The diffusion of fractal aggregates constructed with the method by Thouy and Jullien [J. Phys. A 27, 2953 (1994)] comprised of N(p) spherical primary particles was studied as a function of the aggregate mass and fractal dimension using molecular dynamics simulations. It is shown that finite-size effects have a strong impact on the apparent value of the diffusion coefficient (D), but these can b...

Electrokinetic phenomena in micro/nanofluidic channels have attracted considerable attention because precise control of molecular transport in liquids is required to optically and electrically capture the behavior of single molecules. However, the detailed mechanisms of polymer transport influenced by electroosmotic flows and electric fields in micro/nanofluidic channels have not yet been eluci...

We investigate the effect of various spherical nanoparticles on chain dimensions in polymer melts for high nanoparticle loading which is larger than the percolation threshold, using molecular dynamics simulations. We show that polymer chains are unperturbed by the presence of repulsive nanoparticles. In contrast polymer chains can be perturbed by the presence of attractive nanoparticles when th...

We computed the phase-separation behavior and effective interactions of colloid-polymer mixtures in the "protein limit," where the polymer radius of gyration is much larger than the colloid radius. For ideal polymers, the critical colloidal packing fraction tends to zero, whereas for interacting polymers in a good solvent the behavior is governed by a universal binodal, implying a constant crit...

Several authors have proposed different methods to find the solution of fully fuzzy linear programming (FFLP) problems. But all the existing methods are based on the assumption that all the fuzzy coefficients and the fuzzy variables are non-negative fuzzy numbers. in this paper a new method is proposed to solve an FFLP problems with arbitrary fuzzy coefficients and arbitrary fuzzy variables, th...

The goal of this section is to investigate the tilt-length correlations for the following alternative definitions of the tail director: A. Molecular directors, which characterize tilt of an entire molecule, rather than an individual tail. This approach to the director definition was taken in the earlier work [1–3]. Here, we investigate two different definitions of molecular directors (see Fig. ...

In this work, a three-dimensional hybrid simulation program is used to investigate the process of explosion and expansion large number thermal debris ions in low density background plasma. By quantitatively calculating variation magnetic bubble constraint motion cloud, studied are influences plasma charge density, ion atomic weight, charge-mass ratio fragment on bubble. The results show that ha...

molecular dynamic simulation is a powerful method that monitors all variations in the atomic level in explicit solvent. by this method we can calculate many chemical and biochemical properties of large scale biological systems. in this work all-atom molecular dynamics simulation of polyalanine (pa) was investigated in the presence of 0.224, 0.448, 0.673, 0.897 and 1.122 m of guanidinium chlorid...