相关论文: Barrier properties of k-mer packings
The jamming and percolation for two generalized models of random sequential adsorption (RSA) of linear $k$-mers (particles occupying $k$ adjacent sites) on a square lattice are studied by means of Monte Carlo simulation. The classical…
The diffusion-driven self-assembly of rod-like particles was studied by means of Monte Carlo simulation. The rods were represented as linear $k$-mers (i.e., particles occupying $k$ adjacent sites). In the initial state, they were deposited…
Pattern formation in a two-dimensional system of rod-like particles has been simulated using a lattice approach. Rod-like particles were modelled as linear $k$-mers of two mutually perpendicular orientations ($k_x$- and $k_y$-mers) on a…
Random sequential adsorption (RSA) models have been studied due to their relevance to deposition processes on surfaces. The depositing particles are represented by hard-core extended objects; they are not allowed to overlap. Numerical Monte…
Diffusion in a two-species 2D system has been simulated using a lattice approach. Rodlike particles were considered as linear $k$-mers of two mutually perpendicular orientations ($k_x$- and $k_y$-mers) on a square lattice. These $k_x$- and…
The effect of defects on the percolation of linear $k$-mers (particles occupying $k$ adjacent sites) on a square lattice is studied by means of Monte Carlo simulation. The $k$-mers are deposited using a random sequential adsorption…
Jamming phenomena on a square lattice are investigated for two different models of anisotropic random sequential adsorption (RSA) of linear $k$-mers (particles occupying $k$ adjacent adsorption sites along a line). The length of a $k$-mer…
We study by Monte Carlo computer simulations random sequential adsorption (RSA) with diffusional relaxation, of lattice hard squares in two dimensions. While for RSA without diffusion the coverage approaches its maximum jamming value…
Kinetic Monte Carlo (KMC) is a powerful method for simulation of diffusion processes in various systems. The accuracy of the method, however, relies on the extent of details used for the parameterization of the model. Migration barriers are…
We study the percolation and jamming of rods ($k$-mers) on a square lattice that contains defects. The point defects are placed randomly and uniformly on the substrate before deposition of the rods. The general case of unequal probabilities…
Monte Carlo simulations and finite-size scaling analysis have been performed to study the jamming and percolation behavior of linear $k$-mers (also known as rods or needles) on the two-dimensional triangular lattice, considering an…
Numerical simulations by means of Monte Carlo method and finite-size scaling analysis have been performed to study the percolation behavior of linear $k$-mers (also denoted in the literature as rigid rods, needles, sticks) on…
Atomistic rigid lattice Kinetic Monte Carlo is an efficient method for simulating nano-objects and surfaces at timescales much longer than those accessible by molecular dynamics. A laborious part of constructing any Kinetic Monte Carlo…
The percolation behavior of aligned rigid rods of length $k$ ($k$-mers) on two-dimensional triangular lattices has been studied by numerical simulations and finite-size scaling analysis. The $k$-mers, containing $k$ identical units (each…
We have performed extensive simulations of random sequential adsorption and diffusion of $k$-mers, up to $k=5$ in two dimensions with particular attention to the case $k=2$. We focus on the behavior of the coverage and of vacancy dynamics…
We study analytically and numerically a model of random sequential adsorption (RSA) of segments on a line, subject to some constraints suggested by two kinds of physical situations: - deposition of dimers on a lattice where the sites have a…
Restrictions to molecular motion by barriers (membranes) are ubiquitous in biological tissues, porous media and composite materials. A major challenge is to characterize the microstructure of a material or an organism nondestructively using…
Random sequential adsorption (RSA) is a standard method of modeling adsorption of large molecules at the liquid-solid interface. Several studies have recently conjectured that in the RSA of rectangular needles, or $k$-mers, on a square…
Numerical simulations and finite-size scaling analysis have been carried out to study the percolation behavior of straight rigid rods of length $k$ ($k$-mers) on two-dimensional square lattices. The $k$-mers, containing $k$ identical units…
A kinetic Monte Carlo method was used to simulate the diffusion of reptating polymer chains across the interface. A time-resolved fluorescence technique conjunction with direct energy transfer method was used to measure the extend of…