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Ice-like water structure in carbon nanotube (8,8) induces cationic hydration enhancement

He, Zhongjin; Zhou, Jian; Lu, Xiaohua; Corry, Ben

Description

It is well recognized that ice-like water can be formed in carbon nanotubes (CNTs). Here, we perform molecular dynamics simulations of the hydration of Na+, K+ and Cl- in armchair CNT(n,n) (n = 6, 7, 8, 9 and 10) at 300 K to elucidate the effect of such w

CollectionsANU Research Publications
Date published: 2013
Type: Journal article
URI: http://hdl.handle.net/1885/72842
Source: Journal of Physical Chemistry C
DOI: 10.1021/jp4025206

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