scholarly journals Molecular Dynamics Simulation of Rarefaction Effect on Shear-driven Gas Flow in Nanochannels

Author(s):  
Ye Zhang ◽  
Ran Zhang ◽  
Wenjia Xie ◽  
Hua Li
Petroleum ◽  
2019 ◽  
Vol 5 (3) ◽  
pp. 252-259 ◽  
Author(s):  
Jing Zhang ◽  
Guihong Pei ◽  
Liyin Zhang

2018 ◽  
Vol 2018 ◽  
pp. 1-7
Author(s):  
Xiaohui Lin ◽  
Fu-bing Bao ◽  
Xiaoyan Gao ◽  
Jiemin Chen

Molecular dynamics simulation is adopted in the present study to investigate the nanoscale gas flow characteristics in rough channels. The virtual-wall model for the rough wall is proposed and validated. The computational efficiency can be improved greatly by using this model, especially for the low-density gas flow in nanoscale channels. The effect of roughness element geometry on flow behaviors is then studied in detail. The fluid velocity decreases with the increase of roughness element height, while it increases with the increases of element width and spacing.


Author(s):  
Qixin Liu

Many uncommon gas flow phenomena in nanopores have been found by experiments. Besides that, another special characteristic of gas flow at nanopore is that gas’s number density shows uneven distribution. From the point of molecular motion, gas’s number density would affect its dynamic viscosity, so it’s very necessary to study whether the gas’s viscosity is uneven. Due to the gas density’s fluctuation usually takes place near the wall surface so the present paper focuses on the gas’s viscosity near the wall of nanopore. Our molecular dynamics simulation results indicate that the gas’s viscosity in the region near the wall surface isn’t a constant and fluctuates greatly. The profiles of gas’s viscosity and gas number density coincide very well.


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