Sadeghzadeh Sadegh
Smart Micro/Nano Electro Mechanical Systems Lab (MNEMS), School of New Technologies, Iran University of Science and Technology, Tehran, Iran.
J Mol Graph Model. 2016 Nov;70:196-211. doi: 10.1016/j.jmgm.2016.10.001. Epub 2016 Oct 5.
A multi-scale method is employed in this paper to conduct a virtual study of the high-strain behavior of single- and multi-layer graphene sheets and to investigate the design of related graphene-based devices. By bridging the length and time scales by combining the Molecular Dynamics and Finite Element methods together, a comprehensive multiscale model is developed to study the fascinating capabilities of single- and multi-layer graphene sheets in withstanding the impact of ultrafast projectiles. In order to contribute to future developments and innovations in this field, several quantitative and qualitative comparisons are also performed. By employing the validated model, the effects of several parameters on the impact resistance efficiency of the examined sheets are evaluated. The specific penetration energy of multilayer graphene sheets is several times greater than that of metal sheets. It is demonstrated that the number of layers, aspect ratio, sheet size, interlayer distance, delamination, and projectile shape significantly influence the impact resistance of graphene sheets. The specific critical rupture velocity decreases asymptotically with the increase in the number of layers. A large-scale array of fewer graphene layers can withstand bullets of much higher velocities than a multilayer graphene sheet with equivalent weight. Finally, the coefficient of restitution for the oblique collision of gold and steel nanoparticles with multilayer graphene sheets is calculated at different impact velocities.
本文采用多尺度方法对单层和多层石墨烯片的高应变行为进行虚拟研究,并探讨相关石墨烯基器件的设计。通过将分子动力学和有限元方法结合起来,跨越长度和时间尺度,开发了一个综合多尺度模型,以研究单层和多层石墨烯片承受超快抛射体冲击的迷人能力。为了推动该领域的未来发展和创新,还进行了一些定量和定性比较。通过使用经过验证的模型,评估了几个参数对所研究薄片抗冲击效率的影响。多层石墨烯片的比穿透能量比金属片大几倍。结果表明,层数、纵横比、薄片尺寸、层间距离、分层和抛射体形状对石墨烯片的抗冲击性有显著影响。比临界破裂速度随着层数的增加而渐近降低。与具有相同重量的多层石墨烯片相比,较少层数的大规模阵列能够承受速度高得多的子弹。最后,计算了金和钢纳米粒子与多层石墨烯片斜碰撞在不同冲击速度下的恢复系数。