Citation: GE Zhen-Peng, SHI Yan-Chao, LI Xiao-Yi. Effects of Ortho nal Electric Field on Water Flux through a Carbon Nanotube[J]. Acta Physico-Chimica Sinica, ;2013, 29(08): 1655-1660. doi: 10.3866/PKU.WHXB201305222 shu

Effects of Ortho nal Electric Field on Water Flux through a Carbon Nanotube

1.
College of Materials Science and Opto-electronics Technology, University of Chinese Academy of Sciences, Beijing 100049, P. R. China

Received Date: 26 February 2013
Available Online: 22 May 2013
Fund Project: 国家自然科学基金(21274164, 21144001) (21274164, 21144001)国家重点基础研究发展规划项目(973) (2012CB934001)资助 (973) (2012CB934001)

Water transport in nanopores is important for many biological processes and the design of nanodevices. It has been demonstrated that water molecules are transported through a (6,6)-type carbon nanotube (CNT) by forming single-file chains. However, a controllable water flow through a CNT remains difficult to achieve. In this paper, we investigated how to control the net flux of water molecules transported through a CNT and the on-off gating behavior of the CNT using an ortho nal electric field. With a 200 MPa pressure difference acting on the top of the first layer of water molecules as the driving force, the net flux of water molecules decreased linearly as the ortho nal electric field strength (E) increased from 1 to 3 V· nm^-1. When E increased over 3 V·nm^-1, the flow of water molecules through the CNT was turned off and the net flux was almost zero. Both the orientation of water dipoles and flipping frequency were strongly correlated with the water occupancy in this case.
- Carbon nanotube,
- Ortho nal electric field,
- Molecular dynamics simulation,
- Flux of water molecules,
- Gating
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