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Complex phenomena are generally modeled with sophisticated simulators that, depending on their accuracy, can be very demanding in terms of computational resources and simulation time. Their time-consuming nature, together with a typically…

In the dynamic and rapidly advancing battery field, alloy anode materials are a focal point due to their superior electrochemical performance. Traditional screening methods are inefficient and time-consuming. Our research introduces a…

Materials Science · Physics 2024-09-17 Xingyue Shi , Linming Zhou , Yuhui Huang , Yongjun Wu , Zijian Hong

This work presents a comparative study of optimization techniques for parameter identification in equivalent electrical models of lithium-ion batteries. The 2RC model is applied to a set of twelve batteries using four publicly available…

Optimization and Control · Mathematics 2025-12-03 Johan Sebastian Suarez Sepúlveda , Edgar Hernando Sepúlveda-Oviedo , Bruno Jammes , Corinne Alonso

Constructing first-principles models is usually a challenging and time-consuming task due to the complexity of the real-life processes. On the other hand, data-driven modeling, and in particular neural network models often suffer from…

Optimization and Control · Mathematics 2023-02-03 Ece S. Koksal , Erdal Aydin

Data-driven methods for battery lifetime prediction are attracting increasing attention for applications in which the degradation mechanisms are poorly understood and suitable training sets are available. However, while advanced machine…

Machine Learning · Computer Science 2021-12-21 Peter M. Attia , Kristen A. Severson , Jeremy D. Witmer

The semiconductors industry benefits greatly from the integration of Machine Learning (ML)-based techniques in Technology Computer-Aided Design (TCAD) methods. The performance of ML models however relies heavily on the quality and quantity…

Machine Learning · Computer Science 2023-09-06 Zeheng Wang , Liang Li , Ross C. C. Leon , Jinlin Yang , Junjie Shi , Timothy van der Laan , Muhammad Usman

Additive manufacturing has become one of the forefront technologies in fabrication, enabling new products impossible to manufacture before. Although many materials exist for additive manufacturing, they typically suffer from performance…

Discovering novel materials with desired properties is essential for driving innovation. Industry 4.0 and smart manufacturing have promised transformative advances in this area through real-time data integration and automated production…

Machine Learning · Computer Science 2025-04-08 Avijit Saha Asru , Hamed Khosravi , Imtiaz Ahmed , Abdullahil Azeem

Data-driven inverse optimization for mixed-integer linear programs (MILPs), which seeks to learn an objective function and constraints consistent with observed decisions, is important for building accurate mathematical models in a variety…

Optimization and Control · Mathematics 2026-02-17 Akira Kitaoka

In order to achieve state-of-the-art performance, modern machine learning techniques require careful data pre-processing and hyperparameter tuning. Moreover, given the ever increasing number of machine learning models being developed, model…

Machine Learning · Statistics 2018-05-03 Nicolo Fusi , Rishit Sheth , Huseyn Melih Elibol

Neuromorphic computing hardware enables edge computing and can be implemented in flexible electronics for novel applications. Metal oxide materials are promising candidates for fabricating flexible neuromorphic electronics, but suffer from…

Emerging Technologies · Computer Science 2026-04-08 Benius Dunn , Javier Meza-Arroyo , Armi Tiihonen , Mark Lee , Julia W. P. Hsu

Lithium-ion batteries are ubiquitous in modern day applications ranging from portable electronics to electric vehicles. Irrespective of the application, reliable real-time estimation of battery state of health (SOH) by on-board computers is…

Machine Learning · Computer Science 2021-02-02 Darius Roman , Saurabh Saxena , Valentin Robu , Michael Pecht , David Flynn

In this paper, we present our vision of differentiable ML pipelines called DiffML to automate the construction of ML pipelines in an end-to-end fashion. The idea is that DiffML allows to jointly train not just the ML model itself but also…

Databases · Computer Science 2022-07-06 Benjamin Hilprecht , Christian Hammacher , Eduardo Reis , Mohamed Abdelaal , Carsten Binnig

Numerical simulations have revolutionized the industrial design process by reducing prototyping costs, design iterations, and enabling product engineers to explore the design space more efficiently. However, the growing scale of simulations…

Lithium-ion batteries are playing a key role in the sustainable energy transition. To fully exploit the potential of this technology, a variety of modeling, estimation, and prediction problems need to be addressed to enhance its design and…

Systems and Control · Electrical Eng. & Systems 2023-05-09 Gabriele Pozzato , Simona Onori

Designing reliable integrated energy systems for industrial processes requires optimization and verification models across multiple fidelities, from architecture-level sizing to high-fidelity dynamic operation. However, model mismatch…

Machine Learning · Computer Science 2026-04-03 Oluwamayowa O. Amusat , Luka Grbcic , Remi Patureau , M. Jibran S. Zuberi , Dan Gunter , Michael Wetter

Dynamical analysis of manufacturing and natural systems provides critical information about production of manufactured and natural resources respectively, thus playing an important role in assessing sustainability of these systems. However,…

Systems and Control · Electrical Eng. & Systems 2021-10-19 William Farlessyost , Shweta Singh

Biomass-derived hard carbon has become the most promising anode material for sodium-ion batteries (SIBs) due to its high capacity and excellent cycling stability. However, the effects of synthesis parameters and structural features on hard…

Chemical Physics · Physics 2025-10-16 Gang Chen , Zihan Yang , Peng Sun , Chenglong Wang , Jinliang Li , Guang Yang , Likun Pan

The rapidly growing use of lithium-ion batteries across various industries highlights the pressing issue of optimal charging control, as charging plays a crucial role in the health, safety and life of batteries. The literature increasingly…

Systems and Control · Electrical Eng. & Systems 2020-04-30 Ning Tian , Huazhen Fang , Yebin Wang

We present a response-augmented machine learning (ML) approach to the energetics of electrified metal surfaces. We leverage local descriptors to learn the work function as the first-order energy change to introduced bias charges and…

Materials Science · Physics 2025-05-27 Nicolas Bergmann , Nicéphore Bonnet , Nicola Marzari , Karsten Reuter , Nicolas G. Hörmann
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