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Explicitly accounting for uncertainties is paramount to the safety of engineering structures. Optimization which is often carried out at the early stage of the structural design offers an ideal framework for this task. When the uncertainties are mainly affecting the objective function, robust design optimization is traditionally considered. This work further assumes the existence of multiple and competing objective functions that need to be dealt with simultaneously. The optimization problem is formulated by considering quantiles of the objective functions which allows for the combination of both optimality and robustness in a single metric. By introducing the concept of common random numbers, the resulting nested optimization problem may be solved using a general-purpose solver, herein the non-dominated sorting genetic algorithm (NSGA-II). The computational cost of such an approach is however a serious hurdle to its application in real-world problems. We therefore propose a surrogate-assisted approach using Kriging as an inexpensive approximation of the associated computational model. The proposed approach consists of sequentially carrying out NSGA-II while using an adaptively built Kriging model to estimate the quantiles. Finally, the methodology is adapted to account for mixed categorical-continuous parameters as the applications involve the selection of qualitative design parameters as well. The methodology is first applied to two analytical examples showing its efficiency. The third application relates to the selection of optimal renovation scenarios of a building considering both its life cycle cost and environmental impact. It shows that when it comes to renovation, the heating system replacement should be the priority.

In this paper, we consider a fully-discrete approximation of an abstract evolution equation deploying a non-conforming spatial approximation and finite differences in time (Rothe-Galerkin method). The main result is the convergence of the discrete solutions to a weak solution of the continuous problem. Therefore, the result can be interpreted either as a justification of the numerical method or as an alternative way of constructing weak solutions. We formulate the problem in the very general and abstract setting of so-called non-conforming Bochner pseudo-monotone operators, which allows for a unified treatment of several evolution problems. Our abstract results for non-conforming Bochner pseudo-monotone operators allow to establish (weak) convergence just by verifying a few natural assumptions on the operators time-by-time and on the discretization spaces. Hence, applications and extensions to several other evolution problems can be performed easily. We exemplify the applicability of our approach on several DG schemes for the unsteady $p$-Navier-Stokes problem. The results of some numerical experiments are reported in the final section.

This paper introduces a novel deep neural network architecture for solving the inverse scattering problem in frequency domain with wide-band data, by directly approximating the inverse map, thus avoiding the expensive optimization loop of classical methods. The architecture is motivated by the filtered back-projection formula in the full aperture regime and with homogeneous background, and it leverages the underlying equivariance of the problem and compressibility of the integral operator. This drastically reduces the number of training parameters, and therefore the computational and sample complexity of the method. In particular, we obtain an architecture whose number of parameters scale sub-linearly with respect to the dimension of the inputs, while its inference complexity scales super-linearly but with very small constants. We provide several numerical tests that show that the current approach results in better reconstruction than optimization-based techniques such as full-waveform inversion, but at a fraction of the cost while being competitive with state-of-the-art machine learning methods.

A Transformer-based deep direct sampling method is proposed for a class of boundary value inverse problems. A real-time reconstruction is achieved by evaluating the learned inverse operator between carefully designed data and the reconstructed images. An effort is made to give a specific example to a fundamental question: whether and how one can benefit from the theoretical structure of a mathematical problem to develop task-oriented and structure-conforming deep neural networks? Specifically, inspired by direct sampling methods for inverse problems, the 1D boundary data in different frequencies are preprocessed by a partial differential equation-based feature map to yield 2D harmonic extensions as different input channels. Then, by introducing learnable non-local kernels, the direct sampling is recast to a modified attention mechanism. The proposed method is then applied to electrical impedance tomography, a well-known severely ill-posed nonlinear inverse problem. The new method achieves superior accuracy over its predecessors and contemporary operator learners, as well as shows robustness with respect to noise. This research shall strengthen the insights that the attention mechanism, despite being invented for natural language processing tasks, offers great flexibility to be modified in conformity with the a priori mathematical knowledge, which ultimately leads to the design of more physics-compatible neural architectures.

We study the sparse high-dimensional Gaussian mixture model when the number of clusters is allowed to grow with the sample size. A minimax lower bound for parameter estimation is established, and we show that a constrained maximum likelihood estimator achieves the minimax lower bound. However, this optimization-based estimator is computationally intractable because the objective function is highly nonconvex and the feasible set involves discrete structures. To address the computational challenge, we propose a Bayesian approach to estimate high-dimensional Gaussian mixtures whose cluster centers exhibit sparsity using a continuous spike-and-slab prior. Posterior inference can be efficiently computed using an easy-to-implement Gibbs sampler. We further prove that the posterior contraction rate of the proposed Bayesian method is minimax optimal. The mis-clustering rate is obtained as a by-product using tools from matrix perturbation theory. The proposed Bayesian sparse Gaussian mixture model does not require pre-specifying the number of clusters, which can be adaptively estimated via the Gibbs sampler. The validity and usefulness of the proposed method is demonstrated through simulation studies and the analysis of a real-world single-cell RNA sequencing dataset.

