Spontaneous Spatiotemporal Ordering of Single-File Water Flow in Narrow Nanotubes

被引:0
|
作者
Wang, Yangjie [1 ,2 ]
Lu, Yangchao [2 ]
Chen, Jige [1 ,2 ,3 ]
机构
[1] Chinese Acad Sci, Shanghai Adv Res Inst, Shanghai 201210, Peoples R China
[2] Chinese Acad Sci, Shanghai Inst Appl Phys, Shanghai 201800, Peoples R China
[3] Univ Chinese Acad Sci, Beijing 100049, Peoples R China
来源
JOURNAL OF PHYSICAL CHEMISTRY C | 2024年 / 128卷 / 30期
基金
上海市自然科学基金;
关键词
ENHANCEMENT; DIFFUSION; HEAT; SELECTIVITY; PERMEATION; MOLECULES; MECHANISM; DYNAMICS; CHANNEL;
D O I
10.1021/acs.jpcc.4c01214
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
Self-organization is usually observed in two- or three-dimensional nonequilibrium processes, where an ordered pattern spontaneously emerges in an initial disordered system. Since spontaneous ordering is not prohibited in one dimension, it is interesting to investigate the ordering behavior in the quasi-one-dimensional nanofluids such as a single-file chain of water molecules. In this paper, we show that spatiotemporal ordering of the single-file water, in the form of collective oscillating unidirectional flows, spontaneously emerges inside a narrow nanotube between two independently heated water reservoirs by molecular dynamics simulations. The spatiotemporal ordering of the single-file water induces a low-frequency coupling and a unidirectional duration time up to nanoseconds and also low-configuration entropy in the flow pattern that separates itself from the chaotic motion of water molecules. Mass density fluctuation plays a critical role in the ordered flow pattern formation, and its crossover from an exponential to a power-law decay decides the disappearance of the ordered flow pattern. We further find that spatiotemporal ordering induces high heat-transfer enhancement that is comparable to thermal conductivity of gaseous water. Our result reveals a peculiar self-organization phenomenon and entirely different dynamics in the single-file water that departs from macroscopic flows in the continuum limit.
引用
收藏
页码:12488 / 12494
页数:7
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