The cooperative migration dynamics of particles correlates to the nature of hexatic-isotropic phase transition in 2D systems of corner-rounded hexagons.

In the two-dimensional (2D) melting transition of colloidal systems, the hexatic-isotropic (H-I) transition can be either first-order or continuous. However, how particle dynamics differs at the single-particle level during these two different melting transitions remains to be disclosed. In this work, by Brownian dynamics (BD) simulations, we have systematically studied the dynamic behavior of corner-rounded hexagons during the H-I transition, for a range of corner-roundness ζ = 0.40 to 0.99 that covers the crossover from the continuous to first-order nature of H-I transition. The results show that hexagons with ζ ≤ 0.5 display a continuous H-I transition, whereas those with ζ ≥ 0.6 demonstrate a first-order H-I transition. Dynamic analysis shows different evolution pathways of the dominant cluster formed by migrating particles, which results in a droplet-like cluster structure for ζ = 0.40 hexagons and a tree-like cluster structure for ζ = 0.99 hexagons. Further investigations on the hopping activities of particles suggest a cooperative origin of migrating clusters. Our work provides a new aspect to understand the dependence of the nature of H-I transition on the roundness of hexagons through particle dynamic behavior.

Patterning High-Resolution Microstructures on Thermoplastics by Ceramic Nanoparticles Filled Epoxy Coated Molds for Duplicating Nature-Derived Functional Surfaces.

Patterning high-resolution microstructures on thermoplastic substrates is of fundamental importance for the commercialization of microfluidics, advanced functional surfaces, and optical elements. Though many methods are developed to fabricate micropatterned plastic devices with 100 µm resolution, they suffer substantially higher cost or lower productivity when the resolution of the micropatterns is to be further improved. Here, we develop low-cost molds consisting of thin ceramic-filled-epoxy composite coatings on steel substrates. By virtue of the loaded ZrO2 nanoparticle fillers, the enhanced mechanical and thermal properties of the composite molds enable the epoxy microstructures to survive harsh conditions in conventional thermoplastic processing methods including hot embossing, imprinting, and mold injection. With the ceramic-filled-epoxy coated molds, we are able to improve the fabrication resolution of microstructures on plastics to 10 µm with unprecedented low-cost and excellent durability.

Dynamic heterogeneity flow promotes binding reactions in a dense system of hard annular sector particles.

We perform molecular dynamics simulations on a system of hard annular sector particles (ASPs) to investigate the reaction-dynamics relationship. The dimerization reaction zone, mixing reaction zone including dimerization and n-merization (n > 2), and arrested region are observed successively as area fraction φA increases from low to high. In this work, we focus on the properties of the concentrated arrested region (φA≥ 0.400). The results show that for systems at φA≥ 0.400, the ratio of n-merization increases with φA and n-merization finally becomes the dominant reaction in the system; dynamic heterogeneity (DH) is observed and is demonstrated to originate from the divergent size of clusters consisting of high-mobility particles; the particles with a high translational or rotational mobility are found to have a high ability to react with other particles at φA > 0.400; more interestingly, binding reactions are found to correlate spatially with DH at φA > 0.400. Our work sheds new light on understanding the role of DH in binding reactions or specific-site recognition assembly in a crowded environment.

Emergent tetratic order in crowded systems of rotationally asymmetric hard kite particles.

Considering multi-body systems of monodisperse hard Brownian particles, it remains challenging to predict the forms of order that can emerge in their dense assembled structures. Surprisingly, here, using Monte Carlo simulations, we show that tetratic-ordered phases emerge in a dense two-dimensional system of hard kites that are rotationally asymmetric and have opposite 72° and α ≈ 90° internal angles. We observe a new tetragonal rectangular crystal (TRX) phase possessing (quasi-)long-range fourfold molecular-orientational order. We propose a method based on local polymorphic configurations of neighboring particle pairs (LPC-NPPs) to understand this emergent tetratic order and show that LPC-NPPs can be useful for predicting orientational order in such systems. To examine the dependence of the tetratic order on α, we apply LPC-NPP analysis to other hard kites for 54° ≤ α ≤ 144°. Our work provides insight into the creation of novel ordered materials by rationally designing particle shape based on anticipated LPC-NPPs.