arXiv subjects

Jingye Tan

Publications and source records attributed to Jingye Tan.

9 recordsLinked to original sources

arXiv2026

Materials Behavior as Mechanism Ensembles: A Probabilistic Framework for Emergent Behaviors

Materials behavior is often treated as a deterministic mapping from structure to properties, yet many important phenomena emerge from the conditional activation of multiple mechanisms across scales. This is especially evident in fatigue of metals, where crack growth is typically modeled as monotonic and irreversible process, despite evidence that local microstructure, loading history, and competing unit processes can shift the balance among propagation, arrest, and self-healing. Here we present a probabilistic framework that describes materials behavior as an ensemble of constituent mechanisms whose activation, interaction, and evolution determine emergent outcomes. The framework connects mechanism activation, state evolution, and macroscopic observables in a probabilistic way. In the case of fatigue crack propagation, it reframes damage tolerance as an inference problem over mechanism competition and provides a basis for integrating multiscale simulation, multimodal characterization, and machine learning. The same logic extends to other physical and chemical systems suggesting a portable framework for any system in which emergent behavior reflects mechanism competition under changing conditions. The broader ambition of this perspective review is a shift from correlating structure and performance after the fact to identifying, in advance, the conditions that make desired emergent behavior probable.

cond-mat.mtrl-sci↗

arXiv2026

Interval and fuzzy physics-augmented neural networks (iPANN and fPANN) for uncertainty quantification and propagation in constitutive modeling

Constitutive modeling under uncertainty remains a central challenge for reliable mechanics simulations, particularly when the available stress-deformation data are sparse, noisy, or heterogeneous. We propose interval and fuzzy physics-augmented neural networks (iPANNs and fPANNs) for uncertainty-aware hyperelastic constitutive modeling. iPANNs learn sparse lower, mean, and upper free energy density branches whose stresses, obtained by automatic differentiation, ultimately enclose noisy stress observations. In contrast to this deterministic interval description, fPANNs embed the learned iPANN branches into a fuzzy-set representation through alpha-cut interpolation, yielding a nested family of admissible responses. iPANNs and fPANNs encode mechanistic constraints - preserving objectivity, consistency and promoting polyconvexity - and smoothed L0 regularization promotes interpretable energy representations. The bound models are trained through a two-stage transfer-learning procedure in which a sparse mean constitutive response is learned first and then fine-tuned into lower and upper energy branches. We evaluate the framework on synthetic isotropic hyperelastic data with heteroscedastic noise, varying random realizations, shifted noise means, and varying noise magnitudes. The results show that the learned bounds enclose noisy stress observations while generalizing to the test set. Further, we examine the propagation of uncertainty through the mean, upper and lower bound predictions of the learned iPANN models in a finite element setting. The proposed framework provides a compact, physics-consistent route for distribution-free aleatoric uncertainty quantification in hyperelastic constitutive modeling, and propagation in downstream finite element simulations.

cs.LG↗

arXiv2026

Towards end-to-end optimization in multimaterial 3D printing

Multimaterial 3D printing enables the fabrication of functionally graded components, but optimizing their spatial material distribution alongside structural topology remains a formidable challenge due to high-dimensional design spaces and complex constitutive modeling. This paper presents an end-to-end computational framework integrating sparsified physics-augmented neural networks with finite-element-based topology optimization. By extracting closed-form, composition-aware hyperelastic constitutive laws from experimental data, this approach facilitates exact symbolic differentiation via the adjoint state method implemented with FEniCSx, efficiently circumventing the bottlenecks of applying neural network constitutive models. This pipeline is deployed on soft robotic gripper applications, demonstrating continuous composition optimization for highly anisotropic contact responses, and the concurrent optimization of macroscopic topology and material distribution under non-failure stretch constraints. This methodology could replace laborious empirical prototyping, establishing interpretable machine-learning models as practical, robust design primitives for advanced multimaterial additive manufacturing.

