Ellen Kuhl

CE
h-index27
23papers
723citations
Novelty48%
AI Score55

23 Papers

LGSep 15, 2022Code
A new family of Constitutive Artificial Neural Networks towards automated model discovery

Kevin Linka, Ellen Kuhl

For more than 100 years, chemical, physical, and material scientists have proposed competing constitutive models to best characterize the behavior of natural and man-made materials in response to mechanical loading. Now, computer science offers a universal solution: Neural Networks. Neural Networks are powerful function approximators that can learn constitutive relations from large data without any knowledge of the underlying physics. However, classical Neural Networks ignore a century of research in constitutive modeling, violate thermodynamic considerations, and fail to predict the behavior outside the training regime. Here we design a new family of Constitutive Artificial Neural Networks that inherently satisfy common kinematic, thermodynamic, and physic constraints and, at the same time, constrain the design space of admissible functions to create robust approximators, even in the presence of sparse data. We revisit the non-linear field theories of mechanics and reverse-engineer the network input to account for material objectivity, symmetry, and incompressibility; the network output to enforce thermodynamic consistency; the activation functions to implement physically reasonable restrictions; and the network architecture to ensure polyconvexity. We demonstrate that this new class of models is a generalization of the classical neo Hooke, Blatz Ko, Mooney Rivlin, Yeoh, and Demiray models and that the network weights have a clear physical interpretation. When trained with classical benchmark data for rubber, our network autonomously selects the best constitutive model and learns its parameters. Our findings suggests that Constitutive Artificial Neural Networks have the potential to induce a paradigm shift in constitutive modeling, from user-defined model selection to automated model discovery. Our source code, data, and examples are available at https://github.com/LivingMatterLab/CANN.

LGMay 12, 2022
Bayesian Physics-Informed Neural Networks for real-world nonlinear dynamical systems

Kevin Linka, Amelie Schafer, Xuhui Meng et al.

Understanding real-world dynamical phenomena remains a challenging task. Across various scientific disciplines, machine learning has advanced as the go-to technology to analyze nonlinear dynamical systems, identify patterns in big data, and make decision around them. Neural networks are now consistently used as universal function approximators for data with underlying mechanisms that are incompletely understood or exceedingly complex. However, neural networks alone ignore the fundamental laws of physics and often fail to make plausible predictions. Here we integrate data, physics, and uncertainties by combining neural networks, physics-informed modeling, and Bayesian inference to improve the predictive potential of traditional neural network models. We embed the physical model of a damped harmonic oscillator into a fully-connected feed-forward neural network to explore a simple and illustrative model system, the outbreak dynamics of COVID-19. Our Physics-Informed Neural Networks can seamlessly integrate data and physics, robustly solve forward and inverse problems, and perform well for both interpolation and extrapolation, even for a small amount of noisy and incomplete data. At only minor additional cost, they can self-adaptively learn the weighting between data and physics. Combined with Bayesian Neural Networks, they can serve as priors in a Bayesian Inference, and provide credible intervals for uncertainty quantification. Our study reveals the inherent advantages and disadvantages of Neural Networks, Bayesian Inference, and a combination of both and provides valuable guidelines for model selection. While we have only demonstrated these approaches for the simple model problem of a seasonal endemic infectious disease, we anticipate that the underlying concepts and trends generalize to more complex disease conditions and, more broadly, to a wide variety of nonlinear dynamical systems.

LGJul 16, 2023
Discovering a reaction-diffusion model for Alzheimer's disease by combining PINNs with symbolic regression

Zhen Zhang, Zongren Zou, Ellen Kuhl et al.

