Computational Molecular Modeling of Transport Processes in Nanoporous Membranes

In this report we have discussed the important role of molecular modeling, especially the use of the molecular dynamics method, in investigating transport processes in nanoporous materials such as membranes. With the availability of high performance computers, molecular modeling can now be used to s...

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Autori principali: Kevin R. Hinkle, Xiaoyu Wang, Xuehong Gu, Cynthia J. Jameson, Sohail Murad
Natura: Artigo
Lingua:Inglês
Pubblicazione: MDPI AG 2018-08-01
Serie:Processes
Soggetti:
molecular simulation
membrane separations
ion-transport
Accesso online:http://www.mdpi.com/2227-9717/6/8/124
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