dependence of carbon nanotube thermal conductivity and extension to the graphene limit". Phys. Rev. B, 82, p. 161402(R).
50. Fujii, M., Zhang, X., Xie, H., Ago, H., Takahashi, K., Ikuta, T., Abe, H., and Shimizu, T., 2005. "Measuring the thermal conductivity of a single carbon nanotube". Phys. Rev. Lett., 95, p. 065502.
51. Pop, E., Mann, D., Wang, Q., Goodson, K., and Dai, H., 2006. "Thermal conductance of an individual single-wall carbon nanotube above room temperature". Nano Lett., 6, p. 96.
52. Huang, P. Y., Ruiz-Vargas, C. S., van der Zande, A. M., Whitney, W. S., Levendorf, M. P., Kevek, J. W., Garg, S., Alden, J. S., Hustedt, C. J., Zhu, Y., Park, J., McEuen, P. L., and Muller, D. A., 2011. "Grains and grain boundaries in single-layer graphene atomic patchwork quilts". Nature, 469, p. 389.
53. Turney, J. E., McGaughey, A. J. H., and Amon, C. H., 2009. "Assessing the applicability of quantum corrections to classical thermal conductivity predictions". Phys. Rev. B, 79, p. 224305.
54. Qiu, B., Sun, L., and Ruan, X., 2011. "Lattice thermal conductivity reduction in bi2te3 quantum wires with smooth and rough surfaces: A molecular dynamics study". Phys. Rev. B, 83, p. 035312.
55. Mattausch, A., and Pankratov, O., 2007. "Ab initio study of graphene on sic". Phys. Rev. Lett., 99, p. 076802.
56. Brenner, D. W., Shenderova, O. A., Harrison, J. A., Stuart, S. J., Ni, B., and Sinnott, S. B., 2002. "A second-generation reactive empirical bond order (rebo) potential energy expression for hydrocarbons". J Physics: Condensed Matter, 14, p. 783.