Misfolded tau proteins play a critical role in the progression and pathology of Alzheimer's disease. Recent studies suggest that the spatio-temporal pattern of misfolded tau follows a reaction-diffusion type equation. However, the precise mathematical model and parameters that characterize the progression of misfolded protein across the brain remain incompletely understood. Here, we use deep learning and artificial intelligence to discover a mathematical model for the progression of Alzheimer's disease using longitudinal tau positron emission tomography from the Alzheimer's Disease Neuroimaging Initiative database. Specifically, we integrate physics informed neural networks (PINNs) and symbolic regression to discover a reaction-diffusion type partial differential equation for tau protein misfolding and spreading. First, we demonstrate the potential of our model and parameter discovery on synthetic data. Then, we apply our method to discover the best model and parameters to explain tau imaging data from 46 individuals who are likely to develop Alzheimer's disease and 30 healthy controls. Our symbolic regression discovers different misfolding models $f(c)$ for two groups, with a faster misfolding for the Alzheimer's group, $f(c) = 0.23c^3 - 1.34c^2 + 1.11c$, than for the healthy control group, $f(c) = -c^3 +0.62c^2 + 0.39c$. Our results suggest that PINNs, supplemented by symbolic regression, can discover a reaction-diffusion type model to explain misfolded tau protein concentrations in Alzheimer's disease. We expect our study to be the starting point for a more holistic analysis to provide image-based technologies for early diagnosis, and ideally early treatment of neurodegeneration in Alzheimer's disease and possibly other misfolding-protein based neurodegenerative disorders.

LGNov 24, 2022
Utilising physics-guided deep learning to overcome data scarcity

Jinshuai Bai, Laith Alzubaidi, Qingxia Wang et al.

Deep learning (DL) relies heavily on data, and the quality of data influences its performance significantly. However, obtaining high-quality, well-annotated datasets can be challenging or even impossible in many real-world applications, such as structural risk estimation and medical diagnosis. This presents a significant barrier to the practical implementation of DL in these fields. Physics-guided deep learning (PGDL) is a novel type of DL that can integrate physics laws to train neural networks. This can be applied to any systems that are controlled or governed by physics laws, such as mechanics, finance and medical applications. It has been demonstrated that, with the additional information provided by physics laws, PGDL achieves great accuracy and generalisation in the presence of data scarcity. This review provides a detailed examination of PGDL and offers a structured overview of its use in addressing data scarcity across various fields, including physics, engineering and medical applications. Moreover, the review identifies the current limitations and opportunities for PGDL in relation to data scarcity and offers a thorough discussion on the future prospects of PGDL.

LGOct 9, 2023
On sparse regression, Lp-regularization, and automated model discovery

Jeremy A. McCulloch, Skyler R. St. Pierre, Kevin Linka et al.

Sparse regression and feature extraction are the cornerstones of knowledge discovery from massive data. Their goal is to discover interpretable and predictive models that provide simple relationships among scientific variables. While the statistical tools for model discovery are well established in the context of linear regression, their generalization to nonlinear regression in material modeling is highly problem-specific and insufficiently understood. Here we explore the potential of neural networks for automatic model discovery and induce sparsity by a hybrid approach that combines two strategies: regularization and physical constraints. We integrate the concept of Lp regularization for subset selection with constitutive neural networks that leverage our domain knowledge in kinematics and thermodynamics. We train our networks with both, synthetic and real data, and perform several thousand discovery runs to infer common guidelines and trends: L2 regularization or ridge regression is unsuitable for model discovery; L1 regularization or lasso promotes sparsity, but induces strong bias; only L0 regularization allows us to transparently fine-tune the trade-off between interpretability and predictability, simplicity and accuracy, and bias and variance. With these insights, we demonstrate that Lp regularized constitutive neural networks can simultaneously discover both, interpretable models and physically meaningful parameters. We anticipate that our findings will generalize to alternative discovery techniques such as sparse and symbolic regression, and to other domains such as biology, chemistry, or medicine. Our ability to automatically discover material models from data could have tremendous applications in generative material design and open new opportunities to manipulate matter, alter properties of existing materials, and discover new materials with user-defined properties.

LGNov 10, 2023
Theory and implementation of inelastic Constitutive Artificial Neural Networks

Hagen Holthusen, Lukas Lamm, Tim Brepols et al.

