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Structure of Hydrocarbon Fluid and Couette Flows in Slit Pores with Pyrophyllite Walls

  • THEORY AND SIMULATION
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Abstract

The process of Couette flow of a hydrocarbon liquid in the slit pores has been simulated and the dynamics of the liquid molecules ordering depending on the liquid density and the slit size has been investigated by means of molecular dynamics. Statistical analysis of the resulting regions of ordered molecules of the hydrocarbon fluid has indicates that the wall material and the liquid viscosity affect the size of such regions.

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ACKNOWLEDGMENTS

This research was supported in part through computational resources of HPC facilities at the HSE University and Joint Institute for High Temperatures, Russian Academy of Sciences.

Funding

The study of the ordering process and the flow regimes was supported by the Russian Science Foundation (project no. 17-79-20391).

Development of software for the analysis of MD trajectories was partially supported by the HSE University Basic Research Program and by the Ministry of Science and Higher Education of the Russian Federation (State Assignment No. 075-01056-22-00).

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Authors and Affiliations

  1. Moscow Institute of Physics and Technology (National Research University), 141701, Dolgoprudnyi, Russia

    M.A. Logunov & V.V. Pisarev

  2. Joint Institute for High Temperatures, Russian Academy of Sciences, 125412, Moscow, Russia

    M.A. Logunov & V.V. Pisarev

  3. National Research University Higher School of Economics, 101000, Moscow, Russia

    V.V. Pisarev

  4. Laboratoire SUBATECH (UMR 6457 – IMT-Atlantique, Nantes Université, CNRS/IN2P3), 44307, Nantes, France

    A.G. Kalinichev

Authors
  1. M.A. Logunov
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  2. A.G. Kalinichev
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  3. V.V. Pisarev
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Correspondence to M.A. Logunov.

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The authors declare that they have no conflicts of interest.

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Translated by E. Karpushkin

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Logunov, M., Kalinichev, A. & Pisarev, V. Structure of Hydrocarbon Fluid and Couette Flows in Slit Pores with Pyrophyllite Walls. Polym. Sci. Ser. A 64, 908–917 (2022). https://doi.org/10.1134/S0965545X2270047X

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  • DOI: https://doi.org/10.1134/S0965545X2270047X

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