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Author:

Liu Jia (Liu Jia.) | Yang Qingsheng (Yang Qingsheng.) (Scholars:杨庆生)

Indexed by:

CPCI-S Scopus

Abstract:

The pull-out process of the carbon nanotube from polyethylene was simulated by molecular dynamics method. A model of a carbon nanotube in polyethylene was established. In the simulation, Adaptive Intermolecular Reactive Empirical Bond Order(ARIEBO) potential was adopted to describe the interaction of C-C and C-H in the carbon nanotube and polymer, and Lennard-Jones pair potential was used to describe the interaction between the carbon nanotube and polymer; NVT ensemble was adopted in the whole simulation and Nose-Hoover method was used to control the temperature at absolute zero, which avoided the influence induced by thermal activation; Verlet algorithm was used to solve molecular dynamics equations in the procedure of simulation. The deformation and forces on interfaces between the carbon nanotube and polymer was analyzed by simulating the process of pulling-out of the carbon nanotube from polyethylene.

Keyword:

molecular dynamics potential function polyethylene carbon nanotube

Author Community:

  • [ 1 ] [Liu Jia]Beijing Univ Technol, Dept Engn Mech, Beijing 100124, Peoples R China
  • [ 2 ] [Yang Qingsheng]Beijing Univ Technol, Dept Engn Mech, Beijing 100124, Peoples R China

Reprint Author's Address:

  • [Liu Jia]Beijing Univ Technol, Dept Engn Mech, Beijing 100124, Peoples R China

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Source :

8TH CHINA INTERNATIONAL NANOSCIENCE AND TECHNOLOGY SYMPOSIUM (CINSTS09)

ISSN: 1742-6588

Year: 2009

Volume: 188

Language: English

Cited Count:

WoS CC Cited Count: 7

SCOPUS Cited Count: 9

ESI Highly Cited Papers on the List: 0 Unfold All

WanFang Cited Count:

Chinese Cited Count:

30 Days PV: 11

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