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We employ a canonical variational framework for the predictive characterization of structural instabilities that develop during the diffusion-driven transient swelling of hydrogels under geometrical constraints. The variational formulation…

数值分析 · 数学 2025-04-11 Siddharth Sriram , Elten Polukhov , Marc-Andre Keip

The goal of this paper is to develop and analyze some fully discrete finite element methods for a displacement-pressure model modeling swelling dynamics of polymer gels under mechanical constraints. In the model, the swelling dynamics is…

数值分析 · 数学 2009-03-25 Xiaobing Feng , Yinnian He

In this study, we present a finite element solver for a thermodynamically consistent electrolyte model that accurately captures multicomponent ionic transport by incorporating key physical phenomena such as steric effects, solvation, and…

计算工程、金融与科学 · 计算机科学 2026-01-28 Jan Habscheid , Satyvir Singh , Lambert Theisen , Stefanie Braun , Manuel Torrilhon

This study explores reduced-order modeling for analyzing the time-dependent diffusion-deformation of hydrogels. The full-order model describing hydrogel transient behavior consists of a coupled system of partial differential equations in…

计算工程、金融与科学 · 计算机科学 2024-06-18 Gopal Agarwal , Jorge-Humberto Urrea-Quintero , Henning Wessels , Thomas Wick

The layer-upon-layer approach in additive manufacturing, open or closed cells in polymeric or metallic foams involve an intrinsic microstructure tailored to the underlying applications. Homogenization of such architectured materials creates…

计算工程、金融与科学 · 计算机科学 2025-09-24 B. Cagri Sarar , M. Erden Yildizdag , Francesco Fabbrocino , B. Emek Abali

Most thermodynamic modeling of hydrogels focused on predicting their final volumes in equilibrium with water, built on Flory's theories for the entropy of mixing and rubber elasticity, and Donnan's equilibrium conditions if polyelectrolyte…

化学物理 · 物理学 2022-01-27 Gang Chen

We introduce a microscopically realistic model of a physical gel and use computer simulations to study its static and dynamic properties at thermal equilibrium. The phase diagram comprises a sol phase, a coexistence region ending at a…

软凝聚态物质 · 物理学 2015-06-25 Pablo I. Hurtado , Ludovic Berthier , Walter Kob

Using a well defined soft model glass in the framework of Molecular Dynamics simulations, the inherent structures are probed by means of a recently developed deformation protocol that aims to capture the Dynamical Heterogeneities (DH), as…

无序系统与神经网络 · 物理学 2013-02-15 F. Leonforte

We present a finite element approach for diffusion problems with thermal fluctuations based on a fluctuating hydrodynamics model. The governing transport equations are stochastic partial differential equations with a fluctuating forcing…

数值分析 · 数学 2024-03-21 P. Martínez-Lera , M. De Corato

A thermodynamically consistent mathematical model for hydrogen adsorption in metal hydrides is proposed. Beside hydrogen diffusion, the model accounts for phase transformation accompanied by hysteresis, swelling, temperature and heat…

数学物理 · 物理学 2013-09-13 Tomas Roubicek , Giuseppe Tomassetti

Large-scale electrical and thermal currents in ordinary metals are well approximated by effective medium theory: global transport properties are governed by the solution to homogenized coupled diffusion equations. In some metals, including…

偏微分方程分析 · 数学 2021-02-03 Guillaume Bal , Andrew Lucas , Mitchell Luskin

We present a finite element discretization of a non-linear diffusion equation used in the field of critical phenomena and, more recently, in the context of Dynamic Density Functional Theory. The discretized equation preserves the structure…

统计力学 · 物理学 2015-06-23 J. A. de la Torre , Pep Español , Aleksandar Donev

We present a theoretical study of the phase diagram and the structure of a fluid adsorbed in high-porosity aerogels by means of an integral-equation approach combined with the replica formalism. To simulate a realistic gel environment, we…

无序系统与神经网络 · 物理学 2009-11-07 V. Krakoviack , E. Kierlik , M. -L. Rosinberg , G. Tarjus

We present recent finite element numerical results on a model convection-diffusion problem in the singular perturbed case when the convection term dominates the problem. We compare the standard Galerkin discretization using the linear…

数值分析 · 数学 2023-02-16 Constantin Bacuta , Daniel Hayes , Tyler O'Grady

The role of heterogeneity in the plastic flow of thin ferrite specimens is investigated in this study. This is done through a recently introduced quasi-2D experimental-numerical framework that allows for a quantitative comparison of the…

材料科学 · 物理学 2024-02-27 J. Wijnen , T. Vermeij , J. P. M. Hoefnagels , M. G. D. Geers , R. H. J. Peerlings

The paper deals with the homogenization of deformable porous media saturated by two-component electrolytes. The model relevant to the microscopic scale describes steady states of the medium while reflecting essential physical phenomena,…

计算物理 · 物理学 2019-01-25 Jana Turjanicová , Eduard Rohan , Vladimír Lukeš

A polymer network can imbibe water, forming an aggregate called hydrogel, and undergo large and inhomogeneous deformation with external mechanical constraint. Due to the large deformation, nonlinearity plays a crucial role, which also…

生物物理 · 物理学 2011-03-04 Hui-Hui Dai , Zilong Song

Thermo-responsive hydrogels are a promising material for creating controllable actuators for use in micro-scale devices, since they expand and contract significantly (absorbing or expelling fluid) in response to relatively small temperature…

软凝聚态物质 · 物理学 2022-08-18 Matthew D. Butler , Thomas D. Montenegro-Johnson

A recent paper [J. A. Evans, D. Kamensky, Y. Bazilevs, "Variational multiscale modeling with discretely divergence-free subscales", Computers & Mathematics with Applications, 80 (2020) 2517-2537] introduced a novel stabilized finite element…

数值分析 · 数学 2021-12-21 Sajje Lee Calfy , John A. Evans , David Kamensky

This work presents a fully physical model of the hydrogen diffusion and trapping kinetics in metals, integrating permeation and thermal desorption within a unified framework. Based on the McNabb and Foster approach, it requires only binding…

材料科学 · 物理学 2025-09-23 Paolo Emilio Di Nunzio
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