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We introduce structural heterogeneity, a new topological characteristic for semi-ordered materials that captures their degree of organisation at a mesoscopic level and tracks their time-evolution, ultimately detecting the order-disorder…

Isomorph theory is one of the promising theories to understand the quasi-universal relationship between thermodynamic, dynamic and structural characteristics. Based on the hidden scale invariance of the inverse power law potentials, it…

Statistical Mechanics · Physics 2019-07-31 Tae Jun Yoon , Min Young Ha , Emanuel A. Lazar , Won Bo Lee , Youn-Woo Lee

Voronoi tessellations have been used to model the geometric arrangement of cells in morphogenetic or cancerous tissues, however so far only with flat hypersurfaces as cell-cell contact borders. In order to reproduce the experimentally…

Biological Physics · Physics 2009-12-02 Martin Bock , Amit Kumar Tyagi , Jan-Ulrich Kreft , Wolfgang Alt

This paper presents the Voronoi diagram-based evolutionary algorithm (VorEAl). VorEAl partitions input space in abnormal/normal subsets using Voronoi diagrams. Diagrams are evolved using a multi-objective bio-inspired approach in order to…

Artificial Intelligence · Computer Science 2016-10-28 Marti Luis , Fansi-Tchango Arsene , Navarro Laurent , Marc Schoenauer

The microstructure of coagulated colloidal particles, for which the inter-particle potential is described by the DLVO theory, is strongly influenced by the particles' surface potential. Depending on its value, the resulting microstructures…

Soft Condensed Matter · Physics 2009-11-09 Iwan Schenker , Frank T. Filser , Tomaso Aste , Hans J. Herrmann , Ludwig J. Gauckler

Complex systems are usually represented as an intricate set of relations between their components forming a complex graph or network. The understanding of their functioning and emergent properties are strongly related to their structural…

Data Analysis, Statistics and Probability · Physics 2014-01-08 Sergio Gomez , Alberto Fernandez , Clara Granell , Alex Arenas

In this paper we present a novel two-scale framework to optimize the structure and the material distribution of an object given its functional specifications. Our approach utilizes multi-material microstructures as low-level building blocks…

Computational Engineering, Finance, and Science · Computer Science 2017-06-13 Bo Zhu , Mélina Skouras , Desai Chen , Wojciech Matusik

We present a novel method for characterizing the microstructure of a material from volumetric datasets such as 3D image data from computed tomography (CT). The method is based on a new statistical model for the distribution of voxel…

Materials Science · Physics 2021-01-06 Elise Otterlei Brenne , Vedrana Andersen Dahl , Peter Stanley Jørgensen

This paper focuses on identifying vertex characteristics in 2D images using topological asymptotic analysis. Vertex characteristics include both the location and the type of the vertex, with the latter defined by the number of lines forming…

Numerical Analysis · Mathematics 2026-04-01 Peter Gangl , Bochra Mejri , Otmar Scherzer

We detail the application of bounding volume hierarchies to accelerate second-virial evaluations for arbitrary complex particles interacting through hard and soft finite-range potentials. This procedure, based on the construction of…

Soft Condensed Matter · Physics 2017-12-14 Maxime M. C. Tortora , Jonathan P. K. Doye

Topological defects are singularities within a field that cannot be removed by continuous transformations. The definition of these irregularities requires an ordered reference configuration, calling into question whether they exist in…

Soft Condensed Matter · Physics 2025-01-06 Vinay Vaibhav , Arabinda Bera , Amelia C. Y. Liu , Matteo Baggioli , Peter Keim , Alessio Zaccone

Order parameters based on spherical harmonics and Fourier coefficients already play a significant role in condensed matter research in the context of systems of spherical or point particles. Here, we extend these types of order parameter to…

Soft Condensed Matter · Physics 2010-12-22 Aaron S. Keys , Christopher R. Iacovella , Sharon C. Glotzer

The functionality of materials is determined by their composition and microstructure, that is, the distribution and orientation of crystalline grains, grain boundaries and the defects within them. The characterisation of the material's…

We introduce a new self-consistent structure finding algorithm that parses large scale cosmological structure into clusters, filaments and voids. This structure finding algorithm probes the cosmological structure at multiple scales and…

Cosmology and Nongalactic Astrophysics · Physics 2016-05-04 Ali Snedden , Lara Arielle Phillips , Grant J. Mathews , Jared Coughlin , In-Saeng Suh , Aparna Bhattacharya

Cryo-electron tomography (cryo-ET) enables structural characterization of biomolecules under near-native conditions. Existing approaches for interpreting the resulting three-dimensional volumes are computationally expensive and have…

Quantitative Methods · Quantitative Biology 2025-10-28 Chengxuan Li , August George , Reece Neff , Doo Nam Kim , Trevor Moser , Kate Baldwin , Malio Nelson , Arsam Firoozfar , James E Evans , Margaret S Cheung

This article represents the computational model for spacial addresation of the sensors in the dynamically changing real-time internet of things system. The model bases on the Voronoi diagrams as a basic data structure. Problem - the correct…

Data Structures and Algorithms · Computer Science 2022-01-11 Almagul Kondybayeva , Giovanna Di Marzo

We point out that interesting features in high energy physics data can be determined from properties of Voronoi tessellations of the relevant phase space. For illustration, we focus on the detection of kinematic "edges" in two dimensions,…

High Energy Physics - Phenomenology · Physics 2015-06-16 Dipsikha Debnath , James S. Gainer , Doojin Kim , Konstantin T. Matchev

Higher-order topological phases (HOTPs) host exotic topological states that go beyond the traditional bulk-boundary correspondence. Up to now, there is still a lack of experimentally measurable momentum-space topological characterization…

Mesoscale and Nanoscale Physics · Physics 2024-12-05 Wei Jia , Bao-Zong Wang , Ming-Jian Gao , Jun-Hong An

Identifying local structural motifs and packing patterns of molecular solids is a challenging task for both simulation and experiment. We demonstrate two novel approaches to characterize local environments in different polymorphs of…

Materials Science · Physics 2024-04-02 Daisuke Kuroshima , Michael Kilgour , Mark E. Tuckerman , Jutta Rogal

We construct algorithms and topological invariants that allow us to distinguish the topological type of a surface, as well as functions and vector fields for their topological equivalence. In the first part (arXiv:2501.15657), we discused…

Geometric Topology · Mathematics 2025-02-17 Alexandr Prishlyak
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