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Mesh-based Graph Neural Networks (GNNs) have recently shown capabilities to simulate complex multiphysics problems with accelerated performance times. However, mesh-based GNNs require a large number of message-passing (MP) steps and suffer from over-smoothing for problems involving very fine mesh. In this work, we develop a multiscale mesh-based GNN framework mimicking a conventional iterative multigrid solver, coupled with adaptive mesh refinement (AMR), to mitigate challenges with conventional mesh-based GNNs. We use the framework to accelerate phase field (PF) fracture problems involving coupled partial differential equations with a near-singular operator due to near-zero modulus inside the crack. We define the initial graph representation using all mesh resolution levels. We perform a series of downsampling steps using Transformer MP GNNs to reach the coarsest graph followed by upsampling steps to reach the original graph. We use skip connectors from the generated embedding during coarsening to prevent over-smoothing. We use Transfer Learning (TL) to significantly reduce the size of training datasets needed to simulate different crack configurations and loading conditions. The trained framework showed accelerated simulation times, while maintaining high accuracy for all cases compared to physics-based PF fracture model. Finally, this work provides a new approach to accelerate a variety of mesh-based engineering multiphysics problems

Inner products of neural network feature maps arises in a wide variety of machine learning frameworks as a method of modeling relations between inputs. This work studies the approximation properties of inner products of neural networks. It is shown that the inner product of a multi-layer perceptron with itself is a universal approximator for symmetric positive-definite relation functions. In the case of asymmetric relation functions, it is shown that the inner product of two different multi-layer perceptrons is a universal approximator. In both cases, a bound is obtained on the number of neurons required to achieve a given accuracy of approximation. In the symmetric case, the function class can be identified with kernels of reproducing kernel Hilbert spaces, whereas in the asymmetric case the function class can be identified with kernels of reproducing kernel Banach spaces. Finally, these approximation results are applied to analyzing the attention mechanism underlying Transformers, showing that any retrieval mechanism defined by an abstract preorder can be approximated by attention through its inner product relations. This result uses the Debreu representation theorem in economics to represent preference relations in terms of utility functions.

Karppa & Kaski (2019) proposed a novel ``broken" or ``opportunistic" matrix multiplication algorithm, based on a variant of Strassen's algorithm, and used this to develop new algorithms for Boolean matrix multiplication, among other tasks. Their algorithm can compute Boolean matrix multiplication in $O(n^{2.778})$ time. While asymptotically faster matrix multiplication algorithms exist, most such algorithms are infeasible for practical problems. We describe an alternative way to use the broken multiplication algorithm to approximately compute matrix multiplication, either for real-valued or Boolean matrices. In brief, instead of running multiple iterations of the broken algorithm on the original input matrix, we form a new larger matrix by sampling and run a single iteration of the broken algorithm on it. Asymptotically, our algorithm has runtime $O(n^{2.763})$, a slight improvement over the Karppa-Kaski algorithm. Since the goal is to obtain new practical matrix-multiplication algorithms, we also estimate the concrete runtime for our algorithm for some large-scale sample problems. It appears that for these parameters, further optimizations are still needed to make our algorithm competitive.

We introduce a higher-dimensional "cubical" chain complex and apply it to the design of quantum locally testable codes. Our cubical chain complex can be constructed for any dimension $t$, and in a precise sense generalizes the Sipser-Spielman construction of expander codes (case $t=1$) and the constructions by Dinur et. al and Panteleev and Kalachev of a square complex (case $t$=2), which have been applied to the design of classical locally testable and quantum low-density parity check codes respectively. For $t=4$ our construction gives a family of quantum locally testable codes conditional on a conjecture about robustness of four-tuples of random linear maps. These codes have linear dimension, inverse poly-logarithmic relative distance and soundness, and polylogarithmic-size parity checks. Our complex can be built in a modular way from two ingredients. Firstly, the geometry (edges, faces, cubes, etc.) is provided by a set $G$ of size $N$, together with pairwise commuting sets of actions $A_1,\ldots,A_t$ on it. Secondly, the chain complex itself is obtained by associating local coefficient spaces based on codes, with each geometric object, and introducing local maps on those coefficient spaces. We bound the cycle and co-cycle expansion of the chain complex. The assumptions we need are two-fold: firstly, each Cayley graph $Cay(G,A_j)$ needs to be a good (spectral) expander, and secondly, the families of codes and their duals both need to satisfy a form of robustness (that generalizes the condition of agreement testability for pairs of codes). While the first assumption is easy to satisfy, it is currently not known if the second can be achieved.

