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The enormous structural and chemical diversity of metal-organic frameworks (MOFs) forces researchers to actively use simulation techniques on an equal footing with experiments. MOFs are widely known for outstanding adsorption properties, so…

Materials Science · Physics 2021-11-22 Vadim V. Korolev , Yurii M. Nevolin , Thomas A. Manz , Pavel V. Protsenko

The difficulties in dealing with discontinuities related to a sharp crack are overcome in the phase-field approach for fracture by modeling the crack as a diffusive object being described by a continuous field having high gradients. The…

Computational Engineering, Finance, and Science · Computer Science 2023-12-05 Sindhu Nagaraja , Mohamed Elhaddad , Marreddy Ambati , Stefan Kollmannsberger , Laura De Lorenzis , Ernst Rank

The industrial application motivating this work is the fatigue computation of aircraft engines' high-pressure turbine blades. The material model involves nonlinear elastoviscoplastic behavior laws, for which the parameters depend on the…

Numerical Analysis · Mathematics 2019-08-12 Fabien Casenave , Nissrine Akkari

This paper presents a novel approach for solving fourth-order phase-field models in brittle fracture mechanics using the Interior Penalty Finite Element Method (IP-FEM). The fourth-order model improves numerical stability and accuracy…

Numerical Analysis · Mathematics 2025-04-15 Tian Tian , Chen Chunyu , Wei Huayi

Catastrophic failure in brittle materials is often due to the rapid growth and coalescence of cracks aided by high internal stresses. Hence, accurate prediction of maximum internal stress is critical to predicting time to failure and…

Machine learning (ML) is shown to predict new alloys and their performances in a high dimensional, multiple-target-property design space that considers chemistry, multi-step processing routes, and characterization methodology variations. A…

Materials Science · Physics 2020-10-12 Sen Liu , Branden B. Kappes , Behnam Amin-ahmadi , Othmane Benafan , Xiaoli Zhang , Aaron P. Stebner

This paper proposes the use of a Spectral method to simulate diffusive moisture transfer through porous materials as a Reduced-Order Model (ROM). The Spectral approach is an a priori method assuming a separated representation of the…

Computational Physics · Physics 2020-02-20 Suelen Gasparin , Julien Berger , Denys Dutykh , Nathan Mendes

The objective of this paper is to design novel multi-layer neural network architectures for multiscale simulations of flows taking into account the observed data and physical modeling concepts. Our approaches use deep learning concepts…

Numerical Analysis · Mathematics 2018-06-14 Yating Wang , Siu Wun Cheung , Eric T. Chung , Yalchin Efendiev , Min Wang

In this work, we introduce a new Hybrid High-Order method for the numerical simulation of fracture propagation based on phase-field models. The proposed method supports general meshes made of polygonal/polyhedral elements, which provides…

Numerical Analysis · Mathematics 2025-11-20 Alessandra Crippa , Julien Coatléven , Daniele A. Di Pietro , Nicolas Guy , Yousef Soleiman

A crucial aspect in phase-field modeling, based on the variational formulation of brittle fracture, is the accurate representation of how the fracture surface energy is dissipated during the fracture process in the energy competition within…

Numerical Analysis · Mathematics 2025-01-29 Luigi Greco , Eleonora Maggiorelli , Matteo Negri , Alessia Patton , Alessandro Reali

In this work, we develop and analyze a higher-order finite element method for the multidimensional fragmentation equation. To the best of our knowledge, this is the first study to establish a rigorous, conforming finite element framework…

Numerical Analysis · Mathematics 2026-04-10 Arushi , Naresh Kumar

Failure trajectories, identifying the probable failure zones, and damage statistics are some of the key quantities of relevance in brittle fracture applications. High-fidelity numerical solvers that reliably estimate these relevant…

Machine Learning · Computer Science 2022-02-16 Somdatta Goswami , Minglang Yin , Yue Yu , George Karniadakis

This article presents a comparison of various implementations of the Lattice Discrete Particle Model (LDPM) for the numerical simulation of concrete and other heterogeneous quasibrittle materials. The comparison involves the use of…

Machine Learning (ML) techniques are revolutionizing the way to perform efficient materials modeling. Nevertheless, not all the ML approaches allow for the understanding of microscopic mechanisms at play in different phenomena. To address…

Materials Science · Physics 2022-06-22 Udaykumar Gajera , Loriano Storchi , Danila Amoroso , Francesco Delodovici , Silvia Picozzi

This work presents a variational physics-informed deep learning framework for phase-field modelling of brittle crack propagation in anisotropic media. Previous Deep Ritz Method (DRM) approaches have focused on second-order, isotropic…

Computational Physics · Physics 2026-04-15 N. Plungė , P. Brommer , R. S. Edwards , E. G. Kakouris

Finding and properly segmenting cracks in images of concrete is a challenging task. Cracks are thin and rough and being air filled do yield a very weak contrast in 3D images obtained by computed tomography. Enhancing and segmenting dark…

Computer Vision and Pattern Recognition · Computer Science 2025-01-31 Tin Barisin , Christian Jung , Anna Nowacka , Claudia Redenbach , Katja Schladitz

The variational approach to fracture is effective for simulating the nucleation and propagation of complex crack patterns, but is computationally demanding. The model is a strongly nonlinear non-convex variational inequality that demands…

Numerical Analysis · Mathematics 2016-05-18 Patrick E. Farrell , Corrado Maurini

This paper addresses the problem of robotic cutting during disassembly of products for materials separation and recycling. Waste handling applications differ from milling in manufacturing processes, as they engender considerable variety and…

Robotics · Computer Science 2023-08-30 Jamie Hathaway , Alireza Rastegarpanah , Rustam Stolkin

Real-time simulation of elastic structures is essential in many applications, from computer-guided surgical interventions to interactive design in mechanical engineering. The Finite Element Method is often used as the numerical method of…

Machine Learning · Computer Science 2021-09-21 Alban Odot , Ryadh Haferssas , Stéphane Cotin

This paper presents a framework for modeling failure in quasi-brittle geomaterials under different loading conditions. A micromechanics-based model is proposed in which the field variables are linked to physical mechanisms at the microcrack…

Materials Science · Physics 2021-11-12 Jacinto Ulloa , Jef Wambacq , Roberto Alessi , Esteban Samaniego , Geert Degrande , Stijn François