Diffusion coefficient of ions through graphene nanopores
In this work, we investigate the transport of ions through graphene nanopores driven by concentration gradients through molecular dynamics simulations. The diffusion coefficients, D, of K+ and Cl− are computed for various pore sizes and porosities. It is found that D is sensitive to the pore size wh...
Main Authors: | , , , , , |
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Format: | Article |
Language: | English |
Published: |
AIP Publishing LLC
2022-08-01
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Series: | AIP Advances |
Online Access: | http://dx.doi.org/10.1063/5.0098641 |