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The shape of the liquid-liquid interface for oil/water mixtures in slit pores. / Kopanichuk, Ilia V.; Berezhnaya, Anastasia S.; Sizova, Anastasia A.; Vanin, Aleksandr A.; Sizov, Vladimir V.; Brodskaya, Elena N.

в: Colloids and Surfaces A: Physicochemical and Engineering Aspects, Том 601, 124884, 20.09.2020.

Результаты исследований: Научные публикации в периодических изданияхстатьяРецензирование

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@article{cdcf388b7cba41fc85b2d0ac908c236f,
title = "The shape of the liquid-liquid interface for oil/water mixtures in slit pores",
abstract = "A surface-area-based theoretical approach to the analysis of relative stability of various shapes of liquid-liquid interfaces observed in binary immiscible liquid systems in slit-like pores is proposed. The theoretical estimates produced by this approach are compared to the results of systematic molecular dynamics simulations for n-decane/water mixtures in pores of hydrophilic siliceous and hydrophobic carbonaceous materials. The limitations of the proposed approach and the dependence of the accuracy of theoretical predictions on system size and the composition of the liquid mixture are discussed.",
keywords = "Confinement, Liquid-liquid interface, Molecular dynamics, Surface area, INTERMOLECULAR POTENTIAL FUNCTIONS, FORCE-FIELD",
author = "Kopanichuk, {Ilia V.} and Berezhnaya, {Anastasia S.} and Sizova, {Anastasia A.} and Vanin, {Aleksandr A.} and Sizov, {Vladimir V.} and Brodskaya, {Elena N.}",
note = "Funding Information: This work was supported by the Russian Foundation for Basic Research (project No. 18-03-01238-a ). Publisher Copyright: {\textcopyright} 2020 Elsevier B.V. Copyright: Copyright 2020 Elsevier B.V., All rights reserved.",
year = "2020",
month = sep,
day = "20",
doi = "10.1016/j.colsurfa.2020.124884",
language = "English",
volume = "601",
journal = "Colloids and Surfaces A: Physicochemical and Engineering Aspects",
issn = "0927-7757",
publisher = "Elsevier",

}

RIS

TY - JOUR

T1 - The shape of the liquid-liquid interface for oil/water mixtures in slit pores

AU - Kopanichuk, Ilia V.

AU - Berezhnaya, Anastasia S.

AU - Sizova, Anastasia A.

AU - Vanin, Aleksandr A.

AU - Sizov, Vladimir V.

AU - Brodskaya, Elena N.

N1 - Funding Information: This work was supported by the Russian Foundation for Basic Research (project No. 18-03-01238-a ). Publisher Copyright: © 2020 Elsevier B.V. Copyright: Copyright 2020 Elsevier B.V., All rights reserved.

PY - 2020/9/20

Y1 - 2020/9/20

N2 - A surface-area-based theoretical approach to the analysis of relative stability of various shapes of liquid-liquid interfaces observed in binary immiscible liquid systems in slit-like pores is proposed. The theoretical estimates produced by this approach are compared to the results of systematic molecular dynamics simulations for n-decane/water mixtures in pores of hydrophilic siliceous and hydrophobic carbonaceous materials. The limitations of the proposed approach and the dependence of the accuracy of theoretical predictions on system size and the composition of the liquid mixture are discussed.

AB - A surface-area-based theoretical approach to the analysis of relative stability of various shapes of liquid-liquid interfaces observed in binary immiscible liquid systems in slit-like pores is proposed. The theoretical estimates produced by this approach are compared to the results of systematic molecular dynamics simulations for n-decane/water mixtures in pores of hydrophilic siliceous and hydrophobic carbonaceous materials. The limitations of the proposed approach and the dependence of the accuracy of theoretical predictions on system size and the composition of the liquid mixture are discussed.

KW - Confinement

KW - Liquid-liquid interface

KW - Molecular dynamics

KW - Surface area

KW - INTERMOLECULAR POTENTIAL FUNCTIONS

KW - FORCE-FIELD

UR - http://www.scopus.com/inward/record.url?scp=85084946097&partnerID=8YFLogxK

U2 - 10.1016/j.colsurfa.2020.124884

DO - 10.1016/j.colsurfa.2020.124884

M3 - Article

AN - SCOPUS:85084946097

VL - 601

JO - Colloids and Surfaces A: Physicochemical and Engineering Aspects

JF - Colloids and Surfaces A: Physicochemical and Engineering Aspects

SN - 0927-7757

M1 - 124884

ER -

ID: 70757086