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 TVT, 2016, Volume 54, Issue 1, Pages 13–22 (Mi tvt2018)

Plasma Investigations

Computer simulation of a forced drift of lithium ions through graphene membranes

A. E. Galashev, O. R. Rakhmanova

Institute of High-Temperature Electrochemistry, RAS

Abstract: A drift of $Li^+$ ions upon electric interactions in a planar channel formed by graphene sheets and a cell separated by two graphene membranes with pores of various types has been investigated by the molecular dynamics method. The optimal size of the planar channel gap is determined based on the character of the ion dynamics and the ion effect on the physical properties of the graphene sheets. A set of graphene sheets with divacancies demonstrates the best throughput of lithium ions among six sets of membrane pairs. The ions passing through the membrane are found to affect the kinetic characteristics of the graphene membranes.

DOI: https://doi.org/10.7868/S0040364415050129

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English version:
High Temperature, 2016, 54:1, 11–19

Bibliographic databases:

UDC: 539.22

Citation: A. E. Galashev, O. R. Rakhmanova, “Computer simulation of a forced drift of lithium ions through graphene membranes”, TVT, 54:1 (2016), 13–22; High Temperature, 54:1 (2016), 11–19

Citation in format AMSBIB
\Bibitem{GalRak16} \by A.~E.~Galashev, O.~R.~Rakhmanova \paper Computer simulation of a forced drift of lithium ions through graphene membranes \jour TVT \yr 2016 \vol 54 \issue 1 \pages 13--22 \mathnet{http://mi.mathnet.ru/tvt2018} \crossref{https://doi.org/10.7868/S0040364415050129} \elib{http://elibrary.ru/item.asp?id=25069616} \transl \jour High Temperature \yr 2016 \vol 54 \issue 1 \pages 11--19 \crossref{https://doi.org/10.1134/S0018151X15050120} \isi{http://gateway.isiknowledge.com/gateway/Gateway.cgi?GWVersion=2&SrcApp=PARTNER_APP&SrcAuth=LinksAMR&DestLinkType=FullRecord&DestApp=ALL_WOS&KeyUT=000373148600003} \scopus{http://www.scopus.com/record/display.url?origin=inward&eid=2-s2.0-84961627503} 

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Citing articles on Google Scholar: Russian citations, English citations
Related articles on Google Scholar: Russian articles, English articles

This publication is cited in the following articles:
1. A. Y. Galashev, K. A. Ivanichkina, “Nanoscale simulation of the lithium ion interaction with defective silicene”, Phys. Lett. A, 381:36 (2017), 3079–3083
2. A. E. Galashev, O. R. Rakhmanova, L. A. Elshina, “Molecular dynamics study of the formation of solid al-c nanocomposites”, Russ. J. Phys. Chem. B, 12:3 (2018), 403–411
3. A. Y. Galashev, K. A. Ivanichkina, “Computer study of atomic mechanisms of intercalation/deintercalation of Li ions in a silicene anode on an Ag(111) substrate”, J. Electrochem. Soc., 165:9 (2018), A1788–A1796
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