Robust Bayesian parameter calibration for DEM simulations of shear cell test

IF 4 3区 工程技术 Q2 ENGINEERING, CHEMICAL
Chemical Engineering Research & Design Pub Date : 2026-07-01 Epub Date: 2026-06-11 DOI:10.1016/j.cherd.2026.06.017
Giovanni Iozzi, Francesca O. Alfano, Sina Zinatlou Ajabshir, Diego Barletta, Massimo Poletto, Francesco P. Di Maio, Alberto Di Renzo
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引用次数: 0

Abstract

Shear test devices are commonly employed to characterise the mechanical behaviour of (cohesive) particulate materials. In simulations, Discrete Element Method (DEM) models require correct material parameter values for accurate predictions in a broad variety of process applications. In the present work, two open-source codes implementing robust Bayesian calibration (GrainLearning) and DEM (MFIX-DEM) are effectively integrated into a framework to investigate the capability of DEM to represent the key features of experimental shear cell test data on a model granular material. Material properties, geometric characteristics and operating procedures were carefully matched by using a periodic box subjected to stress- and displacement-controlled walls. Properties such as the static friction coefficient, rolling friction coefficient, and cohesive energy in DEM are varied in a statistically consistent way to capture the experimental data of the yield loci collected on spherical glass beads. With the calibration process for standard DEM, it was found that, under the conditions investigated, no combination of reasonable parameter values yielded sufficient shear resistance. So, in analogy with approaches documented in the literature, spherical particles with partially and fully locked rotation have been considered, with only the latter case being successful. The sequential Bayesian filtering approach allowed appropriate DEM parameters to be found along with their uncertainty quantification. Using these values, various other experimental features were captured with good agreement, including the evolution of the shear stress during loading and the dilation behaviour. Finally, DEM results were processed to examine the formation of the shear displacement vertical profile from the elastic to the yielding stage.
剪切单元试验DEM模拟的鲁棒贝叶斯参数标定
剪切试验装置通常用于表征(粘性)颗粒材料的力学行为。在模拟中,离散元法(DEM)模型需要正确的材料参数值,以便在各种工艺应用中进行准确预测。在本工作中,两个实现鲁棒贝叶斯校准的开源代码(GrainLearning)和DEM (MFIX-DEM)有效地集成到一个框架中,以研究DEM在模型颗粒材料上表示实验剪切细胞试验数据的关键特征的能力。材料特性、几何特性和操作程序通过使用周期性盒子进行应力和位移控制墙的仔细匹配。在DEM中,静摩擦系数、滚动摩擦系数、内聚能等性能以统计一致的方式变化,以捕获在球形玻璃微珠上采集的屈服位点的实验数据。通过对标准DEM的标定过程,发现在所研究的条件下,没有合理的参数值组合产生足够的抗剪能力。因此,与文献中记录的方法类似,考虑了部分锁定和完全锁定旋转的球形粒子,只有后一种情况是成功的。顺序贝叶斯滤波方法允许找到合适的DEM参数以及它们的不确定性量化。使用这些值,各种其他实验特征被捕获与良好的一致性,包括剪切应力在加载过程中的演变和膨胀行为。最后,对DEM结果进行处理,以检验从弹性阶段到屈服阶段剪切位移垂直剖面的形成。
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来源期刊
Chemical Engineering Research & Design
Chemical Engineering Research & Design 工程技术-工程:化工
CiteScore
6.10
自引率
7.70%
发文量
623
审稿时长
42 days
期刊介绍: ChERD aims to be the principal international journal for publication of high quality, original papers in chemical engineering. Papers showing how research results can be used in chemical engineering design, and accounts of experimental or theoretical research work bringing new perspectives to established principles, highlighting unsolved problems or indicating directions for future research, are particularly welcome. Contributions that deal with new developments in plant or processes and that can be given quantitative expression are encouraged. The journal is especially interested in papers that extend the boundaries of traditional chemical engineering.
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