Nature has always been our inspiration in the research, design and development of materials and has driven us to gain a deep understanding of the mechanisms that characterize anisotropy and inelastic behavior. All this knowledge has been accumulated in the principles of thermodynamics. Deduced from these principles, the multiplicative decomposition combined with pseudo potentials are powerful and universal concepts. Simultaneously, the tremendous increase in computational performance enabled us to investigate and rethink our history-dependent material models to make the most of our predictions. Today, we have reached a point where materials and their models are becoming increasingly sophisticated. This raises the question: How do we find the best model that includes all inelastic effects to explain our complex data? Constitutive Artificial Neural Networks (CANN) may answer this question. Here, we extend the CANNs to inelastic materials (iCANN). Rigorous considerations of objectivity, rigid motion of the reference configuration, multiplicative decomposition and its inherent non-uniqueness, restrictions of energy and pseudo potential, and consistent evolution guide us towards the architecture of the iCANN satisfying thermodynamics per design. We combine feed-forward networks of the free energy and pseudo potential with a recurrent neural network approach to take time dependencies into account. We demonstrate that the iCANN is capable of autonomously discovering models for artificially generated data, the response of polymers for cyclic loading and the relaxation behavior of muscle data. As the design of the network is not limited to visco-elasticity, our vision is that the iCANN will reveal to us new ways to find the various inelastic phenomena hidden in the data and to understand their interaction. Our source code, data, and examples are available at doi.org/10.5281/zenodo.10066805

CEApr 18
Watching Physics: the Generative Science of Matter and Motion

Hagen Holthusen, Kevin Linka, Ellen Kuhl

Can we learn the physics of matter in motion directly from images and video--and trust it? Answering this question requires integrating experiments, physics-based simulation, and data across traditionally separate disciplines. Much of this knowledge is visual and temporal rather than textual: images and videos encode structure, dynamics, and causality that equations alone cannot fully capture. Recent generative models produce compelling visual content, yet they rely on observational data and often lack physical validity. Here we show that generative video models gain scientific value when they couple visual data with experiments and high-fidelity simulations. Using deformation mechanics as a testbed, we study three systems of increasing complexity--rubber compression, can crushing, and cardiac motion--and identify regimes in which visual learning succeeds, fails, and requires mechanistic supervision. When physics manifests in visible kinematics, generative models recover measurable quantities such as surface strain; when internal state variables dominate, visual plausibility no longer ensures physical admissibility. We propose that this convergence defines a new frontier, the Generative Sciences of Matter and Motion, which unifies Simulogenics, Physiogenics, and Materiogenics. These physics-grounded foundation models can turn visual generation into a scientific instrument for inference, prediction, and design of matter in motion.

CEApr 25
Artificial Intelligence for Food Innovation

Bianca Datta, Markus J. Buehler, Yvonne Chow et al.

Global food systems must deliver nutritious, sustainable foods while sharply reducing environmental impact. Yet, food innovation remains slow, empirical, and fragmented. Artificial intelligence (AI) offers a transformative path to link molecular composition to functional performance, connect chemical structure to sensory outcomes, and accelerate cross-disciplinary innovation across the production pipeline. While broadly applicable to food systems, we focus on sustainable proteins--plant-based, fermentation-derived, and cultivated--as a high-impact testbed for AI-driven closed-loop design. We review the applications, opportunities, and challenges of AI for Food as an emerging discipline that integrates ingredient design, formulation development, fermentation and production, texture analysis, sensory science, manufacturing, and recipe generation. We identify four priorities: advancing scientific machine learning with embedded domain priors, treating food as a programmable biomaterial, building self-driving laboratories for automated discovery, and developing deep reasoning models that integrate nutrition and sustainability. Integrating AI responsibly into the food innovation cycle can accelerate the transition to sustainable food systems and establish a predictive, design-driven science of food for human and planetary health.

