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Colloidal Shear-Thickening Fluids Using Variable Functional Star-Shaped Particles: A Molecular Dynamics Study.

Rofiques SalehinRong-Guang XuStefanos Papanikolaou
Published in: Materials (Basel, Switzerland) (2021)
Complex colloidal fluids, depending on constituent shapes and packing fractions, may have a wide range of shear-thinning and/or shear-thickening behaviors. An interesting way to transition between different types of such behavior is by infusing complex functional particles that can be manufactured using modern techniques such as 3D printing. In this paper, we perform 2D molecular dynamics simulations of such fluids with infused star-shaped functional particles, with a variable leg length and number of legs, as they are infused in a non-interacting fluid. We vary the packing fraction (ϕ) of the system, and for each different system, we apply shear at various strain rates, turning the fluid into a shear-thickened fluid and then, in jammed state, rising the apparent viscosity of the fluid and incipient stresses. We demonstrate the dependence of viscosity on the functional particles' packing fraction and we show the role of shape and design dependence of the functional particles towards the transition to a shear-thickening fluid.
Keyphrases
  • molecular dynamics
  • molecular dynamics simulations
  • molecular docking
  • diffusion weighted imaging