Acta Materialia | Predicting Grain Boundary Sliding of Metals

文摘   科学   2025-01-15 08:33   浙江  
Graphical Abstract

Simple: GBS displacement = 0.22 × strain × grain size (0.22 is a well-defined physical parameter, explained below).

Scope: Covers 39 materials with distinct crystal structures and alloy compositions, grain sizes nm - mm, strains 0.1%-161%

Introduction

The mechanical behavior of polycrystalline metals and alloys is significantly influenced by grain boundary sliding (GBS), a key mechanism of plastic deformation. GBS plays a crucial role in determining properties like creep, superplasticity, strength, and ductility, all of which are essential for high-performance alloys used in various industries.

Challenges

While the concept of GBS originated in 1913,  key challenges remain after over 100 years of research. These include the lack of a unified approach for characterizing GBS and a clear understanding of how factors like stress, temperature, and substructure influence it.

Materials

As summarized in Table 1, this study utilizes a comprehensive dataset encompassing 70 years of research (1953-2023) on 39 different materials with grain sizes ranging from nanometers to millimeters, including pure metals (Fe, Al, Mg, Cu, Zn) and their alloys, various steels (ferritic and austenitic), and zirconia.

Table 1. Summary of experimental data

Models
Based on the following two models, the influence of different variables, material types and alloy compositions, and mechanical behaviors on grain boundary sliding (GBS) is evaluated.
GBS basic model
Based on the principles of fundamental creep models, this study constructs a basic model for grain boundary sliding, where all parameters are well-defiend and have physical meanings. The detailed derivation of the model can be found in the original publication. The final model is as follows:

where μgbs is GBS displacement, dg is grain size, and ε is strain. hs=0.22 is a coefficient related to the strain enhancement factor and grain geometry.

GBS Analytical Models

In the analytical model of GBS, variables such as stress, temperature, strain, grain size, stress exponent, creep rate, and subgrain size are comprehensively considered. By constructing seven combinations of variables and combining the Soft Constrained Bayesian Regularization Neural Network (SCBRNN) with statistical analysis methods, the model parameters are determined.

Fig. 1. SCBRNN fit to all experimental data, the flexing curves are results obtaiend from BRNN without constraints, SCBRNN is the physics-informed BRNN.

Findings

  • This study compiled a comprehensive grain boundary sliding (GBS) dataset encompassing a wide range of materials (Fe, ferritic steels, austenitic steels, Al, Mg, Cu, Zn, and their respective alloys), grain sizes (0.066-3250 μm), strain levels (0.1-161%), and deformation modes (creep, tensile, and superplasticity).

  • A unified method for GBS was proposed, converting all measurements to GBS displacement along the stress axis, enabling effective integration and comparison of experimental data from various sources.

  • The influence of different variables, alloy compositions, and mechanical behaviors on GBS was analyzed. Strain and grain size were revealed as the primary factors influencing GBS, and a simple GBS basic model was established: GBS displacement = 0.22 × strain × grain size (where 0.22 is a coefficient related to the strain enhancement factor and grain geometry).

  • This model can effectively predict GBS and has been successfully applied to predict the nucleation and growth of creep cavities.

Fig. 2. GBS displacement predicted by the GBS basic model for all materials under different conditions (left), and the corresponding regression plot of predicted values against experimental data (right).

Significance

This study provides data and theoretical support for grain boundary sliding (GBS). The study helps to a better understanding of material deformation behavior. It can serve as a reference for the evaluation of GBS and mechanical properties.

Future Research

  • Nanoscale GBS: Nanoscale data is limited in this study. Future work could systematically investigate GBS at the nanoscale and validate the applicability of the model.

  • Different conditions: The model covers creep, superplasticity, and tensile deformation. Future research could explore GBS under compression, irradiation, etc., to expand the applicability of the model.


Authors
The first and corresponding author of this work is Assoc. Prof. Jun-Jing He from Hangzhou Dianzi University. Prof. Rolf Sandström from KTH Royal Institute of Technology is the second and co-corresponding author of this paper.
Rolf Sandström, a member of the Royal Swedish Academy of Engineering Sciences and Professor Emeritus at KTH Royal Institute of Technology. He is an internationally renowned expert in creep research. With over 50 years of dedicated research in the field, Prof. Sandström has pioneered the development of fundamental creep models and made significant contributions to the understanding of creep fracture and residual creep life assessment and prediction in high-temperature metallic structural materials. He has authored over 500 publications, including his recent book "Basic Modeling and Theory of Creep of Metallic Materials" which represents his life's work and is considered a foundation for creep prediction.
Jun-Jing He, an Associate Professor at Hangzhou Dianzi University. He received his Ph.D. from KTH Royal Institute of Technology under the supervision of Prof. Rolf Sandström. He has been dedicated to creep theory of metals for 13 years. He has authored over 30  publications. His research focuses on creep mechanisms and modeling, creep life assessment and prediction of high-temperature metals and alloys.
Citation
Jun-Jing He, Rolf Sandström, Shuai-Rui Lü, Pavel Korzhavyi, Jing Zhang, Hai-Ying Qin, Jia-Bin Liu, Predicting grain boundary sliding in metallic materials, Acta Materialia 286 (2025) 120718. doi: https://doi.org/10.1016/j.actamat.2025.120718

Related Recommendations
1. JMS, Grain boundary sliding model in creep of austenitic steels
2. 1-min read | Sandström's Creep Theory-9 Grain boundary sliding
3. JMRT |  Predicting creep rupture of steels using SCMLAs
4. JMS | Creep cavity nucleation model
5. MHT | Creep ductility of fcc metals
6. The link to Prof. Rolf Sandström's book (open access):
https://link.springer.com/book/10.1007/978-3-031-49507-6

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