CEApr 15
Learning ultra-compressible hyperelasticity with splines: Constitutive asymmetries and non-unique representations

Miguel Angel Moreno-Mateos, Simon Wiesheier, Paul Steinmann et al.

Highly compressible solids, such as foams, exhibit complex responses, including pronounced tension-compression asymmetry. Capturing such behaviors within unified hyperelastic frameworks remains challenging. Invariant-based hyperelastic models are commonly identified from standard tests such as homogeneous uniaxial tension/compression and simple shear, implicitly assuming a unique energy representation. Here we show that this assumption is fundamentally violated and that, oftentimes, the choice of which term should prevail is just a matter of taste. Using spline-based strain-energy density functions as a data-adaptive tool and stress-strain experimental data for elastomeric foams, we expose this non-uniqueness, often hidden in low-parameter formulations. Our framework captures the volumetric deformation of ultra-light foams used in racing shoes using homogeneous experimental data from tension, compression, and shear. We formulate an overly rich ansatz of separable and non-separable energies in the ($\bar{I}_1$, $\bar{I}_2$, $J$) space à la Money-Rivlin. These constructs, defined by multiplicative decompositions, resemble classical invariant-based models while generalizing them to a data-driven spline representation. This serves two purposes: (i) to capture the response under complex volumetric deformation modes and (ii) to allow non-uniqueness in the identification problem to emerge naturally. We find that a coupling term between isochoric and volumetric deformation, such as $Ψ(\bar{I}_1,J)$ or $Ψ(\bar{I}_2,J)$, is essential and that additional coupling terms help but are not fully necessary; rather, they pronounce the non-uniqueness. As a consequence, different models may be indistinguishable on available data. Importantly, these challenges are not specific to splines but extend to traditional and neural network-based models.

MED-PHMar 13
Tau-induced atrophy drives functional connectivity disruption in Alzheimer's disease

Kun Jiang, Can Liao, Sujin Jiang et al.

Alzheimer's disease involves progressive tau accumulation and spread, leading to regional brain atrophy and disruption of large-scale functional networks. While tau propagation and tissue degeneration have been widely modeled, how atrophy dynamics translate into functional connectivity (FC) degradation remains unclear. Here, we develop a multiphysics framework integrating anisotropic tau reaction-diffusion, finite-deformation biomechanics, and network modeling to link tau-driven atrophy with FC changes. Model fidelity is evaluated by quantitatively comparing simulated atrophy patterns with imaging-derived measurements. Using longitudinal structural and functional MRI, we identify an approximately linear relationship between regional atrophy rates and FC change. We then construct an atrophy-informed structural network degradation matrix from model-predicted region-specific atrophy rates and embed it into a neural oscillation model to predict FC disruption. Our results show that (i) the coupled reaction-diffusion-biomechanical model reproduces observed regional atrophy, (ii) regional atrophy rates parsimoniously predict longitudinal FC changes, and (iii) the atrophy-informed degradation matrix captures the direction and relative magnitude of regional FC disruption. By converting tau-driven atrophy into predictive FC trajectories, the proposed framework offers a clinically interpretable avenue for forecasting disease progression and informing trial design.

CEMar 31
A Convex Route to Thermomechanics: Learning Internal Energy and Dissipation