physics.comp-ph↗

arXiv2026

Influence of Heterogeneity on the Response of Architected Metamaterials

Architected metamaterials like foams and lattices exhibit complex responses governed by microstructural instabilities, localization, and phase-transition-like phenomena. Their behavior is further affected by heterogeneities inherent in their microstructure often caused through manufacturing processes. In this study we extend a gradient-enhanced, nonlocal continuum formulation to incorporate stochastic material heterogeneity through Gaussian random fields imposed on selected constitutive parameters. The framework enables independent control of both the amplitude and spatial correlation of material fluctuations while preserving thermodynamic consistency and regularization of localization. It also introduces a characteristic lengthscale ratio between the nonlocal and correlation lengthscales, that enables modeling at the limit of random or spatially correlated microstructures. Finite element simulations of confined compression and indentation show that heterogeneity fundamentally alters phase nucleation, localization morphology, and macroscopic response. Overall, the proposed framework provides a unified approach for linking stochastic material variability to instability-driven mechanics in architected metamaterials, enabling improved understanding of imperfection sensitivity, stability and design. It showcases how heterogeneity alone can influence characteristic features of the response, such as stability, slope of the plateau region, and elimination of the initial elastic regime.

cond-mat.mtrl-sci↗

arXiv2026

Towards Rapid Constitutive Model Discovery from Multi-Modal Data: Physics Augmented Finite Element Model Updating (paFEMU)

Recent progress in AI-enabled constitutive modeling has concentrated on moving from a purely data-driven paradigm to the enforcement of physical constraints and mechanistic principles, a concept referred to as physics augmentation. Classical phenomenological approaches rely on selecting a pre-defined model and calibrating its parameters, while machine learning methods often focus on discovery of the model itself. Sparse regression approaches lie in between, where large libraries of pre-defined models are probed during calibration. Sparsification in the aforementioned paradigm, but also in the context of neural network architecture, has been shown to enable interpretability, uncertainty quantification, but also heterogeneous software integration due to the low-dimensional nature of the resulting models. Most works in AI-enabled constitutive modeling have also focused on data from a single source, but in reality, materials modeling workflows can contain data from many different sources (multi-modal data), and also from testing other materials within the same materials class (multi-fidelity data). In this work, we introduce physics augmented finite element model updating (paFEMU), as a transfer learning approach that combines AI-enabled constitutive modeling, sparsification for interpretable model discovery, and finite element-based adjoint optimization utilizing multi-modal data. This is achieved by combining simple mechanical testing data, potentially from a distinct material, with digital image correlation-type full-field data acquisition to ultimately enable rapid constitutive modeling discovery. The simplicity of the sparse representation enables easy integration of neural constitutive models in existing finite element workflows, and also enables low-dimensional updating during transfer learning.

cs.LG↗

arXiv2023

A Scalable Algorithm for Multi-Material Design of Thermal Insulation Components Under Uncertainty

This work presents a scalable computational framework for optimal design under uncertainty with application to multi-material insulation components of building envelopes. The forward model consists of a multi-phase thermo-mechanical model of porous materials governed by coupled partial differential equations (PDEs). The design parameter (material porosity) is an uncertain and space-dependent field, resulting in a high-dimensional PDE-constrained optimization under uncertainty problem after finite element discretization. The robust design framework uses a risk-averse formulation consisting of the mean and variance of the design objective to achieve target thermal and mechanical performances and mitigate uncertainty. To ensure the efficiency and scalability of the solution, a second-order Taylor approximation of the mean and variance and the low-rank structure of the preconditioned Hessian of the design objective are leveraged, which uncovers the low effective dimension of the high-dimensional uncertain parameter space. Moreover, a gradient-based optimization method is implemented using the Lagrangian formalism to derive expressions for the gradient and Hessian with respect to the design and uncertain parameters. Finally, approximated $\ell_0$ regularization functions are utilized via a continuation numerical scheme to promote sparsity in the designed porosity. The framework's accuracy, efficiency, and scalability are demonstrated with numerical examples of a building envelope insulation scenario.

