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We reassess the modeling of amorphous silica bilayers as a two-dimensional classical system whose particles interact with an effective pairwise potential. We show that it is possible to reparameterize the potential developed by Roy, Heyde,…

Statistical Mechanics · Physics 2025-01-22 Marco Dirindin , Daniele Coslovich

We use a structure analysis technique that quantifies cluster geometries using machine learning to identify a bicapped square antiprism (BSAP) as the nearest-neighbor cluster involved in the glass transition in Pd82Si18, a prototype…

Materials Science · Physics 2019-01-23 Jason J. Maldonis , Paul M. Voyles

The liquid structure of a glass-forming binary alloy is studied using molecular dynamics simulations. The analysis combines common neighbour analysis with the geometrical approach of Frank and Kasper to establish that the supercooled liquid…

Soft Condensed Matter · Physics 2010-03-11 Ulf R. Pedersen , Thomas B. Schrøder , Jeppe C. Dyre , Peter Harrowell

We analytically and numerically characterize the structure of hard-sphere fluids in order to review various geometrical frustration scenarios of the glass transition. We find generalized polytetrahedral order to be correlated with…

Statistical Mechanics · Physics 2013-01-07 Benoit Charbonneau , Patrick Charbonneau , Gilles Tarjus

We consider unsupervised learning methods for characterizing the disordered microscopic structure of supercooled liquids and glasses. Specifically, we perform dimensionality reduction of smooth structural descriptors that describe radial…

Statistical Mechanics · Physics 2022-11-24 Daniele Coslovich , Robert L. Jack , Joris Paret

This key-issues review is a plea for a new focus on simpler and more realistic models of glass-forming fluids. It seems to me that we have too often been led astray by sophisticated mathematical models that beautifully capture some of the…

Statistical Mechanics · Physics 2015-06-17 J. S. Langer

The precise nature of complex structural relaxation as well as an explanation for the precipitous growth of relaxation time in cooling glass-forming liquids are essential to the understanding of vitrification of liquids. The dramatic…

Materials Science · Physics 2017-06-14 Kaikin Wong , Rithin P. Krishnan , Changjiu Chen , Qing Du , Dehong Yu , Zhaoping Lu , Suresh M. Chathoth

Transition-metal atoms with d electrons sometimes form clusters in crystals, which significantly affects the physical properties. Such a cluster formation frequently accompanies a change in the crystal system, leading to the presence of…

Strongly Correlated Electrons · Physics 2024-03-13 Shunsuke Kitou , Masaki Gen , Yuiga Nakamura , Yusuke Tokunaga , Taka-hisa Arima

Glasses remain an elusive and poorly understood state of matter. For example, it is not clear how we can design an efficient macroscopic glass former by tuning the properties of its microscopic building blocks. In this paper, we propose a…

Soft Condensed Matter · Physics 2019-02-06 Susana Marín Aguilar , Henricus H. Wensink , Giuseppe Foffi , Frank Smallenburg

We study aging in a colloidal suspension consisting of micron-sized particles in a liquid. This system is made glassy by increasing the particle concentration. We observe samples composed of particles of two sizes, with a size ratio of…

Soft Condensed Matter · Physics 2008-10-02 Jennifer M. Lynch , Gianguido C. Cianci , Eric R. Weeks

The transition from a flowing to a static state in a granular material is studied using large-scale, 3D particle simulations. Similar to glasses, this transition is manifested in the development of a plateau in the contact normal force…

Statistical Mechanics · Physics 2007-05-23 L. E. Silbert , D. Ertas , G. S. Grest , T. C. Halsey , D. Levine

Structural relaxation in binary hard spherical particles has been shown recently to exhibit a wealth of remarkable features when size disparity or mixture's composition is varied. In this paper, we test whether or not similar dynamical…

Soft Condensed Matter · Physics 2014-12-03 Wen-Sheng Xu , Zhao-Yan Sun , Li-Jia An

The early stage evolution of local atomic structures in a multicomponent metallic glass during its crystallization process has been investigated via molecular dynamics simulation. It is found that the initial thermal stability and earliest…

Materials Science · Physics 2024-03-26 Lin Ma , Xiao-Dong Yang , Feng Yang , Xin-Jia Zhou , Zhen-Wei Wu

We map out the solid-state morphologies formed by model soft-pearl-necklace polymers as a function of bending stiffness $k_b$ spanning the range from fully flexible to rodlike chains. The ratio of Kuhn length to bead diameter ($l_K/r_0$)…

Soft Condensed Matter · Physics 2015-10-28 Hong T. Nguyen , Tyler B. Smith , Robert S. Hoy , Nikos Ch. Karayiannis

We explore the nature of glass-formation in variable spatial dimensionality ($d$) based on the generalized entropy theory, a synthesis of the Adam-Gibbs model with direct computation of the configurational entropy of polymer fluids using an…

Soft Condensed Matter · Physics 2016-11-09 Wen-Sheng Xu , Jack F. Douglas , Karl F. Freed

Using molecular dynamics simulation, we examine the dynamics of crystal, polycrystal, and glass in a Lennard-Jones binary mixture composed of small and large particles in two dimensions. The crossovers occur among these states as the…

Soft Condensed Matter · Physics 2010-05-04 Hayato Shiba , Akira Onuki

The effect of ring stiffness and pressure on the glassy dynamics of a thermal assembly of two-dimensional ring polymers is investigated using extensive coarse-grained molecular dynamics simulations. In all cases, dynamical slowing down is…

Soft Condensed Matter · Physics 2023-06-06 Sayantan Ghosh , Satyavani Vemparala , Pinaki Chaudhuri

The shear-banding instability in quasi-statically driven bulk metallic glasses emerges from collective dynamics, mediated by shear transformation zones and associated non-local elastic interactions. It is also phenomenologically known that…

We use confocal microscopy to study the motions of particles in concentrated colloidal systems. Near the glass transition, diffusive motion is inhibited, as particles spend time trapped in transient ``cages'' formed by neighboring…

Disordered Systems and Neural Networks · Physics 2009-11-07 Eric R. Weeks , D. A. Weitz

In this note we present numerical simulations of binary mixtures and we find indications for a thermodynamic transition to a glassy phase. We find that below the transition point the off equilibrium correlation functions and response…

Disordered Systems and Neural Networks · Physics 2009-10-30 Giorgio Parisi