This paper is concerned with a direct sampling method for imaging the support of a frequency-dependent source term embedded in a homogeneous and isotropic medium. The source term is given by the Fourier transform of a time-dependent source whose radiating period in the time domain is known. The time-dependent source is supposed to be stationary in the sense that its compact support does not vary along the time variable. Via a multi-frequency direct sampling method, we show that the smallest strip containing the source support and perpendicular to the observation direction can be recovered from far-field patterns at a fixed observation angle. With multiple but sparse observation directions, the shape of the convex hull of the source support can be recovered. The frequency-domain analysis performed here can be used to handle inverse time-dependent source problems. Our algorithm has low computational overhead and is robust against noise. Numerical experiments in both two and three dimensions have proved our theoretical findings.

Inverse medium scattering solvers generally reconstruct a single solution without an associated measure of uncertainty. This is true both for the classical iterative solvers and for the emerging deep learning methods. But ill-posedness and noise can make this single estimate inaccurate or misleading. While deep networks such as conditional normalizing flows can be used to sample posteriors in inverse problems, they often yield low-quality samples and uncertainty estimates. In this paper, we propose U-Flow, a Bayesian U-Net based on conditional normalizing flows, which generates high-quality posterior samples and estimates physically-meaningful uncertainty. We show that the proposed model significantly outperforms the recent normalizing flows in terms of posterior sample quality while having comparable performance with the U-Net in point estimation.

Given ample experimental data from a system governed by differential equations, it is possible to use deep learning techniques to construct the underlying differential operators. In this work we perform symbolic discovery of differential operators in a situation where there is sparse experimental data. This small data regime in machine learning can be made tractable by providing our algorithms with prior information about the underlying dynamics. Physics Informed Neural Networks (PINNs) have been very successful in this regime (reconstructing entire ODE solutions using only a single point or entire PDE solutions with very few measurements of the initial condition). We modify the PINN approach by adding a neural network that learns a representation of unknown hidden terms in the differential equation. The algorithm yields both a surrogate solution to the differential equation and a black-box representation of the hidden terms. These hidden term neural networks can then be converted into symbolic equations using symbolic regression techniques like AI Feynman. In order to achieve convergence of these neural networks, we provide our algorithms with (noisy) measurements of both the initial condition as well as (synthetic) experimental data obtained at later times. We demonstrate strong performance of this approach even when provided with very few measurements of noisy data in both the ODE and PDE regime.

Engineers and scientists have been collecting and analyzing fatigue data since the 1800s to ensure the reliability of life-critical structures. Applications include (but are not limited to) bridges, building structures, aircraft and spacecraft components, ships, ground-based vehicles, and medical devices. Engineers need to estimate S-N relationships (Stress or Strain versus Number of cycles to failure), typically with a focus on estimating small quantiles of the fatigue-life distribution. Estimates from this kind of model are used as input to models (e.g., cumulative damage models) that predict failure-time distributions under varying stress patterns. Also, design engineers need to estimate lower-tail quantiles of the closely related fatigue-strength distribution. The history of applying incorrect statistical methods is nearly as long and such practices continue to the present. Examples include treating the applied stress (or strain) as the response and the number of cycles to failure as the explanatory variable in regression analyses (because of the need to estimate strength distributions) and ignoring or otherwise mishandling censored observations (known as runouts in the fatigue literature). The first part of the paper reviews the traditional modeling approach where a fatigue-life model is specified. We then show how this specification induces a corresponding fatigue-strength model. The second part of the paper presents a novel alternative modeling approach where a fatigue-strength model is specified and a corresponding fatigue-life model is induced. We explain and illustrate the important advantages of this new modeling approach.

Since deep neural networks were developed, they have made huge contributions to everyday lives. Machine learning provides more rational advice than humans are capable of in almost every aspect of daily life. However, despite this achievement, the design and training of neural networks are still challenging and unpredictable procedures. To lower the technical thresholds for common users, automated hyper-parameter optimization (HPO) has become a popular topic in both academic and industrial areas. This paper provides a review of the most essential topics on HPO. The first section introduces the key hyper-parameters related to model training and structure, and discusses their importance and methods to define the value range. Then, the research focuses on major optimization algorithms and their applicability, covering their efficiency and accuracy especially for deep learning networks. This study next reviews major services and toolkits for HPO, comparing their support for state-of-the-art searching algorithms, feasibility with major deep learning frameworks, and extensibility for new modules designed by users. The paper concludes with problems that exist when HPO is applied to deep learning, a comparison between optimization algorithms, and prominent approaches for model evaluation with limited computational resources.