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Hydrogen bonding and transportation properties of water confined in the single-walled carbon nanotube in the pulse-field
Zhou, Min1; Hu, Ying1; Liu, Jian-chuan2,3,4; Cheng, Ke5; Jia, Guo-zhu1
关键词Molecular Dynamics Carbon Nanotubes Diffusivity Hydrogen Bonding
刊名CHEMICAL PHYSICS LETTERS
2017-10-16
DOI10.1016/j.cplett.2017.08.022
686页:173-177
收录类别SCI
文章类型Article
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
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.
语种英语
WOS记录号WOS:000410844000028
引用统计
文献类型期刊论文
条目标识符http://cas-ir.dicp.ac.cn/handle/321008/150035
专题中国科学院大连化学物理研究所
作者单位1.Sichuan Normal Univ, Coll Phys & Elect Engn, Chengdu 610101, Sichuan, Peoples R China
2.Chinese Acad Sci, Beijing Natl Lab Mol Sci, Inst Chem, Beijing 100190, Peoples R China
3.Chinese Acad Sci, State Key Lab Mol React Dynam, Inst Chem, Beijing 100190, Peoples R China
4.Univ Chinese Acad Sci, Beijing 100049, Peoples R China
5.Chengdu Univ Informat Technol, Coll Optoelect Technol, Chengdu 610225, Sichuan, Peoples R China
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GB/T 7714
Zhou, Min,Hu, Ying,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 Zhou, Min,Hu, Ying,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 Zhou, Min,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.
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