Biomedical subjects

Tiezheng Qian

Publications and source records attributed to Tiezheng Qian.

3 recordsLinked to original sources

PubMed2005

Hydrodynamic slip boundary condition at chemically patterned surfaces: a continuum deduction from molecular dynamics.

We investigate the slip boundary condition for flows past a chemically patterned surface. Molecular dynamics simulations show that fluid forces and stresses vary laterally along the patterned surface. A subtraction scheme is developed to verify the validity of the Navier slip boundary condition, locally, for the patterned surface. A continuum hydrodynamic model is formulated using the Navier-Stokes equation and the Navier boundary condition, with a slip length varying along the patterned surface. Steady-state velocity fields from continuum calculations are in quantitative agreement with those from molecular simulations.

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PubMed2004

Power-law slip profile of the moving contact line in two-phase immiscible flows.

Large-scale molecular dynamics (MD) simulations on two-phase immiscible flows show that, associated with the moving contact line, there is a very large 1/x partial-slip region where x denotes the distance from the contact line. This power-law partial-slip region is verified in large-scale adaptive continuum calculations based on a local, continuum hydrodynamic formulation, which has proved successful in reproducing MD results at the nanoscale. Both MD simulations and numerical solutions of continuum equations indicate the existence of a universal slip profile in the Stokes-flow regime.

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PubMed2003

Molecular scale contact line hydrodynamics of immiscible flows.

From extensive molecular dynamics simulations on immiscible two-phase flows, we find the relative slipping between the fluids and the solid wall everywhere to follow the generalized Navier boundary condition, in which the amount of slipping is proportional to the sum of tangential viscous stress and the uncompensated Young stress. The latter arises from the deviation of the fluid-fluid interface from its static configuration. We give a continuum formulation of the immiscible flow hydrodynamics, comprising the generalized Navier boundary condition, the Navier-Stokes equation, and the Cahn-Hilliard interfacial free energy. Our hydrodynamic model yields interfacial and velocity profiles matching those from the molecular dynamics simulations at the molecular-scale vicinity of the contact line. In particular, the behavior at high capillary numbers, leading to the breakup of the fluid-fluid interface, is accurately predicted.

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