Hagen Holthusen, Paul Steinmann, Ellen Kuhl

We present a physics-based neural network framework for the discovery of constitutive models in fully coupled thermomechanics. In contrast to classical formulations based on the Helmholtz energy, we adopt the internal energy and a dissipation potential as primary constitutive functions, expressed in terms of deformation and entropy. This choice avoids the need to enforce mixed convexity--concavity conditions and facilitates a consistent incorporation of thermodynamic principles. In this contribution, we focus on materials without preferred directions or internal variables. While the formulation is posed in terms of entropy, the temperature is treated as the independent observable, and the entropy is inferred internally through the constitutive relation, enabling thermodynamically consistent modeling without requiring entropy data. Thermodynamic admissibility of the networks is guaranteed by construction. The internal energy and dissipation potential are represented by input convex neural networks, ensuring convexity and compliance with the second law. Objectivity, material symmetry, and normalization are embedded directly into the architecture through invariant-based representations and zero-anchored formulations. We demonstrate the performance of the proposed framework on synthetic and experimental datasets, including purely thermal problems and fully coupled thermomechanical responses of soft tissues and filled rubbers. The results show that the learned models accurately capture the underlying constitutive behavior. All code, data, and trained models are made publicly available via https://doi.org/10.5281/zenodo.19248596.

CEApr 3
Generative AI for material design: A mechanics perspective from burgers to matter

Vahidullah Tac, Ellen Kuhl

Generative artificial intelligence offers a new paradigm to design matter in high-dimensional spaces. However, its underlying mechanisms remain difficult to interpret and limit adoption in computational mechanics. This gap is striking because its core tools-diffusion, stochastic differential equations, and inverse problems-are fundamental to the mechanics of materials. Here we show that diffusion-based generative AI and computational mechanics are rooted in the same principles. We illustrate this connection using a three-ingredient burger as a minimal benchmark for material design in a low-dimensional space, where both forward and reverse diffusion admit analytical solutions: Markov chains with Bayesian inversion in the discrete case and the Ornstein-Uhlenbeck process with score-based reversal in the continuous case. We extend this framework to a high-dimensional design space with 146 ingredients and 8.9x10^43 possible configurations, where analytical solutions become intractable. We therefore learn the discrete and continuous reverse processes using neural network models that infer inverse dynamics from data. We train the models on only 2,260 recipes and generate one million samples that capture the statistical structure of the data, including ingredient prevalence and quantitative composition. We further generate five new burgers and validate them in a restaurant-based sensory study with 100 participants, where three of the AI-designed burgers outperform the classical Big Mac in overall liking, flavor, and texture. These results establish diffusion-based generative modeling as a physically grounded approach to design in high-dimensional spaces. They position generative AI as a natural extension of computational mechanics, with applications from burgers to matter, and establish a path toward data-driven, physics-informed generative design.

CEApr 17
When structure does not imply symmetry

Skyler R. St. Pierre, Thibault Vervenne, Ethan C. Darwin et al.

Fungal protein materials exhibit inherently anisotropic microstructures formed by networks of hyphae, which suggest a natural pathway to replicate the fibrous texture of animal meat. We probe whether this structural anisotropy translates into macroscopic mechanical and sensory anisotropy. Using orthogonal tension, compression, and shear experiments on three fungi-based materials, we identify distinct symmetry classes that range from strongly anisotropic to effectively isotropic behavior. Automated model discovery reveals that fiber-dependent invariants emerge only when mechanically relevant, and enables direct identification of material symmetry from data. These results demonstrate that microstructural anisotropy does not universally imply anisotropic mechanics or perception and establish a data-driven framework to infer symmetry in complex soft materials.

CEOct 5, 2025Code
A Complement to Neural Networks for Anisotropic Inelasticity at Finite Strains

Hagen Holthusen, Ellen Kuhl

We propose a complement to constitutive modeling that augments neural networks with material principles to capture anisotropy and inelasticity at finite strains. The key element is a dual potential that governs dissipation, consistently incorporates anisotropy, and-unlike conventional convex formulations-satisfies the dissipation inequality without requiring convexity. Our neural network architecture employs invariant-based input representations in terms of mixed elastic, inelastic and structural tensors. It adapts Input Convex Neural Networks, and introduces Input Monotonic Neural Networks to broaden the admissible potential class. To bypass exponential-map time integration in the finite strain regime and stabilize the training of inelastic materials, we employ recurrent Liquid Neural Networks. The approach is evaluated at both material point and structural scales. We benchmark against recurrent models without physical constraints and validate predictions of deformation and reaction forces for unseen boundary value problems. In all cases, the method delivers accurate and stable performance beyond the training regime. The neural network and finite element implementations are available as open-source and are accessible to the public via https://doi.org/10.5281/zenodo.17199965.

