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A strategy is developed for generating equilibrated high molecular-weight polymer melts described with microscopic detail by sequentially backmapping coarse-grained (CG) configurations. The microscopic test model is generic but retains…

Soft Condensed Matter · Physics 2016-10-25 Guojie Zhang , Livia A. Moreira , Torsten Stuehn , Kostas Ch. Daoulas , Kurt Kremer

In this paper, maximum principles for Euclidean and hyperbolic discrete conformal structures on polyhedral surfaces are established. These maximum principles unify and generalize the maximum principles for vertex scalings and different…

Metric Geometry · Mathematics 2025-06-19 Yanwen Luo , Xu Xu , Chao Zheng

The mechanism by which a patterned state accommodates the breaking of translational symmetry by a phase boundary or a sample wall has been addressed in the context of Landau branching in type-I superconductors, refinement of magnetic…

Soft Condensed Matter · Physics 2015-05-13 Jiangshui Huang , Benny Davidovitch , Christian Santangelo , Thomas P. Russell , Narayanan Menon

Packing problems have been of great interest in many diverse contexts for many centuries. The optimal packing of identical objects has been often invoked to understand the nature of low temperature phases of matter. In celebrated work,…

Statistical Mechanics · Physics 2009-11-13 Antonio Trovato , Trinh X. Hoang , Jayanth R. Banavar , Amos Maritan

We introduce a novel method for bounding high-order multi-dimensional polynomials in finite element approximations. The method involves precomputing optimal piecewise-linear bounding boxes for polynomial basis functions, which can then be…

Numerical Analysis · Mathematics 2025-04-17 Tarik Dzanic , Tzanio Kolev , Ketan Mittal

We study the two-dimensional hierarchical rectangle packing problem, motivated by applications in analog integrated circuit layout, facility layout, and logistics. Unlike classical strip or bin packing, the dimensions of the container are…

Computational Geometry · Computer Science 2025-12-24 Josef Grus , Zdeněk Hanzálek , Christian Artigues , Cyrille Briand , Emmanuel Hebrard

Shear bands are narrow zones of intense shear observed during plastic deformations of metals at high strain rates. Because they often precede rupture, their study attracted attention as a mechanism of material failure. Here, we aim to…

Analysis of PDEs · Mathematics 2016-11-15 Min-Gi Lee , Athanasios Tzavaras

We study the problem of partitioning a given simple polygon $P$ into a minimum number of connected polygonal pieces, each of bounded size. We describe a general technique for constructing such partitions that works for several notions of…

Computational Geometry · Computer Science 2024-10-23 Mikkel Abrahamsen , Nichlas Langhoff Rasmussen

A layer of monodisperse circular steel disks in a nearly square horizontal cell forms, for shear amplitudes SA $\le$ 0.08, hexagonal close-packed crystallites that grow and merge until a single crystal fills the container. Increasing the…

Soft Condensed Matter · Physics 2024-11-07 Siyuan Su , Jie Zhang , Charles Radin , Harry L. Swinney

Mathematical crystal chemistry views crystal structures as the optimal solutions of mathematical optimization problem formalizing inorganic structural chemistry. This paper introduces the minimum and maximum atomic radii depending on the…

Materials Science · Physics 2025-04-01 Ryotaro Koshoji

Sheared multi-component bulk metallic glasses are characterized by both chemical and structural disorder that define their properties. We investigate the behavior of the local, microstructural elastic modulus across the plastic yielding…

Materials Science · Physics 2022-07-28 Kamran Karimi , Mikko J. Alava , Stefanos Papanikolaou

We apply polynomial techniques (linear programming) to obtain lower and upper bounds on the covering radius of spherical designs as function of their dimension, strength, and cardinality. In terms of inner products we improve the lower…

Combinatorics · Mathematics 2020-07-14 Peter Boyvalenkov , Maya Stoyanova

The clean surfaces of quasicrystals, orthogonal to the directions of the main symmetry axes, have a terrace-like appearance. We extend the Bravais' rule for crystals to quasicrystals, allowing that instead of a single atomic plane a layer…

Materials Science · Physics 2009-11-10 Zorka Papadopolos , Gerald Kasner

Manipulating the way in which colloidal particles self-organise is a central challenge in the design of functional soft materials. Meeting this challenge requires the use of building blocks that interact with one another in a highly…

Soft Condensed Matter · Physics 2021-03-30 Joe G Donaldson , Peter Schall , Laura Rossi

Paradigmatic model systems, which are used to study the mechanical response of matter, are random networks of point-atoms, random sphere packings, or simple crystal lattices, all of these models assume central-force interactions between…

Soft Condensed Matter · Physics 2016-01-14 M. Schlegel , J. Brujic , E. M. Terentjev , A. Zaccone

We consider the isoperimetric problem for clusters in the plane with a double density, that is, perimeter and volume depend on two weights. In this paper we consider the isotropic case, in the parallel paper "On the Steiner property for…

Analysis of PDEs · Mathematics 2023-09-11 Valentina Franceschi , Aldo Pratelli , Giorgio Stefani

We present a geometric multilevel optimization approach that smoothly incorporates box constraints. Given a box constrained optimization problem, we consider a hierarchy of models with varying discretization levels. Finer models are…

Optimization and Control · Mathematics 2024-04-23 Sebastian Müller , Stefania Petra , Matthias Zisler

Conical surfaces pose an interesting challenge to crystal growth: a crystal growing on a cone can wrap around and meet itself at different radii. We use a disk-packing algorithm to investigate how this closure constraint can geometrically…

Soft Condensed Matter · Physics 2024-01-15 Jessica H. Sun , Abigail Plummer , Grace H. Zhang , David R. Nelson , Vinothan N. Manoharan

We provide upper and lower bounds on the least-perimeter way to enclose and separate n regions of equal area in the plane. Along the way, inside the hexagonal honeycomb, we provide minimizers for each n .

Metric Geometry · Mathematics 2007-05-23 Aladar Heppes , Frank Morgan

The self-gravitating, spherically symmetric thin shells built of orbiting particles are sstudied. Two new features are found. One is the minimal possible value for an angular momentum of particles, above which elleptic orbits become…

General Relativity and Quantum Cosmology · Physics 2009-10-31 Victor Berezin , Maxim Okhrimenko