In 2012 Chen and Singer introduced the notion of discrete residues for rational functions as a complete obstruction to rational summability. More explicitly, for a given rational function f(x), there exists a rational function g(x) such that f(x) = g(x+1) - g(x) if and only if every discrete residue of f(x) is zero. Discrete residues have many important further applications beyond summability: to creative telescoping problems, thence to the determination of (differential-)algebraic relations among hypergeometric sequences, and subsequently to the computation of (differential) Galois groups of difference equations. However, the discrete residues of a rational function are defined in terms of its complete partial fraction decomposition, which makes their direct computation impractical due to the high complexity of completely factoring arbitrary denominator polynomials into linear factors. We develop a factorization-free algorithm to compute discrete residues of rational functions, relying only on gcd computations and linear algebra.

Context: Experiment replications play a central role in the scientific method. Although software engineering experimentation has matured a great deal, the number of experiment replications is still relatively small. Software engineering experiments are composed of complex concepts, procedures and artefacts. Laboratory packages are a means of transfer-ring knowledge among researchers to facilitate experiment replications. Objective: This paper investigates the experiment replication process to find out what information is needed to successfully replicate an experiment. Our objective is to propose the content and structure of laboratory packages for software engineering experiments. Method: We evaluated seven replications of three different families of experiments. Each replication had a different experimenter who was, at the time, unfamiliar with the experi-ment. During the first iterations of the study, we identified experimental incidents and then proposed a laboratory package structure that addressed these incidents, including docu-ment usability improvements. We used the later iterations to validate and generalize the laboratory package structure for use in all software engineering experiments. We aimed to solve a specific problem, while at the same time looking at how to contribute to the body of knowledge on laboratory packages. Results: We generated a laboratory package for three different experiments. These packages eased the replication of the respective experiments. The evaluation that we conducted shows that the laboratory package proposal is acceptable and reduces the effort currently required to replicate experiments in software engineering. Conclusion: We think that the content and structure that we propose for laboratory pack-ages can be useful for other software engineering experiments.

We prove explicit uniform two-sided bounds for the phase functions of Bessel functions and of their derivatives. As a consequence, we obtain new enclosures for the zeros of Bessel functions and their derivatives in terms of inverse values of some elementary functions. These bounds are valid, with a few exceptions, for all zeros and all Bessel functions with non-negative indices. We provide numerical evidence showing that our bounds either improve or closely match the best previously known ones.

We introduce a novel continual learning method based on multifidelity deep neural networks. This method learns the correlation between the output of previously trained models and the desired output of the model on the current training dataset, limiting catastrophic forgetting. On its own the multifidelity continual learning method shows robust results that limit forgetting across several datasets. Additionally, we show that the multifidelity method can be combined with existing continual learning methods, including replay and memory aware synapses, to further limit catastrophic forgetting. The proposed continual learning method is especially suited for physical problems where the data satisfy the same physical laws on each domain, or for physics-informed neural networks, because in these cases we expect there to be a strong correlation between the output of the previous model and the model on the current training domain.

Computationally efficient surrogates for parametrized physical models play a crucial role in science and engineering. Operator learning provides data-driven surrogates that map between function spaces. However, instead of full-field measurements, often the available data are only finite-dimensional parametrizations of model inputs or finite observables of model outputs. Building off of Fourier Neural Operators, this paper introduces the Fourier Neural Mappings (FNMs) framework that is able to accommodate such finite-dimensional inputs and outputs. The paper develops universal approximation theorems for the method. Moreover, in many applications the underlying parameter-to-observable (PtO) map is defined implicitly through an infinite-dimensional operator, such as the solution operator of a partial differential equation. A natural question is whether it is more data-efficient to learn the PtO map end-to-end or first learn the solution operator and subsequently compute the observable from the full-field solution. A theoretical analysis of Bayesian nonparametric regression of linear functionals, which is of independent interest, suggests that the end-to-end approach can actually have worse sample complexity. Extending beyond the theory, numerical results for the FNM approximation of three nonlinear PtO maps demonstrate the benefits of the operator learning perspective that this paper adopts.

Generalized linear models (GLMs) form one of the most popular classes of models in statistics. The gamma variant is used, for instance, in actuarial science for the modelling of claim amounts in insurance. A flaw of GLMs is that they are not robust against outliers (i.e., against erroneous or extreme data points). A difference in trends in the bulk of the data and the outliers thus yields skewed inference and predictions. To address this problem, robust methods have been introduced. The most commonly applied robust method is frequentist and consists in an estimator which is derived from a modification of the derivative of the log-likelihood. We propose an alternative approach which is modelling-based and thus fundamentally different. It allows for an understanding and interpretation of the modelling, and it can be applied for both frequentist and Bayesian statistical analyses. The approach possesses appealing theoretical and empirical properties.