CEMay 8
Texture Independently Drives Liking in AI-Generated Alternative Protein Burgers

Vahidullah Tac, Aeneas O. Koosis, Ellen Kuhl

Texture shapes how we perceive and like food, yet clear links between mechanical measurements and sensory perception of texture remain elusive. Here we combine sensory data from a blind tasting with 101 participants with mechanical texture profile analysis across six burgers to identify the textural features that drive consumer perception and liking. We compare five burgers -- generated with artificial intelligence -- with animal-based, plant-based, mushroom-based, and hybrid animal-mushroom patties, and the classical Big\,Mac. Three main findings emerge: First, animal-based burgers occupy a distinctive and coherent sensory-mechanical region associated with attributes such as firm, fatty, and holds together. Second, mushroom- and plant-based burgers deviate from this region in protein-dependent ways: mushroom-based burgers associate with springy and gummy textures, while plant-based burgers associate with dry, brittle, and crumbly textures. Hybrid animal-mushroom burgers, however, maintain sensory profiles comparable to fully animal-based burgers. Third, resilience emerges as the strongest mechanical correlate of perceived meatiness and sensory texture, while stiffness and hardness show no statistically significant association with consumer perception. Texture independently predicts overall liking alongside flavor: increasing texture liking by one point increases overall liking by 0.28. Among all sensory attributes, meatiness is the dominant predictor of texture liking. These findings identify resilience as a promising target for texture engineering and establish texture as a critical design objective for sustainable alternative proteins.

LGMay 9, 2019Code
Multi-fidelity classification using Gaussian processes: accelerating the prediction of large-scale computational models

Francisco Sahli Costabal, Paris Perdikaris, Ellen Kuhl et al.

Machine learning techniques typically rely on large datasets to create accurate classifiers. However, there are situations when data is scarce and expensive to acquire. This is the case of studies that rely on state-of-the-art computational models which typically take days to run, thus hindering the potential of machine learning tools. In this work, we present a novel classifier that takes advantage of lower fidelity models and inexpensive approximations to predict the binary output of expensive computer simulations. We postulate an autoregressive model between the different levels of fidelity with Gaussian process priors. We adopt a fully Bayesian treatment for the hyper-parameters and use Markov Chain Mont Carlo samplers. We take advantage of the probabilistic nature of the classifier to implement active learning strategies. We also introduce a sparse approximation to enhance the ability of themulti-fidelity classifier to handle large datasets. We test these multi-fidelity classifiers against their single-fidelity counterpart with synthetic data, showing a median computational cost reduction of 23% for a target accuracy of 90%. In an application to cardiac electrophysiology, the multi-fidelity classifier achieves an F1 score, the harmonic mean of precision and recall, of 99.6% compared to 74.1% of a single-fidelity classifier when both are trained with 50 samples. In general, our results show that the multi-fidelity classifiers outperform their single-fidelity counterpart in terms of accuracy in all cases. We envision that this new tool will enable researchers to study classification problems that would otherwise be prohibitively expensive. Source code is available at https://github.com/fsahli/MFclass.

LGOct 17, 2024
Automated Model Discovery for Tensional Homeostasis: Constitutive Machine Learning in Growth and Remodeling

Hagen Holthusen, Tim Brepols, Kevin Linka et al.

