Single-edge crack growth in graphene sheets under tension

作者: Minh-Quy Le , Romesh C. Batra

DOI: 10.1016/J.COMMATSCI.2012.11.057

关键词: Materials scienceStrain (chemistry)GrapheneEdge (geometry)Tension (physics)Composite materialMolecular dynamicsCrack initiationStrain rateFracture (geology)Crystallography

摘要: Abstract We use molecular dynamics simulations to study crack initiation and propagation in pre-cracked single layer arm chair graphene sheets deformed simple tension by prescribing axial velocities atoms at one edge keeping the other fixed. It is found that value of J-integral depends upon length, for each initial length it increases with an increase length. Shorter cracks are propagate faster than longer but shorter begin propagating higher values strain cracks. Results computed rates 2.6 × 106, 2.6 × 107 2.6 × 108 s−1 reveal essentially same first two different third rate even though response pristine sheet three rates.

参考文章(25)
D. Li, R. B. Kaner, Graphene-based materials Science. ,vol. 320, pp. 1170- 1171 ,(2013) , 10.1126/SCIENCE.1158180
Traian Dumitrică, Ted Belytschko, Boris I. Yakobson, Bond-breaking bifurcation states in carbon nanotube fracture Journal of Chemical Physics. ,vol. 118, pp. 9485- 9488 ,(2003) , 10.1063/1.1577540
Fang Liu, Pingbing Ming, Ju Li, Ab initio calculation of ideal strength and phonon instability of graphene under tension Physical Review B. ,vol. 76, pp. 064120- ,(2007) , 10.1103/PHYSREVB.76.064120
M Buongiorno Nardelli, J.-L Fattebert, D Orlikowski, C Roland, Q Zhao, J Bernholc, Mechanical properties, defects and electronic behavior of carbon nanotubes Carbon. ,vol. 38, pp. 1703- 1711 ,(2000) , 10.1016/S0008-6223(99)00291-2
K.I. Bolotin, K.J. Sikes, Z. Jiang, M. Klima, G. Fudenberg, J. Hone, P. Kim, H.L. Stormer, Ultrahigh electron mobility in suspended graphene Solid State Communications. ,vol. 146, pp. 351- 355 ,(2008) , 10.1016/J.SSC.2008.02.024
Fenghua Zhou, Jean-François Molinari, Tadashi Shioya, A rate-dependent cohesive model for simulating dynamic crack propagation in brittle materials Engineering Fracture Mechanics. ,vol. 72, pp. 1383- 1410 ,(2005) , 10.1016/J.ENGFRACMECH.2004.10.011
Farid F. Abraham, Huajian Gao, How fast can cracks propagate Physical Review Letters. ,vol. 84, pp. 3113- 3116 ,(2000) , 10.1103/PHYSREVLETT.84.3113
Roland S. Lee, L. A. Girifalco, Miroslav Hodak, Carbon nanotubes, buckyballs, ropes, and a universal graphitic potential Physical Review B. ,vol. 62, pp. 13104- 13110 ,(2000) , 10.1103/PHYSREVB.62.13104
C. Lee, X. Wei, J. W. Kysar, J. Hone, Measurement of the Elastic Properties and Intrinsic Strength of Monolayer Graphene Science. ,vol. 321, pp. 385- 388 ,(2008) , 10.1126/SCIENCE.1157996