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Multiscale modeling of complex systems is crucial for understanding their intricacies. Data-driven multiscale modeling has emerged as a promising approach to tackle challenges associated with complex systems. On the other hand, self-similarity is prevalent in complex systems, hinting that large-scale complex systems can be modeled at a reduced cost. In this paper, we introduce a multiscale neural network framework that incorporates self-similarity as prior knowledge, facilitating the modeling of self-similar dynamical systems. For deterministic dynamics, our framework can discern whether the dynamics are self-similar. For uncertain dynamics, it can compare and determine which parameter set is closer to self-similarity. The framework allows us to extract scale-invariant kernels from the dynamics for modeling at any scale. Moreover, our method can identify the power law exponents in self-similar systems. Preliminary tests on the Ising model yielded critical exponents consistent with theoretical expectations, providing valuable insights for addressing critical phase transitions in non-equilibrium systems.

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ACM/IEEE第23屆模型驅動工程語言和系統國際會議,是模型驅動軟件和系統工程的首要會議系列,由ACM-SIGSOFT和IEEE-TCSE支持組織。自1998年以來,模型涵蓋了建模的各個方面,從語言和方法到工具和應用程序。模特的參加者來自不同的背景,包括研究人員、學者、工程師和工業專業人士。MODELS 2019是一個論壇,參與者可以圍繞建模和模型驅動的軟件和系統交流前沿研究成果和創新實踐經驗。今年的版本將為建模社區提供進一步推進建模基礎的機會,并在網絡物理系統、嵌入式系統、社會技術系統、云計算、大數據、機器學習、安全、開源等新興領域提出建模的創新應用以及可持續性。 官網鏈接: · 優化器 · 線性的 · · 評論員 ·
2023 年 11 月 27 日

The ultimate goal of any numerical scheme for partial differential equations (PDEs) is to compute an approximation of user-prescribed accuracy at quasi-minimal computational time. To this end, algorithmically, the standard adaptive finite element method (AFEM) integrates an inexact solver and nested iterations with discerning stopping criteria balancing the different error components. The analysis ensuring optimal convergence order of AFEM with respect to the overall computational cost critically hinges on the concept of R-linear convergence of a suitable quasi-error quantity. This work tackles several shortcomings of previous approaches by introducing a new proof strategy. First, the algorithm requires several fine-tuned parameters in order to make the underlying analysis work. A redesign of the standard line of reasoning and the introduction of a summability criterion for R-linear convergence allows us to remove restrictions on those parameters. Second, the usual assumption of a (quasi-)Pythagorean identity is replaced by the generalized notion of quasi-orthogonality from [Feischl, Math. Comp., 91 (2022)]. Importantly, this paves the way towards extending the analysis to general inf-sup stable problems beyond the energy minimization setting. Numerical experiments investigate the choice of the adaptivity parameters.

We construct an efficient class of increasingly high-order (up to 17th-order) essentially non-oscillatory schemes with multi-resolution (ENO-MR) for solving hyperbolic conservation laws. The candidate stencils for constructing ENO-MR schemes range from first-order one-point stencil increasingly up to the designed very high-order stencil. The proposed ENO-MR schemes adopt a very simple and efficient strategy that only requires the computation of the highest-order derivatives of a part of candidate stencils. Besides simplicity and high efficiency, ENO-MR schemes are completely parameter-free and essentially scale-invariant. Theoretical analysis and numerical computations show that ENO-MR schemes achieve designed high-order convergence in smooth regions which may contain high-order critical points (local extrema) and retain ENO property for strong shocks. In addition, ENO-MR schemes could capture complex flow structures very well.

In artificial-intelligence-aided signal processing, existing deep learning models often exhibit a black-box structure, and their validity and comprehensibility remain elusive. The integration of topological methods, despite its relatively nascent application, serves a dual purpose of making models more interpretable as well as extracting structural information from time-dependent data for smarter learning. Here, we provide a transparent and broadly applicable methodology, TopCap, to capture the most salient topological features inherent in time series for machine learning. Rooted in high-dimensional ambient spaces, TopCap is capable of capturing features rarely detected in datasets with low intrinsic dimensionality. Applying time-delay embedding and persistent homology, we obtain descriptors which encapsulate information such as the vibration of a time series, in terms of its variability of frequency, amplitude, and average line, demonstrated with simulated data. This information is then vectorised and fed into multiple machine learning algorithms such as k-nearest neighbours and support vector machine. Notably, in classifying voiced and voiceless consonants, TopCap achieves an accuracy exceeding 96% and is geared towards designing topological convolutional layers for deep learning of speech and audio signals.

We study the long time behavior of an underdamped mean-field Langevin (MFL) equation, and provide a general convergence as well as an exponential convergence rate result under different conditions. The results on the MFL equation can be applied to study the convergence of the Hamiltonian gradient descent algorithm for the overparametrized optimization. We then provide a numerical example of the algorithm to train a generative adversarial networks (GAN).

