Investigation on single carbon atom transporting through the single-walled carbon nanotube by MD simulation

DING Yinfeng ZHANG Zhibin KE Xuezhi ZHU Zhiyuan ZHU Dezhang WANG Zhenxia XU Hongjie

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Investigation on single carbon atom transporting through the single-walled carbon nanotube by MD simulation

更新时间：2021-03-12

- Investigation on single carbon atom transporting through the single-walled carbon nanotube by MD simulation
- NUCLEAR TECHNIQUES Issue 4, (2005)
- 作者机构：
  
  1. 中国科学院上海应用物理研究所核分析技术实验室
  2. 中国科学院上海应用物理研究所核分析技术实验室,上海,201800
- 作者简介：
- 基金信息：
  
  中国科学院重大创新课题“微束在团簇中的输运机制及相关效应研究”资助
- DOI：
  CLC： O562
- Published：01 April 2005
- 稿件说明：
移动端阅览
[1]丁印锋,张志滨,柯学志,朱志远,朱德彰,王震遐,徐洪杰.低能碳原子通过单壁碳纳米管的计算机模拟研究[J].核技术,2005(04):301-304.

DING Yinfeng ZHANG Zhibin KE Xuezhi ZHU Zhiyuan ZHU Dezhang WANG Zhenxia XU Hongjie. Investigation on single carbon atom transporting through the single-walled carbon nanotube by MD simulation[J]. Nuclear techniques, 2005, (4): 301-304.
[1]丁印锋,张志滨,柯学志,朱志远,朱德彰,王震遐,徐洪杰.低能碳原子通过单壁碳纳米管的计算机模拟研究[J].核技术,2005(04):301-304. DOI：

DING Yinfeng ZHANG Zhibin KE Xuezhi ZHU Zhiyuan ZHU Dezhang WANG Zhenxia XU Hongjie. Investigation on single carbon atom transporting through the single-walled carbon nanotube by MD simulation[J]. Nuclear techniques, 2005, (4): 301-304. DOI：

摘要

利用分子动力学（MD）模拟对低能碳原子通过单壁碳纳米管的运动轨迹进行了研究。通过改变不同的入射条件

得出粒子在横向平面和三维空间中的运动轨迹

结果表明:在满足一定的入射条件时

粒子在单壁碳纳米管中作受制约的运动或作折线或作螺旋线式的运动。

Abstract

The single carbon atom transporting through the single-walled carbon nanotube has been studied by molecular-dynamics (MD) simulation. We got different trajectories of the carbon atom by changing the input parameters. The simulation results indicate that the single carbon atom with low energy can transport through the carbon nanotube under some input conditions and result in different trajectories being straight line or “rosette” or circular.

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