This study explores the crucial interplay between aggregators and building occupants in activating flexibility through Demand Response (DR) programs, with a keen focus on achieving robust decarbonization and fortifying the resilience of the energy system amidst the uncertainties presented by Renewable Energy Sources (RES). Firstly, it introduces a methodology of optimizing aggregated flexibility provision strategies in environments with limited data, utilizing Discrete Fourier Transformation (DFT) and clustering techniques to identify building occupant's activity patterns. Secondly, the study assesses the disaggregated flexibility provision of Heating Ventilation and Air Conditioning (HVAC) systems during DR events, employing machine learning and optimization techniques for precise, device-level analysis. The first approach offers a non-intrusive pathway for aggregators to provide flexibility services in environments of a single smart meter for the whole building's consumption, while the second approach carefully considers building occupants' thermal comfort profiles, while maximizing flexibility in case of existence of dedicated smart meters to the HVAC systems. Through the application of data-driven techniques and encompassing case studies from both industrial and residential buildings, this paper not only unveils pivotal opportunities for aggregators in the balancing and emerging flexibility markets but also successfully develops end-to-end practical tools for aggregators. Furthermore, the efficacy of this tool is validated through detailed case studies, substantiating its operational capability and contributing to the evolution of a resilient and efficient energy system.

The past decade has seen tremendous breakthroughs in computation and there is no indication that this will slow any time soon. Machine learning, large-scale computing resources, and increased industry focus have resulted in rising investments in computer-driven solutions for data management, simulations, and model generation. However, with this growth in computation has come an even larger expansion of data and with it, complexity in data storage, sharing, and tracking. In this work, we introduce ZnTrack, a Python-driven data versioning tool. ZnTrack builds upon established version control systems to provide a user-friendly and easy-to-use interface for tracking parameters in experiments, designing workflows, and storing and sharing data. From this ability to reduce large datasets to a simple Python script emerges the concept of Data as Code, a core component of the work presented here and an undoubtedly important concept as the age of computation continues to evolve. ZnTrack offers an open-source, FAIR data compatible Python package to enable users to harness these concepts of the future.

While colonization has sociohistorically impacted people's identities across various dimensions, those colonial values and biases continue to be perpetuated by sociotechnical systems. One category of sociotechnical systems--sentiment analysis tools--can also perpetuate colonial values and bias, yet less attention has been paid to how such tools may be complicit in perpetuating coloniality, although they are often used to guide various practices (e.g., content moderation). In this paper, we explore potential bias in sentiment analysis tools in the context of Bengali communities that have experienced and continue to experience the impacts of colonialism. Drawing on identity categories most impacted by colonialism amongst local Bengali communities, we focused our analytic attention on gender, religion, and nationality. We conducted an algorithmic audit of all sentiment analysis tools for Bengali, available on the Python package index (PyPI) and GitHub. Despite similar semantic content and structure, our analyses showed that in addition to inconsistencies in output from different tools, Bengali sentiment analysis tools exhibit bias between different identity categories and respond differently to different ways of identity expression. Connecting our findings with colonially shaped sociocultural structures of Bengali communities, we discuss the implications of downstream bias of sentiment analysis tools.

Lambert's problem concerns with transferring a spacecraft from a given initial to a given terminal position within prescribed flight time via velocity control subject to a gravitational force field. We consider a probabilistic variant of the Lambert problem where the knowledge of the endpoint constraints in position vectors are replaced by the knowledge of their respective joint probability density functions. We show that the Lambert problem with endpoint joint probability density constraints is a generalized optimal mass transport (OMT) problem, thereby connecting this classical astrodynamics problem with a burgeoning area of research in modern stochastic control and stochastic machine learning. This newfound connection allows us to rigorously establish the existence and uniqueness of solution for the probabilistic Lambert problem. The same connection also helps to numerically solve the probabilistic Lambert problem via diffusion regularization, i.e., by leveraging further connection of the OMT with the Schr\"odinger bridge problem (SBP). This also shows that the probabilistic Lambert problem with additive dynamic process noise is in fact a generalized SBP, and can be solved numerically using the so-called Schr\"odinger factors, as we do in this work. We explain how the resulting analysis leads to solving a boundary-coupled system of reaction-diffusion PDEs where the nonlinear gravitational potential appears as the reaction rate. We propose novel algorithms for the same, and present illustrative numerical results. Our analysis and the algorithmic framework are nonparametric, i.e., we make neither statistical (e.g., Gaussian, first few moments, mixture or exponential family, finite dimensionality of the sufficient statistic) nor dynamical (e.g., Taylor series) approximations.

Computational efficiency and adversarial robustness are critical factors in real-world engineering applications. Yet, conventional neural networks often fall short in addressing both simultaneously, or even separately. Drawing insights from natural physical systems and existing literature, it is known that an input convex architecture enhances computational efficiency, while a Lipschitz-constrained architecture bolsters adversarial robustness. By leveraging the strengths of convexity and Lipschitz continuity, we develop a novel network architecture, termed Input Convex Lipschitz Recurrent Neural Networks. This model outperforms existing recurrent units across a spectrum of engineering tasks in terms of computational efficiency and adversarial robustness. These tasks encompass a benchmark MNIST image classification, real-world solar irradiance prediction for Solar PV system planning at LHT Holdings in Singapore, and real-time Model Predictive Control optimization for a chemical reactor.

