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Complex fluid-fluid interfaces featuring mesoscale structures with adsorbed particles are key components of newly designed materials which are continuously enriching the field of soft matter. Simulation tools which are able to cope with the…

Soft Condensed Matter · Physics 2014-02-24 Marcello Sega , Mauro Sbragaglia , Sofia Sergeevna Kantorovich , Alexey Olegovich Ivanov

We use molecular dynamics simulations to test integral equation theory predictions for the structure of fluids of spherical particles with eight different piecewise-constant pair interaction forms comprising a hard core and a combination of…

Soft Condensed Matter · Physics 2015-05-01 Kyle B. Hollingshead , Thomas M. Truskett

The accelerated inverse design of complex material properties - such as identifying a material with a given stress-strain response over a nonlinear deformation path - holds great potential for addressing challenges from soft robotics to…

Computational Engineering, Finance, and Science · Computer Science 2024-02-02 Jan-Hendrik Bastek , Dennis M. Kochmann

Finite mixture models that allow for a broad range of potentially non-elliptical cluster distributions is an emerging methodological field. Such methods allow for the shape of the clusters to match the natural heterogeneity of the data,…

We investigated the equilibrium properties of a one-dimensional system of classical particles which interact in pairs through a bounded repulsive potential with a Gaussian shape. Notwithstanding the absence of a proper fluid-solid phase…

Soft Condensed Matter · Physics 2012-01-11 Cristina Speranza , Santi Prestipino , Paolo V. Giaquinta

Based on statistical approach we described possible formation of spatially inhomogeneous distribution in the system of interacting Fermi particles by long-rage forces, and we demonstrated nonperturbative calculation of the partition…

Statistical Mechanics · Physics 2009-11-13 K. V. Grigorishin , B. I. Lev

Singlet fission has emerged as one of the most exciting phenomena known to improve the efficiencies of different types of solar cells and has found uses in diverse optoelectronic applications. The range of available singlet fission…

An improved inverse simulated annealing method is presented to determine the structure of complex disordered systems from first principles in agreement with available experimental data or desired predetermined target properties. The…

Materials Science · Physics 2014-10-07 Jan H. Los , Silvia Gabardi , Marco Bernasconi , Thomas D. Kühne

The old problem of a singular, inverse square potential in nonrelativistic quantum mechanics is treated employing a field-theoretic, functional renormalization method. An emergent contact coupling flows to a fixed point or develops a limit…

High Energy Physics - Theory · Physics 2010-01-21 Sergej Moroz , Richard Schmidt

Self-folding is an emerging paradigm for the inverse design of three-dimensional structures. While most efforts have concentrated on the shape of the net, our approach introduces a new design dimension-bond specificity between the edges. We…

Soft Condensed Matter · Physics 2025-01-14 Diogo E. P. Pinto , Nuno A. M. Araújo , Petr Šulc , John Russo

In an attempt to test the possibility of solving the inverse problem for liquid metals i.e. obtaining the effective pair potential from the experimental structure factor, we solve the modified Hypernetted-Chain Integral equation for liquid…

Statistical Mechanics · Physics 2020-06-01 Moustafa Sayem El-Daher

Metasurfaces are an emerging technology that may supplant many of the conventional optics found in imaging devices, displays, and precision scientific instruments. Here, we develop a method for designing optical systems composed of multiple…

Optics · Physics 2019-10-23 Adam S. Backer

The inverse problem method is tested for a class of monomer-dimer statistical mechanics models that contain also an attractive potential and display a mean-field critical point at a boundary of a coexistence line. The inversion is obtained…

Statistical Mechanics · Physics 2017-05-24 Pierluigi Contucci , Rachele Luzi , Cecilia Vernia

We study the structure of colloidal fluids with reference to colloid-polymer mixtures. We compare the one component description of the Asakura-Oosawa (AO) idealisation of colloid-polymer mixtures with the full two-component model. We also…

Soft Condensed Matter · Physics 2015-01-20 Jade Taffs , Alex Malins , Stephen R. Williams , C. Patrick Royall

Clustered data arise naturally in many scientific and applied research settings where units are grouped within clusters. They are commonly analyzed using linear mixed models to account for within-cluster correlations. This article focuses…

Methodology · Statistics 2025-10-10 Zhi Yang Tho , Raymond Chambers , A. H. Welsh

We present an experimental study of the statistical properties of millimeter-size spheres floating on the surface of a turbulent flow. The flow is generated in a layer of liquid metal by an electromagnetic forcing. By using two magnet…

Fluid Dynamics · Physics 2016-07-04 Pablo Gutiérrez , Sébastien Aumaître

The dynamics of randomly crosslinked liquids is addressed via a Rouse- and a Zimm-type model with crosslink statistics taken either from bond percolation or Erdoes-Renyi random graphs. While the Rouse-type model isolates the effects of the…

Soft Condensed Matter · Physics 2007-05-23 Henning Löwe , Peter Müller , Annette Zippelius

In this article, we demonstrate a method for inducing reversible crystal-to-crystal transitions in binary mixtures of soft colloidal particles. Through a controlled decrease of salinity and increasingly dominating electrostatic…

Soft Condensed Matter · Physics 2021-08-30 Jasper N. Immink , Maxime J. Bergman , J. J. Erik Maris , Joakim Stenhammar , Peter Schurtenberger

The cluster perturbation theory (CPT) is one of the simplest but systematic quantum cluster approaches to lattice models of strongly correlated electrons with local interactions. By treating the inter-cluster potential, in addition to the…

Strongly Correlated Electrons · Physics 2011-05-27 Matthias Balzer , Michael Potthoff

We develop a unified framework for identifying bounds to maximum resonant nonlinear optical susceptibilities, and for "inverse designing" quantum-well structures that can approach such bounds. In special cases (e.g. second-harmonic…