范德瓦尔斯力
碳纳米管
纳米线
纳米技术
堆积
材料科学
分子动力学
壳体(结构)
芯(光纤)
纳米管
化学物理
复合材料
化学
分子
计算化学
有机化学
作者
Danhui Zhang,Houbo Yang,Zhongkui Liu,Anmin Liu
标识
DOI:10.1016/j.jallcom.2018.06.182
摘要
In recent year, carbon materials have attracted an intensive interest for scientists to propel the development of nanotechnology. In this manuscript, using forced-field-based molecular dynamics simulations, the interaction between the carbon nanotubes (CNTs) and silver (Ag) nanowires (NWs) has been investigated. The results show that the Ag NW can induce the self-assembly of the CNTs to form a shell-core structure, and the van der Waals interaction and the offset face-to-face π-π stacking interaction play an important role in this process. Furthermore, the size (diameter) of the CNTs should meet some required conditions to guarantee the shell-core configuration and different surface of Ag NWs exhibits different result. Moreover, different metal nanowires were also discussed.
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