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Gianluigi Rozza

Publications and source records attributed to Gianluigi Rozza.

At least 55 records · Page 3Linked to original sources

Coupling Physics Informed Neural Networks with External Solvers

The current work aims to incorporate physics-based loss in Physics Informed Neural Network (PINN) directly using the numerical residual obtained from the governing equation in any dicretized forward solver. PINN's major difficulties in coupling with external forward solvers arise from the inability to access the discretized form (Finite difference, finite volume, finite element, etc.) of the governing equation directly through the network and to include them in its computational graph. This poses a significant challenge to conventional automatic-differentiation-based derivative computation of physics-based loss terms concerning the neural network hyperparameters if gradient-based optimization techniques are adopted. Therefore, we propose modifying the physics-based loss term to account for the residual arising from the external solver and to compute the derivative required for the optimization machinery. The proposed methodologies are demonstrated on benchmark full-order and reduced-order systems.

math.NA↗

Projection-based model order reduction for residence time distribution analysis of an industrial-scale continuous casting tundish

The flow behavior in the continuous casting tundish plays a critical role in steel quality and is typically characterized via residence time distribution (RTD) curves. This study investigates the fluid flow behaviour in a single-strand tundish using numerical and experimental approaches. Full-order model (FOM) steady-state simulations were conducted under both isothermal and non-isothermal conditions to assess the influence of thermal buoyancy on the flow characteristics. The results show that buoyancy effects under non-isothermal conditions have a negligible impact on the overall velocity field. The converged flow fields serve as initial conditions for transient tracer transport simulations, enabling evaluation of RTD curves and volume partitioning. A Galerkin projection-based reduced-order model (ROM) is developed to efficiently derive RTD curves. Comparison of RTD curves from experiments, FOM simulations, and ROM predictions demonstrates strong agreement, with both computational approaches closely matching experimental data. A parameter-time dependent ROM is subsequently developed using Galerkin projection and operator interpolation. This enables efficient evaluation of RTD curves across varying parameter values with significantly reduced computational cost compared to full-order simulations. The ROM framework is well-suited for real-time analysis, design processes, optimization, and digital twin applications in metallurgical processes.

physics.flu-dyn↗

A Deep-Learning Enhanced Gappy Proper Orthogonal Decomposition Method for Conjugate Heat Transfer Problem

The current study aims to develop a non-intrusive Reduced Order Model (ROM) to reconstruct the full temperature field for a large-scale industrial application based on both numerical and experimental datasets. The proposed approach is validated against a domestic refrigerator. At the full order level, air circulation and heat transfer in fluid and between fluid and surrounding solids in the fridge were numerically studied using the Conjugated Heat Transfer (CHT) method to explore both the natural and forced convection-based fridge model followed by a parametric study-based on the ambient temperature, fridge fan velocity, and evaporator temperature. The main novelty of the current work is the introduction of a stable Artificial Neural Network (ANN) enhanced Gappy Proper Orthogonal Decomposition (GPOD) method which shows better performance than the conventional GPOD approach in such large-scale industrial applications. The full-order model is validated with the experimental results and the prediction accuracy of the surrogate model associated with different reduced-order approaches is compared with the benchmark numerical results or high-fidelity results. In our current work, we show that a prediction error of one degree centigrade and computational speed-up of 5000 is achieved even at a very sparse training dataset using the proposed deep-learning enhanced GPOD approach.

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Efficient Numerical Strategies for Entropy-Regularized Semi-Discrete Optimal Transport

Semi-discrete optimal transport (SOT), which maps a continuous probability measure to a discrete one, is a fundamental problem with wide-ranging applications. Entropic regularization is often employed to solve the SOT problem, leading to a regularized (RSOT) formulation that can be solved efficiently via its convex dual. However, a significant computational challenge emerges when the continuous source measure is discretized via the finite element (FE) method to handle complex geometries or densities, such as those arising from solutions to Partial Differential Equations (PDEs). The evaluation of the dual objective function requires dense interactions between the numerous source quadrature points and all target points, creating a severe bottleneck for large-scale problems. This paper presents a cohesive framework of numerical strategies to overcome this challenge. We accelerate the dual objective and gradient evaluations by combining distance-based truncation with fast spatial queries using R-trees. For overall convergence, we integrate multilevel techniques based on hierarchies of both the FE source mesh and the discrete target measure, alongside a robust scheduling strategy for the regularization parameter. When unified, these methods drastically reduce the computational cost of RSOT, enabling its practical application to complex, large-scale scenarios. We provide an open-source C++ implementation of this framework, built upon the deal.II finite element library, available at https://github.com/SemiDiscreteOT/SemiDiscreteOT.

