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Data-Driven Computing Methods for Nonlinear Physics Systems with Geometric Constraints

arXiv.org Artificial Intelligence

In a landscape where scientific discovery is increasingly driven by data, the integration of machine learning (ML) with traditional scientific methodologies has emerged as a transformative approach. This paper introduces a novel, data-driven framework that synergizes physics-based priors with advanced ML techniques to address the computational and practical limitations inherent in first-principle-based methods and brute-force machine learning methods. Our framework showcases four algorithms, each embedding a specific physics-based prior tailored to a particular class of nonlinear systems, including separable and nonseparable Hamiltonian systems, hyperbolic partial differential equations, and incompressible fluid dynamics. The intrinsic incorporation of physical laws preserves the system's intrinsic symmetries and conservation laws, ensuring solutions are physically plausible and computationally efficient. The integration of these priors also enhances the expressive power of neural networks, enabling them to capture complex patterns typical in physical phenomena that conventional methods often miss. As a result, our models outperform existing data-driven techniques in terms of prediction accuracy, robustness, and predictive capability, particularly in recognizing features absent from the training set, despite relying on small datasets, short training periods, and small sample sizes.


Prediction of Unobserved Bifurcation by Unsupervised Extraction of Slowly Time-Varying System Parameter Dynamics from Time Series Using Reservoir Computing

arXiv.org Machine Learning

Nonlinear and non-stationary processes are prevalent in various natural and physical phenomena, where system dynamics can change qualitatively due to bifurcation phenomena. Traditional machine learning methods have advanced our ability to learn and predict such systems from observed time series data. However, predicting the behavior of systems with temporal parameter variations without knowledge of true parameter values remains a significant challenge. This study leverages the reservoir computing framework to address this problem by unsupervised extraction of slowly varying system parameters from time series data. We propose a model architecture consisting of a slow reservoir with long timescale internal dynamics and a fast reservoir with short timescale dynamics. The slow reservoir extracts the temporal variation of system parameters, which are then used to predict unknown bifurcations in the fast dynamics. Through experiments using data generated from chaotic dynamical systems, we demonstrate the ability to predict bifurcations not present in the training data. Our approach shows potential for applications in fields such as neuroscience, material science, and weather prediction, where slow dynamics influencing qualitative changes are often unobservable.


Probabilistic Emulation of a Global Climate Model with Spherical DYffusion

arXiv.org Machine Learning

Data-driven deep learning models are on the verge of transforming global weather forecasting. It is an open question if this success can extend to climate modeling, where long inference rollouts and data complexity pose significant challenges. Here, we present the first conditional generative model able to produce global climate ensemble simulations that are accurate and physically consistent. Our model runs at 6-hourly time steps and is shown to be stable for 10-year-long simulations. Our approach beats relevant baselines and nearly reaches a gold standard for successful climate model emulation. We discuss the key design choices behind our dynamics-informed diffusion model-based approach which enables this significant step towards efficient, data-driven climate simulations that can help us better understand the Earth and adapt to a changing climate.


AI Driven Laser Parameter Search: Inverse Design of Photonic Surfaces using Greedy Surrogate-based Optimization

arXiv.org Artificial Intelligence

Photonic surfaces designed with specific optical characteristics are becoming increasingly important for use in in various energy harvesting and storage systems. , In this study, we develop a surrogate-based optimization approach for designing such surfaces. The surrogate-based optimization framework employs the Random Forest algorithm and uses a greedy, prediction-based exploration strategy to identify the laser fabrication parameters that minimize the discrepancy relative to a user-defined target optical characteristics. We demonstrate the approach on two synthetic benchmarks and two specific cases of photonic surface inverse design targets. It exhibits superior performance when compared to other optimization algorithms across all benchmarks. Additionally, we demonstrate a technique of inverse design warm starting for changed target optical characteristics which enhances the performance of the introduced approach.


Decoupled Subgraph Federated Learning

arXiv.org Artificial Intelligence

We address the challenge of federated learning on graph-structured data distributed across multiple clients. Specifically, we focus on the prevalent scenario of interconnected subgraphs, where interconnections between different clients play a critical role. We present a novel framework for this scenario, named FedStruct, that harnesses deep structural dependencies. To uphold privacy, unlike existing methods, FedStruct eliminates the necessity of sharing or generating sensitive node features or embeddings among clients. Instead, it leverages explicit global graph structure information to capture inter-node dependencies. We validate the effectiveness of FedStruct through experimental results conducted on six datasets for semi-supervised node classification, showcasing performance close to the centralized approach across various scenarios, including different data partitioning methods, varying levels of label availability, and number of clients.


Automated architectural space layout planning using a physics-inspired generative design framework

arXiv.org Artificial Intelligence

During this stage, the foundational spatial arrangement is conceptualised, setting the stage for subsequent spatial interactions and functional efficacy. Typically, architects initiate the space layout design by creating rough sketches or diagrams to delineate the positions and interrelationships of distinct functional areas, subsequently refining these into multiple design solutions. The meticulous planning of space layout, which outlines the internal spaces' form, size, and circulation patterns, directly influences the building's operational performance and economic outlay [1, 2]. Layout planning is recognised as a wicked problem due to its inherent complexity and variability [3]. This complexity tends to escalate, presenting a compounded challenge for human designers as the scale and intricacies of the project increase. Computational design and design automation techniques have been utilised extensively within the realm of architecture, offering significant time savings by streamlining repetitive tasks and thereby enhancing designer productivity [4-7]. This efficiency has paved the way for these technologies to be integrated more deeply into architectural practices. Consequently, it is a natural progression to employ these automated techniques to assist designers in the repetitive or complex task of space layout planning in architecture. In recent years, generative design and automated generation of floorplans and space layout has garnered considerable interest, indicating a potential paradigm shift in design methodologies.


