Molecular dynamics study of a CNT-buckyball-enabled energy absorption system.

An energy absorption system (EAS) composed of a carbon nanotube (CNT) with nested buckyballs is put forward for energy dissipation during impact owing to the outstanding mechanical properties of both CNTs and buckyballs. Here we implement a series of molecular dynamics (MD) simulations to investigate the energy absorption capabilities of several different EASs based on a variety of design parameters. For example, the effects of impact energy, the number of nested buckyballs, and of the size of the buckyballs are analyzed to optimize the energy absorption capability of the EASs by tuning the relevant design parameters. Simulation results indicate that the energy absorption capability of the EAS is closely associated with the deformation characteristics of the confined buckyballs. A low impact energy leads to recoverable deformation of the buckyballs and the dissipated energy is mainly converted to thermal energy. However, a high impact energy yields non-recoverable deformation of buckyballs and thus the energy dissipation is dominated by the strain energy of the EAS. The simulation results also reveal that there exists an optimal value of the number of buckyballs for an EAS under a certain impact energy. Larger buckyballs are able to deform to a larger degree yet also need less impact energy to induce plastic deformation, therefore performing with a better overall energy absorption ability. Overall, the EAS in this study shows a remarkably high energy absorption density of 2 kJ g(-1), it is a promising candidate for mitigating impact energy and sheds light on the research of buckyball-filled CNTs for other applications.

[1]  Z. Guan,et al.  The energy-absorption characteristics of metal tube-reinforced polymer foams , 2015 .

[2]  David P. Thambiratnam,et al.  Impact and energy absorption of portable water-filled road safety barrier system fitted with foam , 2014 .

[3]  Xiaomiao Cao,et al.  Cell structure and impact properties of foamed polystyrene in constrained conditions using supercritical carbon dioxide , 2014, Iranian Polymer Journal.

[4]  Xianqiao Wang,et al.  Molecular Dynamics Study of Programmable Nanoporous Graphene , 2014 .

[5]  C. Daraio,et al.  Geometry‐Induced Mechanical Properties of Carbon Nanotube Foams , 2014 .

[6]  Guanghong Wei,et al.  The molecular mechanism of fullerene-inhibited aggregation of Alzheimer's β-amyloid peptide fragment. , 2014, Nanoscale.

[7]  O. V. Kharissova,et al.  Variations of interlayer spacing in carbon nanotubes , 2014 .

[8]  N. Merah,et al.  Impact behavior and finite element prediction of the compression after impact strength of foam/vinylester-glass composite sandwiches , 2014 .

[9]  P. Cachim,et al.  Mechanics of filled carbon nanotubes , 2014 .

[10]  Weidong Wu,et al.  Nano-epoxy resins containing electrospun carbon nanofibers and the resulting hybrid multi-scale composites , 2014 .

[11]  S. Balawi,et al.  Geometrical effects in the impact response of the aluminium honeycomb sandwich structures , 2014 .

[12]  J. Njuguna,et al.  Effect of nanofillers on low energy impact performance of sandwich structures with nanoreinforced polyurethane foam cores , 2014 .

[13]  Rong Xiang,et al.  Three‐Dimensional Carbon Nanotube Sponge‐Array Architectures with High Energy Dissipation , 2014, Advanced materials.

[14]  Amélie Kolopp,et al.  Experimental study of sandwich structures as armour against medium-velocity impacts , 2013 .

[15]  Tongming Huang,et al.  Microwave sintering carbon nanotube/Ni0.5Zn0.5Fe2O4 composites and their electromagnetic performance , 2013 .

[16]  J. Koplik,et al.  Attenuation of shock waves propagating through nano-structured porous materials , 2013 .

[17]  G. Vignaud,et al.  Eco-friendly conductive polymer nanocomposites (CPC) for solar absorbers design , 2013 .

[18]  H. Shodja,et al.  Mechanics and morphology of single-walled carbon nanotubes: from graphene to the elastica , 2013 .

[19]  Yibing Li,et al.  A Super Energy Mitigation Nanostructure at High Impact Speed Based on Buckyball System , 2013, PloS one.

[20]  Yuming Cui,et al.  One-pot synthesis of α-Fe2O3 nanospheres by solvothermal method , 2013, Nanoscale Research Letters.

[21]  J. Reddy,et al.  Multiscale analysis of impact mitigation in soft tissues using nanotube reinforced composites , 2013 .

[22]  Jun Xu,et al.  Molecular dynamics simulation of impact response of buckyballs , 2013 .

[23]  Hailong Liu,et al.  Interaction between Mechanical Wave and Nanoporous Energy Absorption System , 2013 .

[24]  D. M. Anjos,et al.  Inelastic neutron scattering, Raman and DFT investigations of the adsorption of phenanthrenequinone on onion-like carbon , 2013 .

[25]  J. González,et al.  Transport properties of two finite armchair graphene nanoribbons , 2013, Nanoscale Research Letters.

[26]  Steven Marguet,et al.  Modeling of Impacts on Sandwich Structures , 2012 .