math.NA↗

A reduced-order model for segregated fluid-structure interaction solvers based on an ALE approach

This article presents a Galerkin projection-based reduced-order modelling (ROM) approach for segregated fluid-structure interaction (FSI) problems, formulated within an Arbitrary Lagrangian Eulerian (ALE) framework at low Reynolds numbers using the Finite Volume Method (FVM). The ROM is constructed using Proper Orthogonal Decomposition (POD) and incorporates a data-driven technique that combines classical Galerkin projection with radial basis function (RBF) networks. The results demonstrate the numerical stability and accuracy of the proposed method relative to the high-fidelity model. The ROM successfully captures transient flow fields and, importantly, the forces acting on the moving structure without exhibiting unphysical growth or divergence over time. This is further supported by the bounded evolution of error metrics and physical observables, which remain consistent with the full-order simulations throughout the prediction horizon. The method's effectiveness is validated through a benchmark vortex-induced vibration (VIV) case involving a circular cylinder at Reynolds number Re=200. The hybrid ROM approach yields an accurate and efficient tool for solving FSI problems involving mesh motion.

math.NA↗

BARNN: A Bayesian Autoregressive and Recurrent Neural Network

Autoregressive and recurrent networks have achieved remarkable progress across various fields, from weather forecasting to molecular generation and Large Language Models. Despite their strong predictive capabilities, these models lack a rigorous framework for addressing uncertainty, which is key in scientific applications such as PDE solving, molecular generation and Machine Learning Force Fields. To address this shortcoming we present BARNN: a variational Bayesian Autoregressive and Recurrent Neural Network. BARNNs aim to provide a principled way to turn any autoregressive or recurrent model into its Bayesian version. BARNN is based on the variational dropout method, allowing to apply it to large recurrent neural networks as well. We also introduce a temporal version of the "Variational Mixtures of Posteriors" prior (tVAMP-prior) to make Bayesian inference efficient and well-calibrated. Extensive experiments on PDE modelling and molecular generation demonstrate that BARNN not only achieves comparable or superior accuracy compared to existing methods, but also excels in uncertainty quantification and modelling long-range dependencies.

cs.LG↗

Non-intrusive model reduction of advection-dominated hyperbolic problems using neural network shift augmented manifold transformation

Advection-dominated problems are predominantly noticed in nature, engineering systems, and various industrial processes. Traditional linear compression methods, such as proper orthogonal decomposition (POD) and reduced basis (RB) methods are ill-suited for these problems, due to slow Kolmogorov $n$-width decay. This results in inefficient and inaccurate reduced order models (ROMs). There are few non-linear approaches to accelerate the Kolmogorov $n$-width decay. In this work, we use a neural network shift augmented transformation technique that employs automatic shift detection. This approach leverages a deep-learning framework to derive a parameter-dependent mapping between the original manifold $\mathcal{M}$ and the transformed manifold $\tilde{\mathcal{M}}$. We apply a linear compression method to obtain a low-dimensional linear approximation subspace of the transformed manifold $\tilde{\mathcal{M}}$. Furthermore, we construct non-intrusive reduced order models on the resulting transformed linear approximation subspace and employ automatic shift detection for predictions in the online stage. We propose a complete framework, the neural network shift-augmented proper orthogonal decomposition-based reduced order model (NNsPOD-ROM) algorithm, comprising both offline and online stages for model reduction of advection-dominated problems. We test our proposed methodology on numerous experiments to evaluate its performance on the 1D linear advection equation, a higher order method benchmark case - the 2D isentropic convective vortex, and 2D two-phase flow.

math.NA↗

Generative Models for Parameter Space Reduction applied to Reduced Order Modelling

