The transport properties of water through a nanochannel influenced by the direction of an
external electric field has been investigated by using molecular dynamics simulations. Water …

Wetting and dewetting of a (6, 6) carbon nanotube in presence of an orthogonal electric field
of varying strengths are studied by means of molecular dynamics simulations using seven …

Homogeneous crystallization of supercooled water under electric field with strength ranging
from 4.0 to 40.0 V· nm-1 was investigated by using molecular simulation technique. The …

Reverse osmosis has become the most prevalent approach to seawater desalination. It is
still limited by the permeability-selectivity trade-off of the membranes and the energy …

利用分子动力学模拟方法, 对比考察了平衡条件, 外压作用, 梯度电场作用下, 摩尔比为1: 1
的甲醇-水混合溶液在纳米碳管(CNT) 中的静态结构以及输运行为. 研究发现 …

采用分子动力学模拟方法研究了强度为4.0-40.0 V∙ nm-1 的均匀电场对过冷水冰晶结构和冰晶
生长速率的影响. 文中通过CHILL 算法来识别不同的冰相结构, 通过拟合Avrami …

In this study, we have investigated how to control the net flux of water molecules transported
through a CNT using an orthogonal and axial electric field. The flow of water molecules …

Molecular dynamics simulations of a methanol-water mixture (molar ratio 1: 1) were
performed to determine the differences among the structural and transport properties in …