The carbon footprint associated with large language models (LLMs) is a significant concern, encompassing emissions from their training, inference, experimentation, and storage processes, including operational and embodied carbon emissions. An essential aspect is accurately estimating the carbon impact of emerging LLMs even before their training, which heavily relies on GPU usage. Existing studies have reported the carbon footprint of LLM training, but only one tool, mlco2, can predict the carbon footprint of new neural networks prior to physical training. However, mlco2 has several serious limitations. It cannot extend its estimation to dense or mixture-of-experts (MoE) LLMs, disregards critical architectural parameters, focuses solely on GPUs, and cannot model embodied carbon footprints. Addressing these gaps, we introduce LLMCarbon, an end-to-end carbon footprint projection model designed for both dense and MoE LLMs. Compared to mlco2, LLMCarbon significantly enhances the accuracy of carbon footprint estimations for various LLMs. Large language models (LLMs) have established their supremacy in addressing a wide spectrum of natural language processing tasks (Brown et al., 2020). However, the proliferation of these models, coupled with increasingly expansive datasets (Sanderson, 2023; Anil et al., 2023), has woven LLM inferences into the fabric of everyday life (Campello de Souza et al., 2023).

Energy consumption of memory accesses dominates the compute energy in energy-constrained robots which require a compact 3D map of the environment to achieve autonomy. Recent mapping frameworks only focused on reducing the map size while incurring significant memory usage during map construction due to multi-pass processing of each depth image. In this work, we present a memory-efficient continuous occupancy map, named GMMap, that accurately models the 3D environment using a Gaussian Mixture Model (GMM). Memory-efficient GMMap construction is enabled by the single-pass compression of depth images into local GMMs which are directly fused together into a globally-consistent map. By extending Gaussian Mixture Regression to model unexplored regions, occupancy probability is directly computed from Gaussians. Using a low-power ARM Cortex A57 CPU, GMMap can be constructed in real-time at up to 60 images per second. Compared with prior works, GMMap maintains high accuracy while reducing the map size by at least 56%, memory overhead by at least 88%, DRAM access by at least 78%, and energy consumption by at least 69%. Thus, GMMap enables real-time 3D mapping on energy-constrained robots.

We present Neural Spectral Methods, a technique to solve parametric Partial Differential Equations (PDEs), grounded in classical spectral methods. Our method uses orthogonal bases to learn PDE solutions as mappings between spectral coefficients. In contrast to current machine learning approaches which enforce PDE constraints by minimizing the numerical quadrature of the residuals in the spatiotemporal domain, we leverage Parseval's identity and introduce a new training strategy through a spectral loss. Our spectral loss enables more efficient differentiation through the neural network, and substantially reduces training complexity. At inference time, the computational cost of our method remains constant, regardless of the spatiotemporal resolution of the domain. Our experimental results demonstrate that our method significantly outperforms previous machine learning approaches in terms of speed and accuracy by one to two orders of magnitude on multiple different problems, including reaction-diffusion systems, and forced and unforced Navier-Stokes equations. When compared to numerical solvers of the same accuracy, our method demonstrates a 10 increase in performance speed. Partial differential equations (PDEs) are fundamental for describing complex systems like turbulent flow (Temam, 2001), diffusive processes (Friedman, 2008), and thermodynamics (Van Kampen, 1992). Due to their complexity, these systems frequently lack closed-form analytical solutions, prompting the use of numerical methods. These numerical techniques discretize the spatiotemporal domain of interest and solve a set of discrete equations to approximate the system's behavior. Spectral methods are one such class of numerical techniques, and are widely recognized for their effectiveness (Boyd, 2001; Gottlieb & Orszag, 1977).

This chapter is a preprint from our book by , focusing on leveraging machine learning (ML) in chemical and polyolefin manufacturing optimization. It's crafted for both novices and seasoned professionals keen on the latest ML applications in chemical processes. We trace the evolution of AI and ML in chemical industries, delineate core ML components, and provide resources for ML beginners. A detailed discussion on various ML methods is presented, covering regression, classification, and unsupervised learning techniques, with performance metrics and examples. Ensemble methods, deep learning networks, including MLP, DNNs, RNNs, CNNs, and transformers, are explored for their growing role in chemical applications. Practical workshops guide readers through predictive modeling using advanced ML algorithms. The chapter culminates with insights into science-guided ML, advocating for a hybrid approach that enhances model accuracy. The extensive bibliography offers resources for further research and practical implementation. This chapter aims to be a thorough primer on ML's practical application in chemical engineering, particularly for polyolefin production, and sets the stage for continued learning in subsequent chapters. Please cite the original work [169,170] when referencing.

Recent models have achieved human level performance on the Stanford Question Answering Dataset when using F1 scores to evaluate the reading comprehension task. Yet, teaching machines to comprehend text has not been solved in the general case. By appending one adversarial sentence to the context paragraph, past research has shown that the F1 scores from reading comprehension models drop almost in half. In this paper, I replicate past adversarial research with a new model, ELECTRA-Small, and demonstrate that the new model's F1 score drops from 83.9% to 29.2%. To improve ELECTRA-Small's resistance to this attack, I finetune the model on SQuAD v1.1 training examples with one to five adversarial sentences appended to the context paragraph. Like past research, I find that the finetuned model on one adversarial sentence does not generalize well across evaluation datasets. However, when finetuned on four or five adversarial sentences the model attains an F1 score of more than 70% on most evaluation datasets with multiple appended and prepended adversarial sentences. The results suggest that with enough examples we can make models robust to adversarial attacks.