Solving and optimising Partial Differential Equations (PDEs) in geometrically parameterised domains often requires iterative methods, leading to high computational and time complexities. One potential solution is to learn a direct mapping from the parameters to the PDE solution. Two prominent methods for this are Data-driven Non-Intrusive Reduced Order Models (DROMs) and Parametrised Physics Informed Neural Networks (PPINNs). However, their accuracy tends to degrade as the number of geometric parameters increases. To address this, we propose adopting Generative Models to create new geometries, effectively reducing the number of parameters, and improving the performance of DROMs and PPINNs. The first section briefly reviews the general theory of Generative Models and provides some examples, whereas the second focusses on their application to geometries with fixed or variable points, emphasising their integration with DROMs and PPINNs. DROMs trained on geometries generated by these models demonstrate enhanced accuracy due to reduced parameter dimensionality. For PPINNs, we introduce a methodology that leverages Generative Models to reduce the parameter dimensions and improve convergence. This approach is tested on a Poisson equation defined over deformed Stanford Bunny domains.

math.NA↗

Model Reduction for Transport-Dominated Problems via Cross-Correlation Based Snapshot Registration

Traditional linear approximation methods, such as proper orthogonal decomposition and the reduced basis method, are ill-suited for transport-dominated problems due to the slow decay of the Kolmogorov $n$-width, leading to inefficient and inaccurate reduced-order models. In this work, we propose a model reduction approach for transport-dominated problems by employing cross-correlation based snapshot registration to accelerate the Kolmogorov $n$-width decay, thereby enabling the construction of efficient and accurate reduced-order models using linear approximation methods. We propose a complete framework comprising offline-online stages for the development of reduced order models using the cross-correlation based snapshots registration. The effectiveness of the proposed approach is demonstrated using two test cases: 1D travelling waves and the higher-order methods benchmark test case, 2D isentropic convective vortex.

math.NA↗

Data-driven Closure Strategies for Parametrized Reduced Order Models via Deep Operator Networks

In this paper, we propose an equation-based parametric Reduced Order Model (ROM), whose accuracy is improved with data-driven terms added into the reduced equations. These additions have the aim of reintroducing contributions that in standard reduced-order approaches are not taken into account. In particular, in this work we focus on a Proper Orthogonal Decomposition (POD)-based formulation and our goal is to build a closure or correction model, aimed to re-introduce the contribution of the discarded modes. The approach has been investigated in previous works, and the goal of this manuscript is to extend the model to a parametric setting making use of machine learning procedures, and, in particular, of deep operator networks. More in detail, we model the closure terms through a deep operator network taking as input the reduced variables and the parameters of the problem. We tested the methods on three test cases with different behaviors: the periodic turbulent flow past a circular cylinder, the unsteady turbulent flow in a channel-driven cavity, and the geometrically-parametrized backstep flow. The performance of the machine learning-enhanced ROM is deeply studied in different modal regimes, and considerably improved the pressure and velocity accuracy with respect to the standard POD-Galerkin approach.

math.NA↗

Projection-based Reduced Order Modelling for Unsteady Parametrized Optimal Control Problems in 3D Cardiovascular Flows

This paper presents a projection-based reduced order modelling (ROM) framework for unsteady parametrized optimal control problems (OCP$_{(μ)}$s) arising from cardiovascular (CV) applications. In real-life scenarios, accurately defining outflow boundary conditions in patient-specific models poses significant challenges due to complex vascular morphologies, physiological conditions, and high computational demands. These challenges make it difficult to compute realistic and reliable CV hemodynamics by incorporating clinical data such as 4D magnetic resonance imaging. To address these challenges, we focus on controlling the outflow boundary conditions to optimize CV flow dynamics and minimize the discrepancy between target and computed flow velocity profiles. The fluid flow is governed by unsteady Navier--Stokes equations with physical parametric dependence, i.e. the Reynolds number. Numerical solutions of OCP$_{(μ)}$s require substantial computational resources, highlighting the need for robust and efficient ROMs to perform real-time and many-query simulations. Here, we aim at investigating the performance of a projection-based reduction technique that relies on the offline-online paradigm, enabling significant computational cost savings. The Galerkin finite element method is used to compute the high-fidelity solutions in the offline phase. We implemented a nested-proper orthogonal decomposition (nested-POD) for fast simulation of OCP$_{(μ)}$s that encompasses two stages: temporal compression for reducing dimensionality in time, followed by parametric-space compression on the precomputed POD modes. We tested the efficacy of the methodology on vascular models, namely an idealized bifurcation geometry and a patient-specific coronary artery bypass graft, incorporating stress control at the outflow boundary, observing consistent speed-up with respect to high-fidelity strategies.

