Two-stage random sequential adsorption of discorectangles and disks on a two-dimensional surface.

The different variants of two-stage random sequential adsorption (RSA) models for packing of disks and discorectangles on a two-dimensional (2D) surface were investigated. In the SD (sticks+disks) model, the discorectangles were first deposited and then the disks were added. In the DS (disks+sticks) model, the disks were first deposited and then discorectangles were added. At the first stage the particles were deposited up to the selected concentration and at the final (second) stage the particles were deposited up to the saturated (jamming) state. The main parameters of the models were the concentration of particles deposited at the first stage, aspect ratio of the discorectangles ɛ (length to diameter of ratio ɛ=l/d) and disk diameter D. All distances were measured using the value of d as a unit of measurement of linear dimensions, the disk diameter was varied in the interval D∈[1-10], and the aspect ratio value was varied in the interval ɛ∈[1-50]. The dependencies of the jamming coverage of particles deposited at the second stage versus the parameters of the models were analyzed. The presence of first deposited particles for both models regulated the maximum possible disk diameter D_{max} (SD model) or the maximum aspect ratio ɛ_{max} (DS model). This behavior was explained by the deposition of particles in the second stage into triangular (SD model) or elongated (DS model) pores formed by particles deposited at the first stage. The percolation connectivity of disks (SD model) and discorectangles (DS model) for the particles with a hard core and a soft shell structure was analyzed. The disconnectedness was ensured by overlapping of soft shells. The dependencies of connectivity versus the parameters of SD and DS models were also analyzed.

Confinement effects on the random sequential adsorption packings of elongated particles in a slit.

The behavior of a system of two-dimensional elongated particles (discorectangles) packed in a slit between the two parallel walls was analyzed using a simulation approach. The packings were produced using the random sequential adsorption model with continuous positional and orientational degrees of freedom. The aspect ratio (length-to-width ratio, ɛ=l/d) of the particles was varied within the range ɛ∈[1;32] while the distance between the walls was varied within the range h/d∈[1;80]. The properties of deposits in jammed state [the coverage, the order parameter, and the long-range (percolation) connectivity between particles] were studied numerically. The values of ɛ and h significantly affected the structure of the packings and the percolation connectivity. Particularly, the observed nontrivial dependencies of the jamming coverage φ(ɛ) or φ(h) were explained by the interplay of the different geometrical factors related to confinement, particle orientation degrees of freedom and excluded volume effects.

Connectedness percolation in the random sequential adsorption packings of elongated particles.

Connectedness percolation phenomena in the two-dimensional packing of elongated particles (discorectangles) were studied numerically. The packings were produced using random sequential adsorption off-lattice models with preferential orientations of the particles along a given direction. The partial ordering was characterized by the order parameter S, with S=0 for completely disordered films (random orientation of particles) and S=1 for completely aligned particles along the horizontal direction x. The aspect ratio (length-to-width ratio) of the particles was varied within the range ɛ∈[1;100]. Analysis of connectivity was performed assuming a core-shell structure of the particles. The value of S affected the structure of the packings, the formation of long-range connectivity, and the behavior of the electrical conductivity. The effects can be explained by taking accounting of the competition between the particles' orientational degrees of freedom and excluded volume effects. For aligned deposition, anisotropy in the electrical conductivity was observed with the values along the alignment direction σ_{x} being larger than the values in the perpendicular direction σ_{y}. Anisotropy in the localization of the percolation threshold was also observed in finite-sized packings, but it disappeared in the limit of infinitely large systems.

Relaxation of saturated random sequential adsorption packings of discorectangles aligned on a line.

Relaxation of the packing of elongated particles (discorectangles) aligned on a line was studied numerically. The aspect ratio (length-to-width ratio) for the discorectangles was varied within the range ɛ∈[1;50]. The initial jamming (saturated) state was produced using the basic variant of the random sequential adsorption model with random positions and orientations of particles. The relaxation was performed by allowing rotational and translational diffusion motions of the particles while their centers remained located on the line. The effects of the aspect ratio ɛ on the kinetics of relaxation, the orientation order parameter, and the distribution function of the distances between nearest-neighbor discorectangles were analyzed. The transport properties of the resulting one-dimensional systems were also analyzed by using the diffusion of a tracer particle (random walker) between the nearest-neighbor discorectangles. In the relaxed states the anomalous diffusion was observed having a hopping exponent d_{w}>2 dependent upon ɛ.

Paris car parking problem for partially oriented discorectangles on a line.

The random sequential adsorption (RSA) of identical elongated particles (discorectangles) on a line ("Paris car parking problem") was studied numerically. An off-lattice model with continuous positional and orientational degrees of freedom was considered. The possible orientations of the discorectanles were restricted between θ∈[-θ_{m};θ_{m}] while the aspect ratio (length-to-width ratio) for the discorectangles was varied within the range ɛ∈[1;100]. Additionally, the limiting case ɛ=∞ (i.e., widthless sticks) was considered. We observed that the RSA deposition for the problem under consideration was governed by the formation of rarefied holes (containing particles oriented along a line) surrounded by comparatively dense stacks (filled with almost parallel particles oriented in the vertical direction). The kinetics of the changes of the order parameter and the packing density are discussed. Partial ordering of the discorectangles significantly affected the packing density at the jamming state, φ_{j}, and shifted the cusps in the φ_{j}(ɛ) dependencies. This can be explained by the effects on the competition between the particles' orientational degrees of freedom and the excluded volume effects.