Controlling density fluctuations in wall-bounded dissipative particle dynamics systems.

نویسندگان

  • Igor V Pivkin
  • George Em Karniadakis
چکیده

Dissipative Particle Dynamics (DPD) simulations of wall-bounded flows exhibit density fluctuations that depend strongly on the no-slip boundary condition and increase with the level of coarse graining. We develop an adaptive model for wall-particle interactions that eliminates such oscillations and can target prescribed density profiles. Comparisons are made with ideal no-slip boundary conditions and molecular dynamics simulations. The new model is general and can be used in other coarse-grained particle methods.

برای دانلود متن کامل این مقاله و بیش از 32 میلیون مقاله دیگر ابتدا ثبت نام کنید

ثبت نام

اگر عضو سایت هستید لطفا وارد حساب کاربری خود شوید

منابع مشابه

A stochastic boundary forcing for dissipative particle dynamics

The method of dissipative particle dynamics (DPD) is an effective, coarse grained model of the hydrodynamics of complex fluids. DPD simulations of wall-bounded flows are however often associated with spurious fluctuations of the fluid properties near the wall. We present a novel stochastic boundary forcing for DPD simulations of wall-bounded flows, based on the identification of fluctuations in...

متن کامل

Hydrodynamic effects on flow-induced polymer translocation through a microfluidic channel

The flow-induced translocation of polymer chains through a microfluidic channel is investigated using particle-based Dissipative Particle Dynamics and modified Langevin Dynamics approaches. Adaptive noslip wall boundary conditions have been implemented to model fluid flow in the microfluidic channel, paying attention to controlling fluid density fluctuations. By varying the magnitude of the ext...

متن کامل

Dissipative Particle Dynamics simulation hydrated Nafion EW 1200 as fuel cell membrane in nanoscopic scale

The microphase separation of hydrated perfluorinated sulfonic acid membrane Nafion was investigated using Dissipative Particle Dynamics (DPD). The nafion as a polymer was modelled by connecting coarse grained beads which corresponds to the hydrophobic backbone of polytetrafluoroethylene and perfluorinated side chains terminated by hydrophilic end particles of sulfonic acid groups [1, 2]. Each f...

متن کامل

Blood-plasma separation in Y-shaped bifurcating microfluidic channels: a dissipative particle dynamics simulation study.

The motion of a suspension of red blood cells (RBCs) flowing in a Y-shaped bifurcating microfluidic channel is investigated using a validated low-dimensional RBC model based on dissipative particle dynamics. Specifically, the RBC is represented as a closed torus-like ring of ten colloidal particles, which leads to efficient simulations of blood flow in microcirculation over a wide range of hema...

متن کامل

Coarse-graining limits in open and wall-bounded dissipative particle dynamics systems.

Coarse graining of dense liquid-state systems can potentially lead to fast simulation times, thus providing an effective bridge between atomistic and continuum descriptions. Dissipative particle dynamics (DPD) is a stochastic Lagrangian method that provides a simple formal procedure for coarse graining. Here we analyze some of the fundamental modeling ideas of DPD and identify three factors tha...

متن کامل

ذخیره در منابع من


  با ذخیره ی این منبع در منابع من، دسترسی به آن را برای استفاده های بعدی آسان تر کنید

برای دانلود متن کامل این مقاله و بیش از 32 میلیون مقاله دیگر ابتدا ثبت نام کنید

ثبت نام

اگر عضو سایت هستید لطفا وارد حساب کاربری خود شوید

عنوان ژورنال:
  • Physical review letters

دوره 96 20  شماره 

صفحات  -

تاریخ انتشار 2006