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As a result of the wide span of uncertainties and input variables considered in recent peer-reviewed studies on hydrogen supply chains, consensus and generalized insight are hard to derive. This work presents a meta-analysis model, building…

Hydrogen-vacancy interactions play an important role in governing hydrogen transport and embrittlement in body-centered cubic (BCC) metals. In this study, a multiscale approach combining density functional theory (DFT) and kinetic Monte…

Materials Science · Physics 2026-05-28 Vallinathan K , Gurpreet Kaur , Sharat Chandra

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…

Hydrogen is key in reducing greenhouse gas emissions in materials production. At the same time, it significantly affects mechanical properties, often causing unwanted embrittlement. However, rather than solely addressing these…

There is a need for numerical models capable of predicting local accumulation of hydrogen near stress concentrators and crack tips to prevent and mitigate hydrogen assisted fracture in steels. The experimental characterisation of trapping…

Applied Physics · Physics 2020-10-27 A. Díaz , A. Zafra , E. Martínez-Pañeda , J. M. Alegre , J. Belzunce , I. I. Cuesta

Failures attributed to hydrogen embrittlement are a major concern for metals so a better understanding of damage micro-mechanisms and hydrogen diffusion within the metal is needed. Local concentrations depend on transport phenomena…

Chemical Physics · Physics 2020-08-03 A. Díaz , I. I. Cuesta , E. Martínez-Pañeda , J. M. Alegre

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

Grain boundaries (GBs) play a fundamental role in the strengthening mechanism of crystalline structures by acting as an impediment to dislocation motion. However, the presence of an aggressive environment such as hydrogen increases the…

Materials Science · Physics 2016-02-17 I. Adlakha , K. N. Solanki

Interaction between hydrogen (H) and metals is central to many materials problems of scientific and technological importance. Chief among them is the development of H storage and H-resistant materials. H segregation or trapping at lattice…

Materials Science · Physics 2013-11-06 Weiwei Xing , Xing-Qiu Chen , Gang Lu , Dianzhong Li , Yiyi Li

We present a new theoretical and numerical framework for modelling mechanically-assisted corrosion in elastic-plastic solids. Both pitting and stress corrosion cracking (SCC) can be captured, as well as the pit-to-crack transition.…

Applied Physics · Physics 2020-12-30 Chuanjie Cui , Rujin Ma , Emilio Martínez-Pañeda

A robust $hp$-adaptive finite element framework is presented for the investigation of static cracks in materials characterized by complex, pointwise density variations. Within such heterogeneous media, the equilibrium equation governed by…

Numerical Analysis · Mathematics 2025-12-29 S. M. Mallikarjunaiah

The multiscale picture of hydrogen embrittlement (HE) mechanisms has been under controversy for a long time. Here I report a thermomechanically-consistent HERB framework driven by the Rice-Beltz concept meanwhile incorporating the hydrogen…

Materials Science · Physics 2026-03-04 Kai Zhao

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…

Mathematical Physics · Physics 2013-09-13 Tomas Roubicek , Giuseppe Tomassetti

The capability to simulate a hydraulic fracturing process is an essential tool that can be used to optimize treatment design and increase the efficiency of field operations. In most practical cases, hydraulic fractures propagate in a…

Geophysics · Physics 2023-05-24 A. V. Valov , E. V. Dontsov , A. N. Baykin , S. V. Golovin

This paper presents a modeling framework---mathematical model and computational framework---to study the response of a plastic material due to the presence and transport of a chemical species in the host material. Such a modeling framework…

Numerical Analysis · Mathematics 2020-11-16 M. S. Joshaghani , K. B. Nakshatrala

Brittle materials fail catastrophically. In consequence of their limited flaw-tolerance, failure occurs by localized fracture and is typically a dynamic process. Recently, experiments on epithelial cell monolayers have revealed that this…

Soft Condensed Matter · Physics 2017-02-07 Alessandro Lucantonio , Giovanni Noselli

We present an implicit, fully-coupled hydro-mechanical solver for the three dimensional simulation of fluid-driven rupture propagation along existing discontinuities. The solver handles simultaneously frictional slip (shear failure) and…

The paper addresses the problem of a Mode III interfacial crack advancing quasi-statically in a heterogeneous composite material, that is a two-phase material containing elastic inclusions, both soft and stiff, and defects, such as…

Mathematical Physics · Physics 2011-10-25 Andrea Piccolroaz , Gennady Mishuris , Alexander Movchan , Natasha Movchan

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

We present a hydro-geomechanical model for subsurface methane hydrate systems. Our model considers kinetic hydrate phase change and non-isothermal, multi-phase, multi-component flow in elastically deforming soils. The model accounts for the…

Numerical Analysis · Mathematics 2015-08-07 Shubhangi Gupta , Rainer Helmig , Barbara Wohlmuth