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Fast phase transition of water molecules in a defective carbon nanotube under an electric field
被引:7
|作者:
Meng, Xianwen
[1
]
Huang, Jiping
[2
,3
]
机构:
[1] China Univ Min & Technol, Dept Phys, Xuzhou 221116, Peoples R China
[2] Fudan Univ, Dept Phys, Shanghai 200433, Peoples R China
[3] Fudan Univ, State Key Lab Surface Phys, Shanghai 200433, Peoples R China
来源:
INTERNATIONAL JOURNAL OF MODERN PHYSICS B
|
2016年
/
30卷
/
06期
关键词:
Carbon nanotube;
water molecules;
molecular dynamics simulations;
BIOLOGICAL-MEMBRANES;
TRANSPORT;
DYNAMICS;
CHANNEL;
PROTEIN;
BEHAVIOR;
FORCE;
D O I:
10.1142/S0217979216500193
中图分类号:
O59 [应用物理学];
学科分类号:
摘要:
We utilize molecular dynamics simulations to study the effect of an electric field on the permeation of water molecules through a defective single-walled carbon nanotube (DSWCNT). Compared with a perfect single-walled carbon nanotube (PSWCNT), the behaviors of water molecules respond more quickly under the same electric field in a DSWCNT. Wet-dry phase transition of water molecules occurs when the electric field reaches 0.32 V/nm, which is much lower than the case of the PSWCNT. Besides, the critical electric field is affected by the number of defects. These results pave a way for designing fast wet-dry transition devices and provide a new insight into water permeation through a defective nanochannel.
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页数:8
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