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Paper · arXiv

Gaussian Process Regression-based Knowledge Distillation Framework for Simultaneous Prediction of Physical and Mechanical Properties of Epoxy Polymers

Epoxy polymers are widely used due to their multifunctional properties, but machine learning (ML) applications remain limited owing to their complex 3D molecular structure, multi-component nature, and lack of curated datasets. Existing ML studies are largely restricted to simulation data, specific properties, or narrow constituent ranges. To address these limitations, we developed an informed Gaussian Process Regression-based Knowledge Distillation (GPR-KD) framework for predicting multiple physical (glass transition temperature, density) and mechanical properties (elastic modulus, tensile strength, compressive strength, flexural strength, fracture energy, adhesive strength) of thermoset ...

AuthorsSindu B. S., Jan Hamaekers
Primary categorycond-mat.soft
Published12 March 2026
Last updated at source12 March 2026
cond-mat.softcond-mat.mtrl-scics.LG
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