A system of coupled oscillators on an arbitrary graph is locally driven by the tendency to mutual synchronization between nearby oscillators, but can and often exhibit nonlinear behavior on the whole graph. Understanding such nonlinear behavior has been a key challenge in predicting whether all oscillators in such a system will eventually synchronize. In this paper, we demonstrate that, surprisingly, such nonlinear behavior of coupled oscillators can be effectively linearized in certain latent dynamic spaces. The key insight is that there is a small number of `latent dynamics filters', each with a specific association with synchronizing and non-synchronizing dynamics on subgraphs so that any observed dynamics on subgraphs can be approximated by a suitable linear combination of such elementary dynamic patterns. Taking an ensemble of subgraph-level predictions provides an interpretable predictor for whether the system on the whole graph reaches global synchronization. We propose algorithms based on supervised matrix factorization to learn such latent dynamics filters. We demonstrate that our method performs competitively in synchronization prediction tasks against baselines and black-box classification algorithms, despite its simple and interpretable architecture.

Neural operators have been explored as surrogate models for simulating physical systems to overcome the limitations of traditional partial differential equation (PDE) solvers. However, most existing operator learning methods assume that the data originate from a single physical mechanism, limiting their applicability and performance in more realistic scenarios. To this end, we propose Physical Invariant Attention Neural Operator (PIANO) to decipher and integrate the physical invariants (PI) for operator learning from the PDE series with various physical mechanisms. PIANO employs self-supervised learning to extract physical knowledge and attention mechanisms to integrate them into dynamic convolutional layers. Compared to existing techniques, PIANO can reduce the relative error by 13.6\%-82.2\% on PDE forecasting tasks across varying coefficients, forces, or boundary conditions. Additionally, varied downstream tasks reveal that the PI embeddings deciphered by PIANO align well with the underlying invariants in the PDE systems, verifying the physical significance of PIANO. The source code will be publicly available at: //github.com/optray/PIANO.

The main reason for query model's prominence in complexity theory and quantum computing is the presence of concrete lower bounding techniques: polynomial and adversary method. There have been considerable efforts to give lower bounds using these methods, and to compare/relate them with other measures based on the decision tree. We explore the value of these lower bounds on quantum query complexity and their relation with other decision tree based complexity measures for the class of symmetric functions, arguably one of the most natural and basic sets of Boolean functions. We show an explicit construction for the dual of the positive adversary method and also of the square root of private coin certificate game complexity for any total symmetric function. This shows that the two values can't be distinguished for any symmetric function. Additionally, we show that the recently introduced measure of spectral sensitivity gives the same value as both positive adversary and approximate degree for every total symmetric Boolean function. Further, we look at the quantum query complexity of Gap Majority, a partial symmetric function. It has gained importance recently in regard to understanding the composition of randomized query complexity. We characterize the quantum query complexity of Gap Majority and show a lower bound on noisy randomized query complexity (Ben-David and Blais, FOCS 2020) in terms of quantum query complexity. Finally, we study how large certificate complexity and block sensitivity can be as compared to sensitivity for symmetric functions (even up to constant factors). We show tight separations, i.e., give upper bounds on possible separations and construct functions achieving the same.

We address the communication overhead of distributed sparse matrix-(multiple)-vector multiplication in the context of large-scale eigensolvers, using filter diagonalization as an example. The basis of our study is a performance model which includes a communication metric that is computed directly from the matrix sparsity pattern without running any code. The performance model quantifies to which extent scalability and parallel efficiency are lost due to communication overhead. To restore scalability, we identify two orthogonal layers of parallelism in the filter diagonalization technique. In the horizontal layer the rows of the sparse matrix are distributed across individual processes. In the vertical layer bundles of multiple vectors are distributed across separate process groups. An analysis in terms of the communication metric predicts that scalability can be restored if, and only if, one implements the two orthogonal layers of parallelism via different distributed vector layouts. Our theoretical analysis is corroborated by benchmarks for application matrices from quantum and solid state physics, road networks, and nonlinear programming. We finally demonstrate the benefits of using orthogonal layers of parallelism with two exemplary application cases -- an exciton and a strongly correlated electron system -- which incur either small or large communication overhead.

Most state-of-the-art machine learning techniques revolve around the optimisation of loss functions. Defining appropriate loss functions is therefore critical to successfully solving problems in this field. We present a survey of the most commonly used loss functions for a wide range of different applications, divided into classification, regression, ranking, sample generation and energy based modelling. Overall, we introduce 33 different loss functions and we organise them into an intuitive taxonomy. Each loss function is given a theoretical backing and we describe where it is best used. This survey aims to provide a reference of the most essential loss functions for both beginner and advanced machine learning practitioners.

In large-scale systems there are fundamental challenges when centralised techniques are used for task allocation. The number of interactions is limited by resource constraints such as on computation, storage, and network communication. We can increase scalability by implementing the system as a distributed task-allocation system, sharing tasks across many agents. However, this also increases the resource cost of communications and synchronisation, and is difficult to scale. In this paper we present four algorithms to solve these problems. The combination of these algorithms enable each agent to improve their task allocation strategy through reinforcement learning, while changing how much they explore the system in response to how optimal they believe their current strategy is, given their past experience. We focus on distributed agent systems where the agents' behaviours are constrained by resource usage limits, limiting agents to local rather than system-wide knowledge. We evaluate these algorithms in a simulated environment where agents are given a task composed of multiple subtasks that must be allocated to other agents with differing capabilities, to then carry out those tasks. We also simulate real-life system effects such as networking instability. Our solution is shown to solve the task allocation problem to 6.7% of the theoretical optimal within the system configurations considered. It provides 5x better performance recovery over no-knowledge retention approaches when system connectivity is impacted, and is tested against systems up to 100 agents with less than a 9% impact on the algorithms' performance.

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