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This short paper presents the potential of using machine learning to predict materials behaviour in the context of hydrogen interaction with steel. Effort has been made to understand the quality, and amount of data needed to get improved…

Materials Science · Physics 2021-10-22 M. Amir Siddiq

Interplay between hydrogen and nanovoids, despite long-recognized as a central aspect in hydrogen-induced damages in structural materials, remains poorly understood. Focusing on tungsten as a model BCC system, the present study, for the…

Materials Science · Physics 2019-07-17 Jie Hou , Xiang-Shan Kong , Xuebang Wu , Jun Song , C. S. Liu

In the U.S., approximately 17 patients die each day awaiting an organ transplant, a crisis driven by the inability to store organs long-term via methods like cryopreservation. A primary failure mechanism is the severe thermo-mechanical…

Soft Condensed Matter · Physics 2025-11-20 Ali Saeedi , Ram Devireddy , Mrityunjay Kothari

We combine state-of-the-art thermo-metallurgical welding process modelling with coupled diffusion-elastic-plastic phase field fracture simulations to predict the failure states of hydrogen transport pipelines. This enables quantitatively…

Computational Engineering, Finance, and Science · Computer Science 2025-06-24 J. Wijnen , J. Parker , M. Gagliano , E. Martínez-Pañeda

Fracture in aluminum alloys with precipitates involves at least two mechanisms, namely, ductile fracture of the aluminum-rich matrix and brittle fracture of the precipitates. In this work, a coupled crystal plasticity-phase field model for…

Materials Science · Physics 2022-05-02 Samad Vakili , Pratheek Shanthraj , Franz Roters , Jaber R. Mianroodi , Dierk Raabe

Ever more stringent regulations on greenhouse gas emissions from transportation motivate efforts to revisit materials used for vehicles. High-strength Al-alloys often used in aircrafts could help reduce the weight of automobiles, but are…

This study addresses ductile fracture of single grains in metals by modeling of the formation and propagation of transgranular cracks. A proposed model integrates gradient extended hardening, phase-field modeling for fracture, and crystal…

Numerical Analysis · Mathematics 2024-11-01 Kim Louisa Auth , Jim Brouzoulis , Magnus Ekh

Hydrogen atoms absorbed by metals in the hydrogen-containing environments can lead to the premature fracture of the metal components used in load-bearing conditions. Since metals used in practice are mostly polycrystalline, grain boundaries…

Materials Science · Physics 2018-09-17 Liang Wan , Wen Tong Geng , Akio Ishii , Jun-Ping Du , Nobuyuki Ishikawa , Hajime Kimizuka , Shigenobu Ogata

High strength steels are susceptible to H-induced failure, which is typically caused by the presence of diffusible H in the microstructure. The diffusivity of H in austenitic steels with fcc crystal structure is slow. The austenitic steels…

Materials Science · Physics 2023-09-28 Heena Khanchandani , Stefan Zeiler , Lucas Strobel , Mathias Goeken , Peter Felfer

Hydrogen as a fuel can be stored safely with high volumetric density in metals. It can, however, also be detrimental to metals causing embrittlement. Understanding fundamental behavior of hydrogen at atomic scale is key to improve the…

Materials Science · Physics 2020-02-05 Sytze de Graaf , Jamo Momand , Christoph Mitterbauer , Sorin Lazar , Bart J. Kooi

Zirconium alloys are widely used in the nuclear industry because of their high strength, good corrosion resistance and low neutron absorption cross-section. However, zirconium has strong affinity for hydrogen which leads to hydrogen…

Materials Science · Physics 2014-08-21 T. Maimaitiyili , A. Steuwer , J. Blomquist , B. Matthew , Z. Olivier , J. Andrieux , C. Bjerken , R. Fabienne

Enabling a hydrogen economy requires the development of materials resistant to hydrogen embrittlement (HE). More than 100 years of research have led to several mechanisms and models describing how hydrogen interacts with lattice defects and…

We present a new theoretical and numerical phase field-based formulation for predicting hydrogen-assisted fatigue. The coupled deformation-diffusion-damage model presented enables predicting fatigue crack nucleation and growth for arbitrary…

Computational Engineering, Finance, and Science · Computer Science 2021-10-02 Alireza Golahmar , Philip K. Kristensen , Christian F. Niordson , Emilio Martínez-Pañeda

Large scale modelling of fluid flow coupled with solid failure in geothermal reservoirs or hydrocarbon extraction from reservoir rocks usually involves behaviours at two scales: lower scale of the inelastic localization zone, and larger…

Soft Condensed Matter · Physics 2014-06-06 Giang D. Nguyen , Abbas El-Zein , Terry Bennett

We formulate a continuum electro-chemo-mechanical gradient theory which couples electrochemical reactions with mechanical deformation and damage in solids. The framework models species transport across the host due to diffusion/migration…

Materials Science · Physics 2023-04-05 Donald Bistri , Claudio V. Di Leo

Fossil-free ironmaking is indispensable for reducing massive anthropogenic CO2 emissions in the steel industry. Hydrogen-based direct reduction (HyDR) is among the most attractive solutions for green ironmaking, with high technology…

We perform a linear dynamical stability analysis of a general hydrodynamic model of chemotactic aggregation [Chavanis & Sire, Physica A, in press (2007)]. Specifically, we study the stability of an infinite and homogeneous distribution of…

Biological Physics · Physics 2009-11-13 Pierre-Henri Chavanis , Clement Sire

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

Hydrogen uptake into body-centered cubic (bcc) iron as a root cause for subsequent hydrogen embrittlement, is initiated at the surface. In this paper, we quantify how readily H diffuses from the surface into the bulk. We consider a set of…

Materials Science · Physics 2025-05-27 Lukas Meier , Asif I. Bhatti , Leo Kestens , Stefaan Cottenier

We develop a one-dimensional mathematical model for the loading process of hydrogen in a metal hydride tank. The model describes the evolution of the density and pressure of the hydrogen gas, the temperature of the tank, the averaged…

Materials Science · Physics 2025-07-31 Francesc Font , Attila Husar , Tim Myers , Maria Aguareles , Esther Barrabés