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2025 (English)In: Composite structures, ISSN 0263-8223, E-ISSN 1879-1085, Vol. 370, article id 119292Article in journal (Refereed) Published
Abstract [en]
Graphene-based polymer nanocomposites show great potential for thermal management, but accurately predicting their thermal conductivity remains challenging due to multiscale structural complexity and parameter uncertainty. We propose an innovative approach integrating interpretable stochastic machine learning with multiscale analysis to predict the macroscopic thermal conductivity of graphene-based polymer nanocomposites. Our bottom-up framework addresses uncertainties in meso- and macro-scale input parameters. Using Representative Volume Elements (RVEs) and Finite Element Modeling (FEM), we compute effective thermal conductivity through homogenization. Predictive modeling is powered by the XGBoost regression tree-based algorithm. To elucidate the influence of input parameters on predictions, we employ SHapley Additive exPlanations (SHAP) and Local Interpretable Model-agnostic Explanations (LIME), providing insights into feature interactions and interpretability. Sensitivity analyses further quantify the impact of design parameters on material properties. This integrated method enhances prediction accuracy, reduces computational costs, and bridges data-driven and physical modeling, offering a scalable solution for designing advanced composite materials for thermal management applications.
Place, publisher, year, edition, pages
Elsevier, 2025
Keywords
Interpretable integrated learning, Polymeric graphene-enhanced composites (PGECs), Sensitivity analysis, Stochastic multi-scale modeling, Thermal properties
National Category
Composite Science and Engineering
Identifiers
urn:nbn:se:umu:diva-240315 (URN)10.1016/j.compstruct.2025.119292 (DOI)2-s2.0-105007553544 (Scopus ID)
Funder
J. Gust. Richert stiftelse, 2023–00884The Kempe FoundationsEU, Horizon 2020, 101016854Swedish Energy Agency, P2021-00248Swedish Research Council Formas, 2022-01475
2025-06-242025-06-242025-06-24Bibliographically approved