math.NA↗

Randomized Proper Orthogonal Decomposition for data-driven reduced order modeling of a two-layer quasi-geostrophic ocean model

The two-layer quasi-geostrophic equations (2QGE) serve as a simplified model for simulating wind-driven, stratified ocean flows. However, their numerical simulation remains computationally expensive due to the need for high-resolution meshes to capture a wide range of turbulent scales. This becomes especially problematic when several simulations need to be run because of, e.g., uncertainty in the parameter settings. To address this challenge, we propose a data-driven reduced order model (ROM) for the 2QGE that leverages randomized proper orthogonal decomposition (rPOD) and long short-term memory (LSTM) networks. To efficiently generate the snapshot data required for model construction, we apply a nonlinear filtering stabilization technique that allows for the use of larger mesh sizes compared to a direct numerical simulations (DNS). Thanks to the use of rPOD to extract the dominant modes from the snapshot matrices, we achieve up to 700 times speedup over the use of deterministic POD. LSTM networks are trained with the modal coefficients associated with the snapshots to enable the prediction of the time- and parameter-dependent modal coefficients during the online phase, which is hundreds of thousands of time faster than a DNS. We assess the accuracy and efficiency of our rPOD-LSTM ROM through an extension of a well-known benchmark called double-gyre wind forcing test. The dimension of the parameter space in this test is increased from two to four.

math.NA↗

Mesh-Informed Reduced Order Models for Aneurysm Rupture Risk Prediction

The complexity of the cardiovascular system needs to be accurately reproduced in order to promptly acknowledge health conditions; to this aim, advanced multifidelity and multiphysics numerical models are crucial. On one side, Full Order Models (FOMs) deliver accurate hemodynamic assessments, but their high computational demands hinder their real-time clinical application. In contrast, Reduced Order Models (ROMs) provide more efficient yet accurate solutions, essential for personalized healthcare and timely clinical decision-making. In this work, we explore the application of computational fluid dynamics (CFD) in cardiovascular medicine by integrating FOMs with ROMs for predicting the risk of aortic aneurysm growth and rupture. Wall Shear Stress (WSS) and the Oscillatory Shear Index (OSI), sampled at different growth stages of the thoracic aortic aneurysm, are predicted by means of Graph Neural Networks (GNNs). GNNs exploit the natural graph structure of the mesh obtained by the Finite Volume (FV) discretization, taking into account the spatial local information, regardless of the dimension of the input graph. Our experimental validation framework yields promising results, confirming our method as a valid alternative that overcomes the curse of dimensionality.

physics.med-ph↗

Data-driven Optimization for the Evolve-Filter-Relax regularization of convection-dominated flows

Numerical stabilization techniques are often employed in under-resolved simulations of convection-dominated flows to improve accuracy and mitigate spurious oscillations. Specifically, the evolve--filter--relax (EFR) algorithm is a framework which consists in evolving the solution, applying a filtering step to remove high-frequency noise, and relaxing through a convex combination of filtered and original solutions. The stability and accuracy of the EFR solution strongly depend on two parameters, the filter radius $δ$ and the relaxation parameter $χ$. Standard choices for these parameters are usually fixed in time, and related to the full order model setting, i.e., the grid size for $δ$ and the time step for $χ$. The key novelties with respect to the standard EFR approach are: (i) time-dependent parameters $δ(t)$ and $χ(t)$, and (ii) data-driven adaptive optimization of the parameters in time, considering a fully-resolved simulation as reference. In particular, we propose three different classes of optimized-EFR (Opt-EFR) strategies, aiming to optimize one or both parameters. The new Opt-EFR strategies are tested in the under-resolved simulation of a turbulent flow past a cylinder at $Re=1000$. The Opt-EFR proved to be more accurate than standard approaches by up to 99$\%$, while maintaining a similar computational time. In particular, the key new finding of our analysis is that such accuracy can be obtained only if the optimized objective function includes: (i) a global metric (as the kinetic energy), and (ii) spatial gradients' information.

math.NA↗

Data-driven parameterization refinement for the structural optimization of cruise ship hulls

