A thermodynamics-constrained neural network with mechanical encoding for nonlinear viscoelastic modelling from sparse data

Abstract Accurately predicting the nonlinear viscoelastic behaviour of materials such as polymers remains a key challenge, particularly when only limited experimental data are available. While recurrent neural networks (RNNs) are often used to capture path-dependent material responses, they suffer from training instabilities and poor extrapolation capabilities. This study addresses this gap by developing an alternative approach with a hybrid, thermodynamically-based framework that combines a linear generalised Maxwell model with a multilayer perceptron (MLP). The Maxwell model acts as a ‘physics-based’ encoding layer, providing interpretable internal variables that represent the material’s deformation history. Unlike RNNs, MLPs are better suited for capturing complex nonlinear relationships without relying on memory cells, thereby improving generalisation beyond the training domain. The parameters of the mechanical model and the neural network are jointly optimised. A residual connection allows the network to correct the Maxwell model’s output. The proposed model, referred to as Mech-TANN, accurately reproduces nonlinear viscoelastic behaviour using only forty noisy data points from synthetic shear tests. It achieves less than 7% prediction error on test data with a noise level of 2% of the maximum signal amplitude. With four times the data, the precision improves tenfold. It demonstrates excellent extrapolation to larger strain amplitudes and unseen loading types, including relaxation tests. The combination of mechanical encoding and thermodynamic constraints yields a data-efficient and generalisable modelling framework that benefits from physically motivated inductive bias for complex time-dependent materials.

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Publication Details

Journal
Modelling and Simulation in Materials Science and Engineering
Published
2025-11-21
DOI
https://doi.org/10.1088/1361-651x/ae2284
Primary Topic
Model Reduction and Neural Networks
Type
article
Field-Weighted Citation Impact
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article

A thermodynamics-constrained neural network with mechanical encoding for nonlinear viscoelastic modelling from sparse data

Pierre Kerfriden, Sabine Cantournet, Nicolas Pistenon, Jean‐Luc Bouvard et al.
Modelling and Simulation in Materials Science and Engineering
Model Reduction and Neural Networks
article

A thermodynamics-constrained neural network with mechanical encoding for nonlinear viscoelastic modelling from sparse data

Pierre Kerfriden, Sabine Cantournet, Nicolas Pistenon, Jean‐Luc Bouvard, Daniel Pino Muñoz
article en

Abstract

Abstract Accurately predicting the nonlinear viscoelastic behaviour of materials such as polymers remains a key challenge, particularly when only limited experimental data are available. While recurrent neural networks (RNNs) are often used to capture path-dependent material responses, they suffer from training instabilities and poor extrapolation capabilities. This study addresses this gap by developing an alternative approach with a hybrid, thermodynamically-based framework that combines a linear generalised Maxwell model with a multilayer perceptron (MLP). The Maxwell model acts as a ‘physics-based’ encoding layer, providing interpretable internal variables that represent the material’s deformation history. Unlike RNNs, MLPs are better suited for capturing complex nonlinear relationships without relying on memory cells, thereby improving generalisation beyond the training domain. The parameters of the mechanical model and the neural network are jointly optimised. A residual connection allows the network to correct the Maxwell model’s output. The proposed model, referred to as Mech-TANN, accurately reproduces nonlinear viscoelastic behaviour using only forty noisy data points from synthetic shear tests. It achieves less than 7% prediction error on test data with a noise level of 2% of the maximum signal amplitude. With four times the data, the precision improves tenfold. It demonstrates excellent extrapolation to larger strain amplitudes and unseen loading types, including relaxation tests. The combination of mechanical encoding and thermodynamic constraints yields a data-efficient and generalisable modelling framework that benefits from physically motivated inductive bias for complex time-dependent materials.

Modelling and Simulation in Materials Science and EngineeringVol. 34(1)
Centre de Mise en Forme des Matériaux (FR), Centre des Matériaux (FR)
Openalex Percentile: Top 71%
Model Reduction and Neural Networks
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