Implicit and explicit solvent models for the simulation of a single polymer chain in solution: Lattice Boltzmann versus Brownian dynamics

Lattice Boltzmann Simulation of Polymer-solvent Systems

Received (received date) Revised (revised date) We investigate a new method for simulating polymer-solvent systems which combines a lattice Boltzmann approach for the uid with a continuum molecular dynamics (MD) model for the polymer chain. The two parts are coupled by a friction force which is proportional to the diierence of the monomer velocity and the uid velocity at the monomer's position....

the effect of explicit versus implicit error correction on writing of iranian intermediate efl learners

در این پایان نامه دو روش اصلاح اشتباهات نوشتاری زبان آموزان بزرگسال ایرانی در سطح متوسط مورد بررسی قرار می گیرد. در روش اول (explicit) اشتباهات بطور مستقیم و در روش دوم (implicit) اشتباهات بصورت غیر مستقیم اصلاح می شود. برای انجام این تحقیق از دو گروه 15 نفری استفاده شده است. به زبان آموزان در هر جلسه یک موضوع انشا داده شده است. این کار در 15 هفته (15 جلسه) تکرار شده است. مقایسه نتایج این آزمون...

a study on thermodynamic models for simulation of 1,3 butadiene purification columns

attempts have been made to study the thermodynamic behavior of 1,3 butadiene purification columns with the aim of retrofitting those columns to more energy efficient separation schemes. 1,3 butadiene is purified in two columns in series through being separated from methyl acetylene and 1,2 butadiene in the first and second column respectively. comparisons have been made among different therm...

Simulation of the Dynamics of Polymers in Solution via a Hybrid Molecular Dynamics-Lattice Boltzmann Scheme

A novel boundary condition for the simulation of the submerged bodies using lattice boltzmann method

In this study, we proposed a novel scheme for the implementation of the no-slip boundary condition in thelattice Boltzmann method (LBM) . In detail , we have substituted the classical bounce-back idea by the direct immersed boundary specification . In this way we construct the equilibrium density functions in such a way that it feels the no-slip boundaries . Therefore , in fact a kind of equili...