Determination of the mutual-diffusion coefficient of a binary mixture by non-equilibrium molecular dynamics viewed as a sedimentation experiment

1990 ◽  
Vol 70 (2) ◽  
pp. 209-213 ◽  
Author(s):  
Fernando O. Raineri ◽  
Harold L. Friedman
Keyword(s):  
Molecular Dynamics ◽  
Diffusion Coefficient ◽  
Binary Mixture ◽  
Mutual Diffusion ◽  
Mutual Diffusion Coefficient ◽  
Non Equilibrium Molecular Dynamics ◽  
Non Equilibrium

Shape-dependent collective diffusion coefficient of multi-layers graphene nanopores

RSC Advances ◽  
2015 ◽  
Vol 5 (120) ◽  
pp. 99573-99576 ◽  
Author(s):  
Jia-le Wen ◽  
Dong-qin Zheng ◽  
Wei-rong Zhong
Keyword(s):  
Molecular Dynamics ◽  
Diffusion Coefficient ◽  
Particle Transport ◽  
Graphene Membrane ◽  
Non Equilibrium Molecular Dynamics ◽  
Non Equilibrium

Using non-equilibrium molecular dynamics, the particle transport in graphene membrane nanopores has been studied. It is suggested that the interfacial and intracrystalline resistance can suppress particle transport in nanopores.

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