math.OC↗

arXiv2022

Bayesian Inference of Tissue Heterogeneity for Individualized Prediction of Glioma Growth

Reliably predicting the future spread of brain tumors using imaging data and on a subject-specific basis requires quantifying uncertainties in data, biophysical models of tumor growth, and spatial heterogeneity of tumor and host tissue. This work introduces a Bayesian framework to calibrate the spatial distribution of the parameters within a tumor growth model to quantitative magnetic resonance imaging (MRI) data and demonstrates its implementation in a pre-clinical model of glioma. The framework leverages an atlas-based brain segmentation of grey and white matter to establish subject-specific priors and tunable spatial dependencies of the model parameters in each region. Using this framework, the tumor-specific parameters are calibrated from quantitative MRI measurements early in the course of tumor development in four rats and used to predict the spatial development of the tumor at later times. The results suggest that the tumor model, calibrated by animal-specific imaging data at one time point, can accurately predict tumor shapes with a Dice coefficient > 0.89. However, the reliability of the predicted volume and shape of tumors strongly relies on the number of earlier imaging time points used for calibrating the model. This study demonstrates, for the first time, the ability to determine the uncertainty in the inferred tissue heterogeneity and the model predicted tumor shape.

cs.CE↗

arXiv2021

A Predictive Multiphase Model of Silica Aerogels for Building Envelope Insulations

This work develops a multiphase thermomechanical model of porous silica aerogel and implements an uncertainty analysis framework consisting of the Sobol methods for global sensitivity analyses and Bayesian inference using a set of experimental data of silica aerogel. A notable feature of this work is implementing a new noise model within the Bayesian inversion to account for data uncertainty and modeling error. The hyper-parameters in the likelihood balance data misfit and prior contribution to the parameter posteriors and prevent their biased estimation. The results indicate that the uncertainty in solid conductivity and elasticity are the most influential parameters affecting the model output variance. Also, the Bayesian inference shows that despite the microstructural randomness in the thermal measurements, the model captures the data with 2% error. However, the model is inadequate in simulating the stress-strain measurements resulting in significant uncertainty in the computational prediction of a building insulation component.

cond-mat.mtrl-sci↗

arXiv2020

A Predictive Discrete-Continuum Multiscale Model of Plasticity With Quantified Uncertainty

Multiscale models of materials, consisting of upscaling discrete simulations to continuum models, are unique in their capability to simulate complex materials behavior. The fundamental limitation in multiscale models is the presence of uncertainty in the computational predictions delivered by them. In this work, a sequential multiscale model has been developed, incorporating discrete dislocation dynamics (DDD) simulations and a strain gradient plasticity (SGP) model to predict the size effect in plastic deformations of metallic micro-pillars. The DDD simulations include uniaxial compression of micro-pillars with different sizes and over a wide range of initial dislocation densities and spatial distributions of dislocations. An SGP model is employed at the continuum level that accounts for the size-dependency of flow stress and hardening rate. Sequences of uncertainty analyses have been performed to assess the predictive capability of the multiscale model. The variance-based global sensitivity analysis determines the effect of parameter uncertainty on the SGP model prediction. The multiscale model is then constructed by calibrating the continuum model using the data furnished by the DDD simulations. A Bayesian calibration method is implemented to quantify the uncertainty due to microstructural randomness in discrete dislocation simulations (density and spatial distributions of dislocations) on the macroscopic continuum model prediction (size effect in plastic deformation). The outcomes of this study indicate that the discrete-continuum multiscale model can accurately simulate the plastic deformation of micro-pillars, despite the significant uncertainty in the DDD results. Additionally, depending on the macroscopic features represented by the DDD simulations, the SGP model can reliably predict the size effect in plasticity responses of the micropillars with below 10% of error

cs.CE↗