Hydrogen bonding and transportation properties of water confined in the single-walled carbon nanotube in the pulse-field

	Hydrogen bonding and transportation properties of water confined in the single-walled carbon nanotube in the pulse-field
	Hu, Ying 4; Zhou, Min 4; Liu, Jian-chuan 1,2,5; Cheng, Ke 3; Jia, Guo-zhu 4
刊名	CHEMICAL PHYSICS LETTERS
	2017-10-16
卷号	686 页码:173-177
关键词	Molecular dynamics Carbon nanotubes Diffusivity Hydrogen bonding
英文摘要	In this paper, molecular dynamics simulations were performed to investigate the transportation and hydrogen bonding dynamics of water confined in (6, 6) single-walled carbon nanotube (SWCNT) in the absence and presence of time-dependent pulse-field. The effects of pulse-field range from microwave to ultraviolet frequency on the diffusivity and hydrogen bonding of confined water were analyzed. The significant confinement effect due to the narrow space inside SWCNT was observed. (C) 2017 Published by Elsevier B.V.
WOS标题词	Science & Technology ; Physical Sciences
类目[WOS]	Chemistry, Physical ; Physics, Atomic, Molecular & Chemical
研究领域[WOS]	Chemistry ; Physics
关键词[WOS]	MOLECULAR-DYNAMICS SIMULATIONS ; ELECTRIC-FIELDS ; ICE NANOTUBES ; LIQUID WATER ; DIFFUSION ; NANORINGS ; FLOW
收录类别	SCI
语种	英语
WOS记录号	WOS:000410844000028
内容类型	期刊论文
源URL	[http://cas-ir.dicp.ac.cn/handle/321008/150035]
专题	大连化学物理研究所_中国科学院大连化学物理研究所
作者单位	1.Chinese Acad Sci, State Key Lab Mol React Dynam, Inst Chem, Beijing 100190, Peoples R China 2.Univ Chinese Acad Sci, Beijing 100049, Peoples R China 3.Chengdu Univ Informat Technol, Coll Optoelect Technol, Chengdu 610225, Sichuan, Peoples R China 4.Sichuan Normal Univ, Coll Phys & Elect Engn, Chengdu 610101, Sichuan, Peoples R China 5.Chinese Acad Sci, Beijing Natl Lab Mol Sci, Inst Chem, Beijing 100190, Peoples R China
推荐引用方式 GB/T 7714	Hu, Ying,Zhou, Min,Liu, Jian-chuan,et al. Hydrogen bonding and transportation properties of water confined in the single-walled carbon nanotube in the pulse-field[J]. CHEMICAL PHYSICS LETTERS,2017,686:173-177.
APA	Hu, Ying,Zhou, Min,Liu, Jian-chuan,Cheng, Ke,&Jia, Guo-zhu.(2017).Hydrogen bonding and transportation properties of water confined in the single-walled carbon nanotube in the pulse-field.CHEMICAL PHYSICS LETTERS,686,173-177.
MLA	Hu, Ying,et al."Hydrogen bonding and transportation properties of water confined in the single-walled carbon nanotube in the pulse-field".CHEMICAL PHYSICS LETTERS 686(2017):173-177.