Molecular dynamics simulation of an argon cluster filled inside carbon nanotubes

IMECH-IR > 微重力重点实验室

	Molecular dynamics simulation of an argon cluster filled inside carbon nanotubes
	Cui SW(崔树稳); Zhu RC(朱如曾); Wang XS; Yang HX; Zhu, RZ (reprint author), Chinese Acad Sci, Inst Mech, State Key Lab Nonlinear Mech LNM, Beijing 100190, Peoples R China.
发表期刊	Chinese Physics B
	2014-10
卷号	23 期号:10 页码:106105
ISSN	1674-1056
摘要	The effects of the diameters of single-walled carbon nanotubes (SWCNTs) (7.83 angstrom to 27.40 angstrom) and temperature (20 K-45 K) on the equilibrium structure of an argon cluster are systematically studied by molecular dynamics simulation with consideration of the SWCNTs to be fixed. Since the diameters of SWCNTs with different chiralities increase when temperature is fixed at 20 K, the equilibrium structures of the argon cluster transform from monoatomic chains to helical and then to multishell coaxial cylinders. Chirality has almost no noticeable influence on these cylindrosymmetric structures. The effects of temperature and a non-equilibrium sudden heating process on the structures of argon clusters in SWCNTs are also studied by molecular dynamics simulation.
关键词	Carbon Nanotubes Argon Cluster Molecular Dynamics Simulation
URL	查看原文
收录类别	SCI ; EI ; CSCD
语种	英语
WOS记录号	WOS:000344057600060
项目资助者	Project supported by the National Natural Science Foundation of China (Grant No. 11072242).
论文分区	二类/Q2
引用统计	被引频次：4[WOS] [WOS记录] [WOS相关记录]
文献类型	期刊论文
条目标识符	http://dspace.imech.ac.cn/handle/311007/49337
专题	微重力重点实验室
通讯作者	Zhu, RZ (reprint author), Chinese Acad Sci, Inst Mech, State Key Lab Nonlinear Mech LNM, Beijing 100190, Peoples R China.
推荐引用方式 GB/T 7714	Cui SW,Zhu RC,Wang XS,et al. Molecular dynamics simulation of an argon cluster filled inside carbon nanotubes[J]. Chinese Physics B,2014,23,10,:106105.
APA	Cui SW,Zhu RC,Wang XS,Yang HX,&Zhu, RZ .(2014).Molecular dynamics simulation of an argon cluster filled inside carbon nanotubes.Chinese Physics B,23(10),106105.
MLA	Cui SW,et al."Molecular dynamics simulation of an argon cluster filled inside carbon nanotubes".Chinese Physics B 23.10(2014):106105.

条目包含的文件		下载所有文件
文件名称/大小	文献类型	版本类型	开放类型	使用许可
IMCAS-J2014-278.pdf（1748KB）			开放获取	--	浏览下载