Litcius/Paper detail

High impact resistance in graphyne

Yang Yang, Qiang Cao, Yang Gao, Shuting Lei, Sheng Liu, Qing Peng

2020RSC Advances15 citationsDOIOpen Access PDF

Abstract

Graphyne was recently facilely synthesized with superior mechanical and electrical performance. We investigate the ballistic protection properties of α-, β-, δ-, and γ-graphyne sheets using molecular dynamics simulations in conjunction with elastic theory. The velocities of the in-plane elastic wave and out-of-plane cone wave are obtained by both membrane theory and molecular dynamics simulations. The specific penetration energies are approximately 83% that of graphene, indicating high impact resistance. γ-Graphyne has high sound wave speeds comparable to those of graphene, and its Young's modulus is approximately 60% that of graphene. δ-Graphyne has the highest cone wave speed among the four structures, while α-graphyne possesses the highest penetration energy and impact resistance at most tested projectile speeds. Our results indicate that graphyne is a good protective structural material.

Topics & Concepts

GraphyneGrapheneProjectileMaterials scienceMolecular dynamicsPenetration (warfare)ModulusComposite materialNanotechnologyComputational chemistryChemistryMetallurgyEngineeringOperations researchGraphene research and applicationsCarbon Nanotubes in CompositesIon-surface interactions and analysis