In this work, we focus on the early design phase of cruise ship hulls, where the designers are tasked with ensuring the structural resilience of the ship against extreme waves while reducing steel usage and respecting safety and manufacturing constraints. At this stage the geometry of the ship is already finalized and the designer choose the thickness of the primary structural elements, such as decks, bulkheads, and the shell. Reduced order modeling and black-box optimization techniques reduce the use of expensive finite element analysis to only validate the most promising configurations, thanks to the efficient exploration of the domain of decision variables. However, the quality of the final results heavily relies on the problem formulation, and on how the structural elements are assigned to the decision variables. With the increased request for alternative fuels and engine technologies, the designers are often faced with novel configurations and risk producing ill-suited parameterizations. To address this issue, we enhanced a structural optimization pipeline for cruise ships developed in collaboration with Fincantieri S.p.A. with a novel data-driven hierarchical reparameterization procedure, based on the optimization of a series of sub-problems. Moreover, we implemented a multi-objective optimization module to provide the designers with insights into the efficient trade-offs between competing quantities of interest and enhanced the single-objective Bayesian optimization module. The new pipeline is tested on a simplified midship section and a full ship hull, comparing the automated reparameterization to a baseline model provided by the designers. The tests show that the iterative refinement outperforms the baseline, thus streamlining the initial design phase and helping tackle more innovative projects.

math.NA↗

Combining Extended Convolutional Autoencoders and Reservoir Computing for Accurate Reduced-Order Predictions of Atmospheric Flows

Forecasting atmospheric flows with traditional discretization methods, also called full order methods (e.g., finite element methods or finite volume methods), is computationally expensive. We propose to reduce the computational cost with a Reduced Order Model (ROM) that combines Extended Convolutional Autoencoders (E-CAE) and Reservoir Computing (RC). Thanks to an extended network depth, the E-CAE encodes the high-resolution data coming from the full order method into a compact latent representation and can decode it back into high-resolution with 75% lower reconstruction error than standard CAEs. The compressed data are fed to an RC network, which predicts their evolution. The advantage of RC networks is a reduced computational cost in the training phase compared to conventional predictive models. We assess our data-driven ROM through well-known 2D and 3D benchmarks for atmospheric flows. We show that our ROM accurately reconstructs and predicts the future system dynamics with errors below 6% in 2D and 8% in 3D, while significantly reducing the computational cost of a full-order simulation. Compared to other ROMs available in the literature, such as Dynamic Mode Decomposition and Proper Orthogonal Decomposition with Interpolation, our ROM is as efficient but more accurate. Thus, it is a promising alternative to high-dimensional atmospheric simulations.

math.NA↗

On the choice of proper outlet boundary conditions for numerical simulation of cardiovascular flows

It is well known that in the computational fluid dynamics simulations related to the cardiovascular system the enforcement of outflow boundary conditions is a crucial point. In fact, they highly affect the computed flow and a wrong setup could lead to unphysical results. In this chapter we discuss the main features of two different ways for the estimation of proper outlet boundary conditions in the context of hemodynamics simulations: on one side, a lumped parameter model of the downstream circulation and, on the other one, a technique based on optimal control.

physics.flu-dyn↗

Kinetic data-driven approach to turbulence subgrid modeling

Numerical simulations of turbulent flows are well known to pose extreme computational challenges due to the huge number of dynamical degrees of freedom required to correctly describe the complex multi-scale statistical correlations of the velocity. On the other hand, kinetic mesoscale approaches based on the Boltzmann equation, have the potential to describe a broad range of flows, stretching well beyond the special case of gases close to equilibrium, which results in the ordinary Navier-Stokes dynamics. Here we demonstrate that, by properly tuning, a kinetic approach can statistically reproduce the quantitative dynamics of the larger scales in turbulence, thereby providing an alternative, computationally efficient and physically rooted approach towards subgrid scale (SGS) modeling in turbulence. More specifically we show that by leveraging on data from fully resolved Direct Numerical Simulation (DNS) we can learn a collision operator for the discretized Boltzmann equation solver (the lattice Boltzmann method), which effectively implies a turbulence subgrid closure model. The mesoscopic nature of our formulation makes the learning problem fully local in both space and time, leading to reduced computational costs and enhanced generalization capabilities. We show that the model offers superior performance compared to traditional methods, such as the Smagorinsky model, being less dissipative and, therefore, being able to more closely capture the intermittency of higher-order velocity correlations. This foundational work lays the basis for extending the proposed framework to different turbulent flow settings and -- most importantly -- to develop new classes of hybrid data-driven kinetic-based models capable of faithfully capturing the complex macroscopic dynamics of diverse physical systems such as emulsions, non-Newtonian fluid and multiphase systems.

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