Resource Optimization for Tail-Based Control in Wireless Networked Control Systems

arXiv.org Artificial Intelligence

Achieving control stability is one of the key design challenges of scalable Wireless Networked Control Systems (WNCS) under limited communication and computing resources. This paper explores the use of an alternative control concept defined as tail-based control, which extends the classical Linear Quadratic Regulator (LQR) cost function for multiple dynamic control systems over a shared wireless network. We cast the control of multiple control systems as a network-wide optimization problem and decouple it in terms of sensor scheduling, plant state prediction, and control policies. Toward this, we propose a solution consisting of a scheduling algorithm based on Lyapunov optimization for sensing, a mechanism based on Gaussian Process Regression (GPR) for state prediction and uncertainty estimation, and a control policy based on Reinforcement Learning (RL) to ensure tail-based control stability. A set of discrete time-invariant mountain car control systems is used to evaluate the proposed solution and is compared against four variants that use state-of-the-art scheduling, prediction, and control methods. The experimental results indicate that the proposed method yields 22% reduction in overall cost in terms of communication and control resource utilization compared to state-of-the-art methods.


Active Diffusion Subsampling

arXiv.org Artificial Intelligence

Subsampling is commonly used to mitigate costs associated with data acquisition, such as time or energy requirements, motivating the development of algorithms for estimating the fully-sampled signal of interest $x$ from partially observed measurements $y$. In maximum-entropy sampling, one selects measurement locations that are expected to have the highest entropy, so as to minimize uncertainty about $x$. This approach relies on an accurate model of the posterior distribution over future measurements, given the measurements observed so far. Recently, diffusion models have been shown to produce high-quality posterior samples of high-dimensional signals using guided diffusion. In this work, we propose Active Diffusion Subsampling (ADS), a method for performing active subsampling using guided diffusion in which the model tracks a distribution of beliefs over the true state of $x$ throughout the reverse diffusion process, progressively decreasing its uncertainty by choosing to acquire measurements with maximum expected entropy, and ultimately generating the posterior distribution $p(x | y)$. ADS can be applied using pre-trained diffusion models for any subsampling rate, and does not require task-specific retraining - just the specification of a measurement model. Furthermore, the maximum entropy sampling policy employed by ADS is interpretable, enhancing transparency relative to existing methods using black-box policies. Experimentally, we show that ADS outperforms fixed sampling strategies, and study an application of ADS in Magnetic Resonance Imaging acceleration using the fastMRI dataset, finding that ADS performs competitively with supervised methods. Code available at https://active-diffusion-subsampling.github.io/.


Semi-Autonomous Mobile Search and Rescue Robot for Radiation Disaster Scenarios

arXiv.org Artificial Intelligence

This paper describes a novel semi-autonomous mobile robot system designed to assist search and rescue (SAR) first responders in disaster scenarios. While robots offer significant potential in SAR missions, current solutions are limited in their ability to handle a diverse range of tasks. This gap is addressed by presenting a system capable of (1) autonomous navigation and mapping, allowing the robot to autonomously explore and map areas affected by catastrophic events, (2) radiation mapping, enabling the system to triangulate a radiation map from discrete radiation measurements to aid in identifying hazardous areas, (3) semi-autonomous substance sampling, allowing the robot to collect samples of suspicious substances and analyze them onboard with immediate classification, and (4) valve manipulation, enabling teleoperated closing of valves that control hazardous material flow. This semi-autonomous approach balances human control over critical tasks like substance sampling with efficient robot navigation in low-risk areas. The system is evaluated during three trials that simulate possible disaster scenarios, two of which have been recorded during the European Robotics Hackathon (EnRicH). Furthermore, we provide recorded sensor data as well as the implemented software system as supplemental material through a GitHub repository: https://github.com/TW-Robotics/search-and-rescue-robot-IROS2024.


One Fling to Goal: Environment-aware Dynamics for Goal-conditioned Fabric Flinging

arXiv.org Artificial Intelligence

Fabric manipulation dynamically is commonly seen in manufacturing and domestic settings. While dynamically manipulating a fabric piece to reach a target state is highly efficient, this task presents considerable challenges due to the varying properties of different fabrics, complex dynamics when interacting with environments, and meeting required goal conditions. To address these challenges, we present \textit{One Fling to Goal}, an algorithm capable of handling fabric pieces with diverse shapes and physical properties across various scenarios. Our method learns a graph-based dynamics model equipped with environmental awareness. With this dynamics model, we devise a real-time controller to enable high-speed fabric manipulation in one attempt, requiring less than 3 seconds to finish the goal-conditioned task. We experimentally validate our method on a goal-conditioned manipulation task in five diverse scenarios. Our method significantly improves this goal-conditioned task, achieving an average error of 13.2mm in complex scenarios. Our method can be seamlessly transferred to real-world robotic systems and generalized to unseen scenarios in a zero-shot manner.