Hydrogen bond network in the hydration layer of the water confined in nanotubes increasing the dielectric constant parallel along the nanotube axis

CAS OpenIR > 中科院上海应用物理研究所2011-2018年

	Hydrogen bond network in the hydration layer of the water confined in nanotubes increasing the dielectric constant parallel along the nanotube axis
	Qi, WP; Zhao, HW; Qi, WP (reprint author), Chinese Acad Sci, Shanghai Inst Appl Phys, Key Lab Interfacial Phys & Technol, Shanghai 201800, Peoples R China.
	2015
发表期刊	JOURNAL OF CHEMICAL PHYSICS
ISSN	0021-9606
卷号	143 期号:11 页码:—
文章类型	期刊文献
摘要	The water confined in nanotubes has been extensively studied, because of the potential usages in drug delivery and desalination. The radial distribution of the dielectric constant parallel along the nanotube axis was obtained by molecular dynamics simulations in a carbon nanotube and a nanotube with a very small van der Waals potential. The confined water was divided into two parts, the middle part water and the hydration water. In both cases, the hydrogen bond orientation of the middle water is isotropic, while the hydrogen bonds in hydration layers are apt to parallel along the nanotube axis. Therefore, the hydration water has higher dipole correlations increasing the dielectric constant along the nanotube axis. (C) 2015 AIP Publishing LLC.
关键词	Carbon Nanotubes Molecular-dynamics Channel Permittivity Membranes Simulations Relaxation Nanoscale Transport Proteins
语种	英语
WOS记录号	WOS:000361843900054
引用统计
文献类型	期刊论文
条目标识符	http://ir.sinap.ac.cn/handle/331007/24947
专题	中科院上海应用物理研究所2011-2018年
通讯作者	Qi, WP (reprint author), Chinese Acad Sci, Shanghai Inst Appl Phys, Key Lab Interfacial Phys & Technol, Shanghai 201800, Peoples R China.
推荐引用方式 GB/T 7714	Qi, WP,Zhao, HW,Qi, WP . Hydrogen bond network in the hydration layer of the water confined in nanotubes increasing the dielectric constant parallel along the nanotube axis[J]. JOURNAL OF CHEMICAL PHYSICS,2015,143(11):—.
APA	Qi, WP,Zhao, HW,&Qi, WP .(2015).Hydrogen bond network in the hydration layer of the water confined in nanotubes increasing the dielectric constant parallel along the nanotube axis.JOURNAL OF CHEMICAL PHYSICS,143(11),—.
MLA	Qi, WP,et al."Hydrogen bond network in the hydration layer of the water confined in nanotubes increasing the dielectric constant parallel along the nanotube axis".JOURNAL OF CHEMICAL PHYSICS 143.11(2015):—.

条目包含的文件
文件名称/大小	文献类型	版本类型	开放类型	使用许可
Hydrogen bond networ（2467KB）	期刊论文	作者接受稿	开放获取	CC BY-NC-SA	请求全文