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We report on a large scale computer simulation study of crystal nucleation in hard spheres. Through a combined analysis of real and reciprocal space data, a picture of a two-step crystallization process is supported: First dense, amorphous…

软凝聚态物质 · 物理学 2015-05-18 T. Schilling , H. J. Schope , M. Oettel , G. Opletal , I. Snook

Crystallization of supersaturated liquids usually starts by heterogeneous nucleation. Mounting evidence shows that even homogeneous nucleation in simple liquids takes place in two steps; first a dense amorphous precursor forms, and the…

Targeting specific technological applications requires the control of nanoparticle properties, especially the crystalline polymorph. Freezing a nanodroplet deposited on a solid substrate leads to the formation of crystalline structures. We…

软凝聚态物质 · 物理学 2018-03-02 Julien Lam , James F. Lutsko

We present a computer simulation study on the crystal nucleation process in suspensions of hard spheres, fully taking into account the solvent hydrodynamics. If the dynamics of collodial crystallization were purely diffusive, the crystal…

软凝聚态物质 · 物理学 2015-06-12 Marc Radu , Tanja Schilling

The interplay between densification and positional ordering during the process of crystal nucleation is a greatly investigated topic. Even for the simplest colloidal model -- hard spheres -- there has been much debate regarding the…

软凝聚态物质 · 物理学 2025-02-19 Marjolein de Jager , Nena Slaats , Laura Filion

We study the phase behavior of hard spheres confined between two parallel hard plates using extensive computer simulations. We determine the full equilibrium phase diagram for arbitrary densities and plate separations from one to five…

软凝聚态物质 · 物理学 2009-11-11 Andrea Fortini , Marjolein Dijkstra

We investigate the early part of the crystal nucleation process in the hard sphere fluid using data produced by computer simulation. We find that hexagonal order manifests continuously in the overcompressed liquid, beginning approximately…

软凝聚态物质 · 物理学 2016-06-29 Joshua T. Berryman , Muhammad Anwar , Sven Dorosz , Tanja Schilling

We review theoretical and simulational approaches to the description of equilibrium bulk crystal and interface properties as well as to the nonequilibrium processes of homogeneous and heterogeneous crystal nucleation for the simple model…

软凝聚态物质 · 物理学 2014-02-03 Francesco Turci , Tanja Schilling , Mohammad Hossein Yamani , Martin Oettel

We revisit the effect of polydispersity on the crystal nucleation of hard spheres. Using event-driven molecular dynamics simulations, we obtain the nucleation rate as a function of the supersaturation for a range of polydispersities, and…

软凝聚态物质 · 物理学 2025-12-24 Marjolein de Jager , Antoine Castagnède , Frank Smallenburg , Laura Filion

Over the past two decades, a large number of studies addressed the topic of crystal nucleation in suspensions of hard spheres. The shared result of all these efforts is that, at low super-saturations, experimentally observed nucleation…

软凝聚态物质 · 物理学 2022-06-22 Wilkin Wöhler , Tanja Schilling

The crystallization of a metastable melt is one of the most important non equilibrium phenomena in condensed matter physics, and hard sphere colloidal model systems have been used for several decades to investigate this process by…

软凝聚态物质 · 物理学 2015-05-20 Tanja Schilling , Sven Dorosz , Hans Joachim Schoepe , George Opletal

We study crystal nucleation under the influence of sedimentation in a model of colloidal hard spheres via Brownian Dynamics simulations. We introduce two external fields acting on the colloidal fluid: a uniform gravitational field (body…

软凝聚态物质 · 物理学 2013-07-03 John Russo , Anthony C. Maggs , Daniel Bonn , Hajime Tanaka

With computer simulations of the hard sphere model, we examine in detail the microscopic pathway connecting the metastable melt to the emergence of crystalline clusters. In particular we will show that the nucleation of the solid phase does…

软凝聚态物质 · 物理学 2015-06-12 John Russo , Hajime Tanaka

A kinetic theory of homogeneous crystal nucleation in unary droplets is presented taking into account that a crystal nucleus can form not only in the volume-based mode (with all its facets within the droplet) but also in the…

材料科学 · 物理学 2016-09-28 Yuri S. Djikaev

In the study of crystal nucleation via computer simulations, hard spheres are arguably the most extensively explored model system. Nonetheless, even in this simple model system, the complex thermodynamics of crystal nuclei can sometimes…

软凝聚态物质 · 物理学 2025-02-19 Marjolein de Jager , Carlos Vega , Pablo Montero de Hijes , Frank Smallenburg , Laura Filion

Hard-sphere model systems are well-suited in both experiment and simulations to investigate fundamental aspects of the crystallization of fluids. In experiments on colloidal models of hard-sphere fluids, the uid is unavoidably at contact…

软凝聚态物质 · 物理学 2021-04-28 Jorge R. Espinosa , Carlos Vega , Chantal Valeriani , Daan Frenkel , Eduardo Sanz

We determined bulk crystal nucleation rates in aqueous suspensions of charged spheres at low metastability. Experiments were performed in dependence on electrolyte concen-tration and for two different particle number densities. The…

软凝聚态物质 · 物理学 2021-11-04 Jürgen Schwarz , Paul Leiderer , Thomas Palberg

In supercooled liquids, vitrification generally suppresses crystallization. Yet some glasses can still crystallize despite the arrest of diffusive motion. This ill-understood process may limit the stability of glasses, but its microscopic…

It is widely believed that heterogeneous nucleation occurs without an activation process when the surface is completely wettable. In this report, we review our previous work [J.Chem.Phys {\bf 134}, 234709 (2011)] to show that the critical…

材料科学 · 物理学 2013-07-04 Masao Iwamatsu

We explore the crystallization in a colloidal monolayer on a structured template starting from a few-particle nucleus. The competition between the substrate structure and that of the growing crystal induces a new crystal growth scenario.…

软凝聚态物质 · 物理学 2013-07-09 Tim Neuhaus , Michael Schmiedeberg , Hartmut Löwen
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