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Energy decomposition analysis (EDA) based on absolutely localized molecular orbitals provides detailed insights into intermolecular bonding by decomposing the total molecular binding energy into physically meaningful components. Here, we…

Chemical Physics · Physics 2025-09-25 Hossein Tahmasbi , Michael Beerbaum , Bartosz Brzoza , Attila Cangi , Thomas D. Kühne

We develop a mathematical model for dynamic simulation of an alkaline electrolyzer plant. The plant includes the stack, a water recirculation system and hydrogen storage with compressor. We model each component of the system with mass and…

Systems and Control · Electrical Eng. & Systems 2024-07-30 Nicola Cantisani , Josefine Dovits , John Bagterp Jørgensen

Predicting lithium-ion battery degradation is worth billions to the global automotive, aviation and energy storage industries, to improve performance and safety and reduce warranty liabilities. However, very few published models of battery…

The transition to the zero-carbon power system is underway accelerating recently. Hydrogen energy and electric vehicles (EVs) are promising solutions on the supply and demand sides. This paper presents a novel architecture that includes…

Systems and Control · Electrical Eng. & Systems 2021-03-24 Teng Long , Qing-Shan Jia

Grid-connected hybrid renewable power systems with energy storage can reduce the intermittency of renewable power supply. However, emerging energy storage technologies need improvement to compete with lithium-ion batteries and reduce the…

Systems and Control · Electrical Eng. & Systems 2023-11-29 Sleiman Farah , Gorm Bruun Andresen

Hydrogen is central to the global energy transition when produced at low emissions. This paper introduces a renewable hydrogen production system model (HPSM) that optimizes a hybrid hydrogen production system (HPS) on a worldwide 50x50 km…

Physics and Society · Physics 2023-12-13 Stephan Kigle , Tapio Schmidt-Achert , Miguel Ángel Martínez Pérez

This paper proposes a power system architecture and control for efficient and low-cost green hydrogen production. The proposed system integrates photovoltaic (PV) sources directly with an electrolyser stack, thereby eliminating the need for…

Systems and Control · Electrical Eng. & Systems 2024-07-16 Aymeric Fabre , Glen Farivar , Andre Chambers

Hydrogen electrolyzers, with their operational flexibility, can be configured as smart dynamic loads which can provide grid services and facilitate the integration of more renewable energy sources into the electrical grid. However, to…

Systems and Control · Electrical Eng. & Systems 2022-09-14 Bang L. H. Nguyen , Mayank Panwar , Rob Hovsapian , Kazunori Nagasawa , Tuyen V. Vu

In this paper, we aim to analyse the impact of hydrogen production decarbonisation and electrification scenarios on the infrastructure development, generation mix, $CO_{2}$ emissions, and system costs of the European power system,…

Optimization and Control · Mathematics 2023-12-12 Germán Morales-España , Ricardo Hernández-Serna , Diego A. Tejada-Arango , Marcel Weeda

Water electrolysis is promising for industrial hydrogen production to achieve a sustainable and green hydrogen economy, but the high cost of the technology limits its market share. Developing efficient yet economic electrocatalysts is…

The recent decrease in battery manufacturing costs stimulates the market participation of utility-scale battery energy storage systems (BESSs). However, battery degradation remains a major concern for BESS owners while determining their…

Systems and Control · Electrical Eng. & Systems 2021-06-28 Reza Khalilisenobari , Meng Wu

Hybrid Energy Systems (HES), amalgamating renewable sources, energy storage, and conventional generation, have emerged as a responsive resource for providing valuable grid services. Subsequently, modeling and analysis of HES has become…

Optimization and Control · Mathematics 2024-03-19 Tanmay Mishra , Amritanshu Pandey , Mads R. Almassalkhi

We present an electron tomography method that allows for the identification of hundreds of electrocatalyst nanoparticles with one-to-one correspondence before and after electrochemical aging. This method allows us to track, in…

Development of efficient and high-performing electrolytes is crucial for advancing energy storage technologies, particularly in batteries. Predicting the performance of battery electrolytes rely on complex interactions between the…

Machine Learning · Computer Science 2024-07-01 Indra Priyadarsini , Vidushi Sharma , Seiji Takeda , Akihiro Kishimoto , Lisa Hamada , Hajime Shinohara

Prognostics and Health Management is crucial for the reliability and lifetime assessment of Polymer Electrolyte Fuel Cells (PEFCs). Here, we review the current advances on this topic, focusing mainly on key degradation mechanisms and…

Systems and Control · Electrical Eng. & Systems 2025-11-17 Farideh Abdollahi , Kourosh Malek , Thomas Kadyk , Nadiia Kulyk , Christophe Gerling , Michael H. Eikerling

This paper proposes a new optimization model and solution method for determining optimal locations and sizing of renewable energy sources and hydrogen storage in a power network. We obtain these strategic decisions based on the multi-period…

Optimization and Control · Mathematics 2022-07-25 Sezen Ece Kayacık , Albert H. Schrotenboer , Evrim Ursavas , Iris F. A. Vis

Designing lithium-ion batteries for long service life remains a challenge, as most cells are optimized for beginning-of-life metrics such as energy density, often overlooking how design and operating conditions shape degradation. This work…

We present a comprehensive model to analyze, quantitatively, and predict the process of degradation of organic light-emitting diodes (OLEDs) considering all possible degradation mechanisms, i.e., polaron, exciton, exciton-polaron…

This paper proposes a bi-level optimization framework to investigate the optimal market operation strategies of price-maker battery energy storage systems (BESSs) in real-time energy, spinning reserve, and pay as performance regulation…

Systems and Control · Electrical Eng. & Systems 2022-01-20 Reza Khalilisenobari , Meng Wu

In order for the widely discussed benefits of flow batteries for electrochemical energy storage to be applied at large scale, the cost of the electrochemical stack must come down substantially. One promising avenue for reducing stack cost…

Chemical Physics · Physics 2015-06-19 W. A. Braff , M. Z. Bazant , C. R. Buie
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