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Dissipative particle dynamics: Effects of thermostating schemes on nano-colloid electrophoresis

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  • Hassanzadeh Afrouzi, Hamid
  • Moshfegh, Abouzar
  • Farhadi, Mousa
  • Sedighi, Kurosh

Abstract

A novel fully explicit approach using dissipative particle dynamics (DPD) method is introduced in the present study to model the electrophoretic transport of nano-colloids in an electrolyte solution. Slater type charge smearing function included in 3D Ewald summation method is employed to treat electrostatic interaction. Performance of various thermostats are challenged to control the system temperature and study the dynamic response of colloidal electrophoretic mobility under practical ranges of external electric field (0.0720.145v/nm) while thermal equilibrium is maintained. Reasonable agreements are achieved by benchmarking the system radial distribution function with available EW3D modellings, as well as comparing reduced mobility against conventional Smoluchowski and Hückel theories, and numerical solution of Poisson–Boltzmann equation.

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  • Hassanzadeh Afrouzi, Hamid & Moshfegh, Abouzar & Farhadi, Mousa & Sedighi, Kurosh, 2018. "Dissipative particle dynamics: Effects of thermostating schemes on nano-colloid electrophoresis," Physica A: Statistical Mechanics and its Applications, Elsevier, vol. 497(C), pages 285-301.
    • Handle: RePEc:eee:phsmap:v:497:y:2018:i:c:p:285-301
    DOI: 10.1016/j.physa.2018.01.017
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    References listed on IDEAS

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    1. Nemati, Maedeh & Shateri Najaf Abady, Ali Reza & Toghraie, Davood & Karimipour, Arash, 2018. "Numerical investigation of the pseudopotential lattice Boltzmann modeling of liquid–vapor for multi-phase flows," Physica A: Statistical Mechanics and its Applications, Elsevier, vol. 489(C), pages 65-77.
    2. Karimipour, Arash & Hemmat Esfe, Mohammad & Safaei, Mohammad Reza & Toghraie Semiromi, Davood & Jafari, Saeed & Kazi, S.N., 2014. "Mixed convection of copper–water nanofluid in a shallow inclined lid driven cavity using the lattice Boltzmann method," Physica A: Statistical Mechanics and its Applications, Elsevier, vol. 402(C), pages 150-168.
    3. Rezaei, M. & Azimian, A.R. & Toghraie, D., 2015. "Molecular dynamics study of an electro-kinetic fluid transport in a charged nanochannel based on the role of the stern layer," Physica A: Statistical Mechanics and its Applications, Elsevier, vol. 426(C), pages 25-34.
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    Cited by:

    1. Afrouzi, Hamid Hassanzadeh & Hosseini, Mirolah & Toghraie, Davood & Mehryaar, Ehsan & Afrand, Masoud, 2020. "Thermo-hydraulic characteristics investigation of nanofluid heat transfer in a microchannel with super hydrophobic surfaces under non-uniform magnetic field using Incompressible Preconditioned Lattice," Physica A: Statistical Mechanics and its Applications, Elsevier, vol. 553(C).
    2. Javadzadegan, Ashkan & Joshaghani, Mohammad & Moshfegh, Abouzar & Akbari, Omid Ali & Afrouzi, Hamid Hassanzadeh & Toghraie, Davood, 2020. "Accurate meso-scale simulation of mixed convective heat transfer in a porous media for a vented square with hot elliptic obstacle: An LBM approach," Physica A: Statistical Mechanics and its Applications, Elsevier, vol. 537(C).

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