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
Source PublicationJOURNAL OF CHEMICAL PHYSICS
ISSN0021-9606
Volume143Issue:11Pages:
Subtype期刊文献
AbstractThe 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.
KeywordCarbon Nanotubes Molecular-dynamics Channel Permittivity Membranes Simulations Relaxation Nanoscale Transport Proteins
Language英语
WOS IDWOS:000361843900054
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Cited Times:2[WOS]   [WOS Record]     [Related Records in WOS]
Document Type期刊论文
Identifierhttp://ir.sinap.ac.cn/handle/331007/24947
Collection中科院上海应用物理研究所2011-2018年
Corresponding AuthorQi, WP (reprint author), Chinese Acad Sci, Shanghai Inst Appl Phys, Key Lab Interfacial Phys & Technol, Shanghai 201800, Peoples R China.
Recommended Citation
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):—.
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