Soft biological tissues exhibit a tendency to maintain a preferred state of tensile stress, known as tensional homeostasis, which is restored even after external mechanical stimuli. This macroscopic behavior can be described using the theory of kinematic growth, where the deformation gradient is multiplicatively decomposed into an elastic part and a part related to growth and remodeling. Recently, the concept of homeostatic surfaces was introduced to define the state of homeostasis and the evolution equations for inelastic deformations. However, identifying the optimal model and material parameters to accurately capture the macroscopic behavior of inelastic materials can only be accomplished with significant expertise, is often time-consuming, and prone to error, regardless of the specific inelastic phenomenon. To address this challenge, built-in physics machine learning algorithms offer significant potential. In this work, we extend our inelastic Constitutive Artificial Neural Networks (iCANNs) by incorporating kinematic growth and homeostatic surfaces to discover the scalar model equations, namely the Helmholtz free energy and the pseudo potential. The latter describes the state of homeostasis in a smeared sense. We evaluate the ability of the proposed network to learn from experimentally obtained tissue equivalent data at the material point level, assess its predictive accuracy beyond the training regime, and discuss its current limitations when applied at the structural level. Our source code, data, examples, and an implementation of the corresponding material subroutine are made accessible to the public at https://doi.org/10.5281/zenodo.13946282.

LGFeb 19, 2025
A generalized dual potential for inelastic Constitutive Artificial Neural Networks: A JAX implementation at finite strains

Hagen Holthusen, Kevin Linka, Ellen Kuhl et al.

We present a methodology for designing a generalized dual potential, or pseudo potential, for inelastic Constitutive Artificial Neural Networks (iCANNs). This potential, expressed in terms of stress invariants, inherently satisfies thermodynamic consistency for large deformations. In comparison to our previous work, the new potential captures a broader spectrum of material behaviors, including pressure-sensitive inelasticity. To this end, we revisit the underlying thermodynamic framework of iCANNs for finite strain inelasticity and derive conditions for constructing a convex, zero-valued, and non-negative dual potential. To embed these principles in a neural network, we detail the architecture's design, ensuring a priori compliance with thermodynamics. To evaluate the proposed architecture, we study its performance and limitations discovering visco-elastic material behavior, though the method is not limited to visco-elasticity. In this context, we investigate different aspects in the strategy of discovering inelastic materials. Our results indicate that the novel architecture robustly discovers interpretable models and parameters, while autonomously revealing the degree of inelasticity. The iCANN framework, implemented in JAX, is publicly accessible at https://doi.org/10.5281/zenodo.14894687.

CEApr 7
Adaptive Material Fingerprinting for the fast discovery of polyconvex feature combinations in isotropic and anisotropic hyperelasticity

Moritz Flaschel, Hagen Holthusen, Denisa Martonová et al.

We recently proposed a method called Material Fingerprinting for the rapid discovery of mechanical material models that avoids solving continuous optimization problems. Material Fingerprinting assumes that each material exhibits a unique response when subjected to a standardized experimental setup, which is interpreted as the material's mechanical fingerprint. If a database of fingerprints is generated in an offline phase, a model for an unseen experimental measurement can be discovered in real time by comparing the experimentally measured fingerprint to the fingerprints in the database. In our original contributions, the database comprised a fixed number of material models, each with a fixed number of parameters. To increase the fitting flexibility of Material Fingerprinting, we propose an adaptive model database coupled with an iterative pattern recognition algorithm that refines the material model in each step. This strategy enables Material Fingerprinting to discover arbitrary linear combinations of material models from the database, rather than being restricted to selecting a single model from a predefined set. In comparison to previous works on Material Fingerprinting, this enables the discovery of more complex models, such as multi-term Ogden models or the anisotropic Holzapfel-Gasser-Ogden model. To design the adaptive database, we leverage sums of strain energy density feature functions that depend on isotropic and anisotropic invariants. All modeling features satisfy fundamental physical constraints, and polyconvexity can be optionally enforced via a simple user-controlled switch. We test the method on experimental data stemming from mechanical tests of isotropic rubber materials and anisotropic animal skin tissue.

