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We analyze the structure diagram for binary clusters of Lennard-Jones particles by means of a global optimization approach for a large range of cluster sizes, compositions and interaction energies and present a publicly accessible database…

Soft Condensed Matter · Physics 2017-10-03 Marko Mravlak , Thomas Kister , Tobias Kraus , Tanja Schilling

Clusters of spherical particles with isotropic attraction favour compact structures that maximise the number of energetically optimal nearest-neighbour interactions. In contrast, dipolar interactions lead to the formation of chains with a…

We introduce a global optimization approach for binary clusters that for a given cluster size is able to directly search for the structure and composition that has the greatest stability. We apply this approach to binary Lennard-Jones…

Other Condensed Matter · Physics 2007-05-23 Jonathan P. K. Doye , Lars Meyer

We revisit the role of attractions in liquids and apply these concepts to colloidal suspensions. Two means are used to investigate the structure; the pair correlation function and a recently developed topological method. The latter…

Soft Condensed Matter · Physics 2011-01-11 Jade Taffs , Alex Malins , Stephen R. Williams , C. Patrick Royall

At low temperatures, colloidal particles with short-range attractive and long-range repulsive interactions can form various periodic microphases in bulk.In this paper, we investigate the self-assembly behaviour of colloids with competing…

Soft Condensed Matter · Physics 2023-12-12 Ningyi Li , Junhong Li , Lijingting Qing , Shicheng Ma , Yao Li , Baohui Li

Colloidal particles self assemble into a wide range of structures under external AC electric fields due to induced dipolar interactions [Yethiraj and Van Blaaderen Nature 421 513 (2003)]. As a result of these dipolar interactions, at low…

Soft Condensed Matter · Physics 2025-01-29 Xiaoyue Wu , Fiona C. Meldrum , Katherine Skipper , Yushi Yang , C. Patrick Royall

We examine in detail the causes of the structural transitions that occur for those small Lennard-Jones clusters that have a non-icosahedral global minima. Based on the principles learned from these examples we develop a method to construct…

Condensed Matter · Physics 2007-05-23 Jonathan P. K. Doye , Florent Calvo

We propose a method to determine the locally preferred structure of model liquids. This latter is obtained numerically as the global minimum of the effective energy surface of clusters formed by small numbers of particles embedded in a…

Soft Condensed Matter · Physics 2009-11-10 S. Mossa , G. Tarjus

Colloids can acquire a dipolar interaction in the presence of an external electric field. At high field strength, the particles form strings in the field direction. However at weaker field strength, competition with isotropic interactions…

Soft Condensed Matter · Physics 2024-06-25 Katherine Skipper , Fergus J. Moore , C. Patrick Royall

Active matter has thrived in recent years, driven both by the insight that it underlies fundamental processes in nature, and by its vast potential for applications. This allows for innovation both inspired by experimental observations, and…

Soft Condensed Matter · Physics 2026-02-03 Margaret Rosenberg , Hartmut Löwen

Recently, Locatelli and Schoen proposed a transformation of the potential energy that aids the global optimization of Lennard-Jones clusters with non-icosahedral global minima. These cases are particularly difficult to optimize because the…

Condensed Matter · Physics 2007-05-23 Jonathan Doye

Studying physical mechanisms and common geometric principles underlying known spherical packings is crucial for rational design of synthetic nanocontainers. Here we model the growth of small spherical shells containing n<72 identical…

Soft Condensed Matter · Physics 2026-03-16 Ivan Yu. Golushko , Olga V. Konevtsova , Daria S. Roshal , Sergei B. Rochal

Assembly of spherical colloidal particles into extended structures, including linear strings, in the absence of directional interparticle bonding interactions or external perturbation could facilitate the design of new functional materials.…

Soft Condensed Matter · Physics 2019-10-15 Debapriya Banerjee , Beth A. Lindquist , Ryan B. Jadrich , Thomas M. Truskett

We investigate the self-organization of point-particles with short-range interactions modeled via simple 1D and 2D Hubbard-like models. We show how various properties emerge such as, boson-like ordering leading to topological structures in…

Strongly Correlated Electrons · Physics 2020-09-08 Ioannis Kleftogiannis , Ilias Amanatidis

The dense packing of interacting particles on spheres has proved to be a useful model for virus capsids and colloidosomes. Indeed, icosahedral symmetry observed in virus capsids corresponds to potential energy minima that occur for magic…

Soft Condensed Matter · Physics 2017-03-03 Stefan Paquay , Halim Kusumaatmaja , David J. Wales , Roya Zandi , Paul van der Schoot

We study metastable clusters in a colloidal system with competing interactions. A short-ranged polymer-induced attraction drives clustering, while a weak, long-ranged electrostatic repulsion prevents extensive aggregation. We compare…

We report our studies of the potential energy surface (PES) of selected binary Lennard-Jones clusters. The effect of adding selected impurity atoms to a homogeneous cluster is explored. Inherent structures and transition states are found by…

Materials Science · Physics 2009-11-10 Dubravko Sabo , J. D. Doll , David L. Freeman

We report on self-assemblies formed from spherical patchy particles interacting by a long-range attraction through a patch region in a two-dimensional system. We performed Monte Carlo simulations to find stable structures in a system with…

Soft Condensed Matter · Physics 2019-09-05 Masahide Sato

Mutually repelling particles form spontaneously ordered clusters when forced into confinement. The clusters may adopt similar spatial arrangements even if the underlying particle interactions are contrastingly different. Here we demonstrate…

Soft Condensed Matter · Physics 2026-02-13 P. D. S. de Lima , R. De La Cour , K. Gaff , J. M. de Araújo , S. J. Cox , M. S. Ferreira , S. Hutzler

Colloidal particles, amphiphiles, and functionalized nanoparticles are examples of systems that frequently exhibit short-range attractions coupled with long-range repulsions. In this work, we observe striking differences in the dynamics of…

Soft Condensed Matter · Physics 2017-06-01 Jakub Pȩkalski , Andrew P. Santos , Athanassios Z. Panagiotopoulos
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