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The collapse of flexible polyelectrolytes in a solution of multivalent counterions is studied by means of a two state model. The states correspond to rod-like and spherically collapsed conformations respectively. We focus on the very dilute…

Soft Condensed Matter · Physics 2009-10-31 Francisco J. Solis , Monica Olvera de la Cruz

Next-generation lithium-ion batteries with silicon anodes have positive characteristics due to higher energy densities compared to state-of-the-art graphite anodes. However, the large volume expansion of silicon anodes can cause high…

Numerical Analysis · Mathematics 2024-04-03 R. Schoof , G. F. Castelli , W. Dörfler

Accurately predicting the state of charge of Lithium-ion batteries is essential to the performance of battery management systems of electric vehicles. One of the main reasons for the slow global adoption of electric cars is driving range…

Systems and Control · Electrical Eng. & Systems 2024-10-23 Hadeel Aboueidah , Abdulrahman Altahhan

Due to the importance of using supercapacitors in electronic storage devices, improving their efficiency is one of the topics that has attracted the attention of many researchers. Choosing the proper electrolyte for supercapacitors is one…

Computational Physics · Physics 2023-01-04 Nasrin Eyvazi , Davood Abbaszadeh , Morad Biagooi , SeyedEhsan Nedaaee Oskoee

A novel approach is presented to efficiently include transport effects in thin active material coating layers of all-solid-state batteries using a dimensionally reduced formulation embedded into a three-dimensionally resolved coupled…

Chemical Physics · Physics 2023-07-06 Stephan Sinzig , Christoph P. Schmidt , Wolfgang A. Wall

Electrolytes play a critical role in designing next-generation battery systems, by allowing efficient ion transfer, preventing charge transfer, and stabilizing electrode-electrolyte interfaces. In this work, we develop a differentiable…

Capacity degradation of lithium-ion batteries under long-term cyclic aging is modelled via a flexible sigmoidal-type regression set-up, where the regression parameters can be interpreted. Different approaches known from the literature are…

Applications · Statistics 2019-07-31 Marcus Johnen , Simon Pitzen , Udo Kamps , Maria Kateri , Dirk Uwe Sauer

Ionic behaviors, including ion distributions and hydration characteristics at solid-liquid interfaces, are important research interests in many important applications, such as electric double-layer capacitors and water lubrication. Here, we…

Chemical Physics · Physics 2025-12-08 Bowen Ai , Zekun Gong , Long Ma , Hongwen Zhang , Tianyi Sui , Yinghua Qiu

The lithium transport mechanism in ternary polymer electrolytes, consisting of PEO/LiTFSI and various fractions of the ionic liquid N-methyl-N-propylpyrrolidinium bis(trifluoromethane)sulfonimide, are investigated by means of MD…

Soft Condensed Matter · Physics 2013-02-21 Diddo Diddens , Andreas Heuer

Advanced battery management is to lithium-ion battery systems as the brain is to the human body. Its performance rests on the use of battery models that are both fast and accurate. However, mainstream equivalent circuit models and…

Systems and Control · Electrical Eng. & Systems 2022-11-14 Nikhil Biju , Huazhen Fang

It is shown that continuously occurring electrolyte-reduction reaction on freshly-exposed electrode surfaces during lithiation/delithiation cycles causes the lowering of cycling efficiency, and hence, capacity fade in well-cycled silicon…

Materials Science · Physics 2020-02-19 Vijay A. Sethuraman

This paper investigates the environmental impact of Li-Ion batteries by quantifying manufacturing-related emissions and analyzing how electricity mix and production scale affect emission intensity. To this end, we conduct a meta-analysis of…

Systems and Control · Electrical Eng. & Systems 2025-06-09 Maurizio Clemente , Prapti Maharjan , Mauro Salazar , Theo Hofman

This work explores controllability and the control effort required for lithium-ion batteries. Battery packs have become a critical technology in both personal and professional applications as a means to store large amounts of energy.…

Systems and Control · Electrical Eng. & Systems 2026-04-14 Preston T. Abadie , Donald J. Docimo

We investigate the thermodynamic properties of a polyelectrolyte solution in a presence of {\it multivalent} salts. The polyions are modeled as rigid cylinders with the charge distributed uniformly along the major axis. The solution,…

Condensed Matter · Physics 2015-06-25 Paulo S. Kuhn , Yan Levin , Marcia C. Barbosa

Porous electrode theory, pioneered by John Newman and collaborators, provides a useful macroscopic description of battery cycling behavior, rooted in microscopic physical models rather than empirical circuit approximations. The theory…

Chemical Physics · Physics 2017-02-28 Raymond B. Smith , Martin Z. Bazant

Due to the hydrolytic instability of $LiPF_6$ in carbonate-based solvents, HF is a typical impurity in Li-ion battery electrolytes. HF significantly influences the performance of Li-ion batteries, for example by impacting the formation of…

We present two successive mean-field approximations for describing the mechanical properties and the swelling equilibrium of polyelectrolyte gels in contact with a salt solution. The first mean-field approximation reduces the many-chain…

Soft Condensed Matter · Physics 2019-11-22 Jonas Landsgesell , Christian Holm

Electrochemical hybrid battery models have major potential to enable advanced physics-based control, diagnostic, and prognostic features for next-generation lithium-ion battery management systems. This is due to the physical significance of…

Systems and Control · Electrical Eng. & Systems 2025-05-13 Jackson Fogelquist , Xinfan Lin

Understanding ion relaxation dynamics in overlapping electric double layers (EDLs) is critical for the development of efficient nanotechnology based electrochemical energy storage, electrochemomechanical energy conversion and…

Chemical Physics · Physics 2014-11-04 Vaibhav Thakore , James J. Hickman

Liquid electrolytes are critical components of next-generation energy storage systems, enabling fast ion transport, minimizing interfacial resistance, and ensuring electrochemical stability for long-term battery performance. However,…

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