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Machine learning (ML) can facilitate efficient thermoelectric (TE) material discovery essential to address the environmental crisis. However, ML models often suffer from poor experimental generalizability despite high metrics. This study…

Materials Science · Physics 2026-02-03 Shoeb Athar , Adrien Mecibah , Philippe Jund

The optimization of the electrode manufacturing process is important for upscaling the application of Lithium Ion Batteries (LIBs) to cater for growing energy demand. In particular, LIB manufacturing is very important to be optimized…

Machine Learning · Computer Science 2023-07-13 Marc Duquesnoy , Chaoyue Liu , Vishank Kumar , Elixabete Ayerbe , Alejandro A. Franco

The hydro-mechanical behavior of clay-sulfate rocks, especially their swelling properties, poses significant challenges in geotechnical engineering. This study presents a hybrid constrained machine learning (ML) model developed using the…

With the advent of powerful computer simulation techniques, it is time to move from the widely used knowledge-guided empirical methods to approaches driven by data science, mainly machine learning algorithms. We investigated the predictive…

Dry reforming of methane (DRM) over platinum catalysts offers a promising route for CO2 utilization and syngas (H2/CO) production, a versatile feedstock for synthetic fuels. This study employs automated chemical kinetic model generation to…

Computational Physics · Physics 2025-08-05 Esther Ritov , Alon Grinberg Dana

Wind energy significantly contributes to the global shift towards renewable energy, yet operational challenges, such as Leading-Edge Erosion on wind turbine blades, notably reduce energy output. This study introduces an advanced, scalable…

Systems and Control · Electrical Eng. & Systems 2025-06-17 Emil Marcus Buchberg , Kent Vugs Nielsen

The robotic systems continuously interact with complex dynamical systems in the physical world. Reliable predictions of spatiotemporal evolution of these dynamical systems, with limited knowledge of system dynamics, are crucial for…

Artificial Intelligence · Computer Science 2019-01-08 Yun Long , Xueyuan She , Saibal Mukhopadhyay

The functionality of catalysts, enzymes, and supramolecular assemblies emerges not from individual molecules alone, but from the subtle interplay between multiple components arranged in complex systems. Designing such systems is a grand…

Computational Physics · Physics 2026-04-15 Rhyan Barrett , Robin Curth , Julia Westermayr

A well-known approach to describe the dynamics of an open quantum system is to compute the master equation evolving the reduced density matrix of the system. This approach plays an important role in describing excitation transfer through…

Quantum Physics · Physics 2022-10-25 Kimara Naicker , Ilya Sinayskiy , Francesco Petruccione

Hydrogen plays an important role in the context of global carbon reduction. For an off-grid renewable power to hydrogen system (OReP2HS), a grid-forming (GFM) source is essential to provide frequency and voltage references. Here, we take…

Systems and Control · Electrical Eng. & Systems 2024-01-08 Jie Zhu

Accurate power consumption prediction is crucial for improving efficiency and reducing environmental impact, yet traditional methods relying on specialized instruments or rigid physical models are impractical for large-scale, real-world…

Machine Learning · Computer Science 2025-08-12 Roksana Yahyaabadi , Ghazal Farhani , Taufiq Rahman , Soodeh Nikan , Abdullah Jirjees , Fadi Araji

The sustainable utilization of lithium-ion batteries (LIBs) is crucial to the global energy transition and carbon neutrality, yet data scarcity and heterogeneity remain major barriers across remanufacturing, reusing, and recycling. This…

Machine Learning · Computer Science 2025-09-29 Shengyu Tao

Due the alarming rate of climate change, the implementation of efficient CO$_2$ capture has become crucial. This project aims to create an algorithm that predicts the uptake of CO$_2$ adsorbing Metal-Organic Frameworks (MOFs) by using…

Machine Learning · Computer Science 2021-10-13 Mahati Manda

This paper presents an experimental investigation and performance evaluation of a hybrid electric radio-controlled car powered by a Nickel-Metal Hydride battery combined with a renewable Proton Exchange Membrane Fuel Cell system. The study…

Signal Processing · Electrical Eng. & Systems 2025-10-22 Amirhesam Aghanouri , Mohamed Sabry , Joshua Cherian Varughese , Cristina Olaverri-Monreal

Most existing criteria derived from progenitor properties of core-collapse supernovae are not very accurate in predicting explosion outcomes. We present a novel look at identifying the explosion outcome of core-collapse supernovae using a…

Solar and Stellar Astrophysics · Physics 2022-09-28 Benny T. -H. Tsang , David Vartanyan , Adam Burrows

The rising energy footprint of artificial intelligence has become a measurable component of US data center emissions, yet cybersecurity research seldom considers its environmental cost. This study introduces an eco aware anomaly detection…

Hydrogen electrocatalysis (HER/HOR) exhibits an anomalous, non-Nernstian pH dependence that has motivated competing mechanistic narratives yet still lacks a unified, transferable, and quantitatively predictive description across conditions.…

High Energy Physics - Experiment · Physics 2026-02-06 Bishuang Chen , Huayang Cai

Integrating external heat into electrolysers can reduce the electrical power demand for carbon-neutral hydrogen production. Efficient operation requires detailed models that incorporate heat availability and its effect on startup costs.…

Chemical Physics · Physics 2025-07-11 Matthias Derez , Alexander Hoogsteyn , Erik Delarue

We use a unique combination of electrochemical techniques to elucidate the dependency of hydrogen evolution reaction (HER) and absorption on pH and overpotential for iron and nickel. Impedance spectroscopy shows the dominance of the…

Chemical Physics · Physics 2024-03-07 L. Cupertino-Malheiros , M. Duportal , T. Hageman , E. Martínez-Pañeda

Water is a life-giving source, fundamental to human existence, yet, over a billion people lack access to clean drinking water. Present techniques for water treatment such as piped, treated water rely on time and resource intensive…

Chemical Physics · Physics 2016-07-26 Venkatasubramanian Viswanathan , Heine A. Hansen , Jens K. Nørskov
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