SOFTAug 16, 2025
Generalized invariants meet constitutive neural networks: A novel framework for hyperelastic materials

Denisa Martonová, Alain Goriely, Ellen Kuhl

The major challenge in determining a hyperelastic model for a given material is the choice of invariants and the selection how the strain energy function depends functionally on these invariants. Here we introduce a new data-driven framework that simultaneously discovers appropriate invariants and constitutive models for isotropic incompressible hyperelastic materials. Our approach identifies both the most suitable invariants in a class of generalized invariants and the corresponding strain energy function directly from experimental observations. Unlike previous methods that rely on fixed invariant choices or sequential fitting procedures, our method integrates the discovery process into a single neural network architecture. By looking at a continuous family of possible invariants, the model can flexibly adapt to different material behaviors. We demonstrate the effectiveness of this approach using popular benchmark datasets for rubber and brain tissue. For rubber, the method recovers a stretch-dominated formulation consistent with classical models. For brain tissue, it identifies a formulation sensitive to small stretches, capturing the nonlinear shear response characteristic of soft biological matter. Compared to traditional and neural-network-based models, our framework provides improved predictive accuracy and interpretability across a wide range of deformation states. This unified strategy offers a robust tool for automated and physically meaningful model discovery in hyperelasticity.

CEMar 16, 2025
Discovering uncertainty: Gaussian constitutive neural networks with correlated weights

Jeremy A. McCulloch, Ellen Kuhl

When characterizing materials, it can be important to not only predict their mechanical properties, but also to estimate the probability distribution of these properties across a set of samples. Constitutive neural networks allow for the automated discovery of constitutive models that exactly satisfy physical laws given experimental testing data, but are only capable of predicting the mean stress response. Stochastic methods treat each weight as a random variable and are capable of learning their probability distributions. Bayesian constitutive neural networks combine both methods, but their weights lack physical interpretability and we must sample each weight from a probability distribution to train or evaluate the model. Here we introduce a more interpretable network with fewer parameters, simpler training, and the potential to discover correlated weights: Gaussian constitutive neural networks. We demonstrate the performance of our new Gaussian network on biaxial testing data, and discover a sparse and interpretable four-term model with correlated weights. Importantly, the discovered distributions of material parameters across a set of samples can serve as priors to discover better constitutive models for new samples with limited data. We anticipate that Gaussian constitutive neural networks are a natural first step towards generative constitutive models informed by physical laws and parameter uncertainty.

CESep 2, 2025
Autoencoder-based non-intrusive model order reduction in continuum mechanics

Jannick Kehls, Ellen Kuhl, Tim Brepols et al.

We propose a non-intrusive, Autoencoder-based framework for reduced-order modeling in continuum mechanics. Our method integrates three stages: (i) an unsupervised Autoencoder compresses high-dimensional finite element solutions into a compact latent space, (ii) a supervised regression network maps problem parameters to latent codes, and (iii) an end-to-end surrogate reconstructs full-field solutions directly from input parameters. To overcome limitations of existing approaches, we propose two key extensions: a force-augmented variant that jointly predicts displacement fields and reaction forces at Neumann boundaries, and a multi-field architecture that enables coupled field predictions, such as in thermo-mechanical systems. The framework is validated on nonlinear benchmark problems involving heterogeneous composites, anisotropic elasticity with geometric variation, and thermo-mechanical coupling. Across all cases, it achieves accurate reconstructions of high-fidelity solutions while remaining fully non-intrusive. These results highlight the potential of combining deep learning with dimensionality reduction to build efficient and extensible surrogate models. Our publicly available implementation provides a foundation for integrating data-driven model order reduction into uncertainty quantification, optimization, and digital twin applications.

CEApr 3, 2025
Atrial constitutive neural networks

Mathias Peirlinck, Kevin Linka, Ellen Kuhl

This work presents a novel approach for characterizing the mechanical behavior of atrial tissue using constitutive neural networks. Based on experimental biaxial tensile test data of healthy human atria, we automatically discover the most appropriate constitutive material model, thereby overcoming the limitations of traditional, pre-defined models. This approach offers a new perspective on modeling atrial mechanics and is a significant step towards improved simulation and prediction of cardiac health.