# Monolayers of hard rods on planar substrates: II. Growth

**Authors:** M. Klopotek, H. Hansen-Goos, M. Dixit, T. Schilling, F. Schreiber and, M. Oettel

arXiv: 1701.05830 · 2017-04-05

## TL;DR

This paper investigates the growth dynamics of hard-rod monolayers on substrates using lattice and continuum models, revealing entropic-driven nematic order transitions and the influence of non-equilibrium effects, with implications for multilayer growth.

## Contribution

It introduces a comprehensive comparison of lattice and continuum models for rod monolayer growth, highlighting the role of entropic effects and non-equilibrium conditions in ordering transitions.

## Key findings

- Nematic order evolution is mainly entropic and governed by equilibrium solutions.
- Non-equilibrium effects depend on the ratio of translational to rotational move rates.
- Lattice and continuum models show qualitative agreement when characteristic times are matched.

## Abstract

Growth of hard--rod monolayers via deposition is studied in a lattice model using rods with discrete orientations and in a continuum model with hard spherocylinders. The lattice model is treated with kinetic Monte Carlo simulations and dynamic density functional theory while the continuum model is studied by dynamic Monte Carlo simulations equivalent to diffusive dynamics. The evolution of nematic order (excess of upright particles, "standing--up" transition) is an entropic effect and is mainly governed by the equilibrium solution, {rendering a continuous transition} (paper I, J. Chem. Phys. 145, 074902 (2016)). Strong non--equilibrium effects (e.g. a noticeable dependence on the ratio of rates for translational and rotational moves) are found for attractive substrate potentials favoring lying rods. Results from the lattice and the continuum models agree qualitatively if the relevant characteristic times for diffusion, relaxation of nematic order and deposition are matched properly. Applicability of these monolayer results to multilayer growth is discussed for a continuum--model realization in three dimensions where spherocylinders are deposited continuously onto a substrate via diffusion.

## Full text

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## Figures

36 figures with captions in the complete paper: https://tomesphere.com/paper/1701.05830/full.md

## References

51 references — full list in the complete paper: https://tomesphere.com/paper/1701.05830/full.md

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