[27]  G. Cao.  Working Mechanism of Nanoporous Energy Absorption System under High Speed Loading , 2012 .

[28]  Xianqiao Wang,et al.  Simulation of collisions between buckyballs and graphene sheets , 2012 .

[29]  V. Zaporojtchenko,et al.  Vapor Phase Deposition, Structure, and Plasmonic Properties of Polymer-Based Composites Containing Ag–Cu Bimetallic Nanoparticles , 2012, Plasmonics.

[30]  D. Mielewski,et al.  Rate dependencies and energy absorption characteristics of nanoreinforced, biofiber, and microcellular polymer composites , 2011 .

[31]  W. Ma,et al.  Macroscopic carbon nanotube assemblies: preparation, properties, and potential applications. , 2011, Small.

[32]  David Bono,et al.  Acoustic energy absorption in Ni–Mn–Ga/polymer composites , 2011 .

[33]  E. Barbero,et al.  Behavior of sandwich structures and spaced plates subjected to high‐velocity impacts , 2011 .

[34]  V. Zaporojtchenko,et al.  Preparation and plasmonic properties of polymer-based composites containing Ag–Au alloy nanoparticles produced by vapor phase co-deposition , 2010 .

[35]  C. Wang,et al.  Recent Studies on Buckling of Carbon Nanotubes , 2010 .

[36]  Faramarz Gordaninejad,et al.  Energy absorption capability of nanocomposites: A review , 2009 .

[37]  Y. Bando,et al.  The mechanical response of turbostratic carbon nanotubes filled with Ga-doped ZnS: II. Slenderness ratio and crystalline filling effects , 2009, Nanotechnology.

[38]  Y. Bando,et al.  Effect of crystalline filling on the mechanical response of carbon nanotubes , 2009 .

[39]  B. Büchner,et al.  Iron-filled carbon nanotubes as probes for magnetic force microscopy , 2008 .

[40]  N. Kaur,et al.  Behaviour of a bucky-ball under extreme internal and external pressures , 2006, cond-mat/0610007.

[41]  J. Viana.  Polymeric materials for impact and energy dissipation , 2006 .

[42]  Y. Liu,et al.  Compressive behavior and energy absorption of metal porous polymer composite with interpenetrating network structure , 2006 .

[43]  Tongxi Yu,et al.  Crushing of thin-walled spheres and sphere arrays , 2006 .

[44]  Nik Petrinic,et al.  Axial crushing of metal foam-filled square columns: Foam density distribution and impactor inclination effects , 2005 .

[45]  Y. Qiao,et al.  Energy absorption of a nanoporous system subjected to dynamic loadings , 2005 .

[46]  S. Allen,et al.  Large energy absorption in Ni-Mn-Ga/polymer composites , 2005 .

[47]  Arcady Dyskin,et al.  Interlocking properties of buckyballs , 2003 .

[48]  J. M. Starbuck,et al.  New Test method for determining energy absorption mechanisms in polymer composite plates , 2003 .

[49]  John W. Gillespie,et al.  Dynamics of metal foam deformation during Taylor cylinder–Hopkinson bar impact experiment , 2003 .

[50]  Miroslav Hodak,et al.  Van der Waals binding energies in graphitic structures , 2002 .

[51]  Donald W. Brenner,et al.  A second-generation reactive empirical bond order (REBO) potential energy expression for hydrocarbons , 2002 .

[52]  Riichiro Saito,et al.  Anomalous potential barrier of double-wall carbon nanotube , 2001 .

[53]  T. Chou,et al.  Advances in the science and technology of carbon nanotubes and their composites: a review , 2001 .

[54]  S. Stuart,et al.  A reactive potential for hydrocarbons with intermolecular interactions , 2000 .

[55]  S. Ramakrishna.  MICROSTRUCTURAL DESIGN OF COMPOSITE MATERIALS FOR CRASHWORTHY STRUCTURAL APPLICATIONS , 1997 .

[56]  Z. Man,et al.  The rebounding of C60 on graphite surface: a molecular dynamics simulation , 1995 .

[57]  S. Kozyrev,et al.  Fullerene: Structure, crystal lattice dynamics, electron structure, and properties (a review) , 1993 .

[58]  Roger Smith,et al.  Energetic fullerene interactions with a graphite surface , 1993, Proceedings of the Royal Society of London. Series A: Mathematical and Physical Sciences.

[59]  Steve Plimpton,et al.  Fast parallel algorithms for short-range molecular dynamics , 1993 .

[60]  Rodney S. Ruoff,et al.  The bulk modulus of C60 molecules and crystals: A molecular mechanics approach , 1991 .

[61]  Jinsong Leng,et al.  Shape memory polymer/CNT composites and their microwave induced shape memory behaviors , 2014 .

[62]  Linfeng Hu,et al.  Synthesis of CNT/In2O3 Nanocomposite by Sol-Gel Method and Its Photocatalytic Property , 2013 .

[63]  W. Abramowicz,et al.  Axial crushing of foam-filled columns , 1988 .