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Electrode morphology critically determines the stability and efficiency of lithium metal anodes, yet no predictive framework has explained how measurable parameters control deposition. Here we introduce the first theoretical model of…

Materials Science · Physics 2025-10-21 Hanning Zhang , Oleg V. Yazyev , Ruslan Yamaletdinov

The improvement of Li-ion battery performance requires development of models that capture the essential physics and chemistry in Li-ion battery electrode materials. In this paper a novel electrochemical phase-field model is presented that…

Improving the film quality in the synthesis of large-area hexagonal boron nitride films (h-BN) for two-dimensional material devices remains a great challenge. The measurement of electrical breakdown dielectric strength (EBD) is one of the…

Materials Science · Physics 2017-01-04 Yoshiaki Hattori , Takashi Taniguchi , Kenji Watanabe , Kosuke Nagashio

Lithium-ion batteries (LIBs) are the leading technology used in consumer electronics, electric vehicles, and grid-level electrochemical energy storage applications. The ever-increasing use of LIBs has highlighted a gap in understanding of…

Liquid Metal Batteries (LMBs) are a promising grid-scale energy storage technology that offer low costs per kilowatt-hour, high energy and current densities, as well as low fade rates. The all-liquid composition of the batteries, as well as…

Fluid Dynamics · Physics 2021-05-27 Declan Finn Keogh , Victoria Timchenko , John Reizes , Chris Menictas

Electrochemical oxidation-reduction of radicals is a green and environmentally friendly approach to generating fuels. These reactions, however, suffer from sluggish kinetics due to a low local concentration of radicals around the…

Chemical Physics · Physics 2021-12-15 Chaudry Sajed Saraj , Subhash C. Singh , Gopal Verma , Rahul A Rajan , Wei Li , Chunlei Guo

Silicon anodes promise high energy densities of next-generation lithium-ion batteries, but suffer from shorter cycle life. The accelerated capacity fade stems from the repeated fracture and healing of the solid-electrolyte interphase (SEI)…

Chemical Physics · Physics 2022-12-01 Lars von Kolzenberg , Arnulf Latz , Birger Horstmann

This paper investigates in hatching process strategies for additive manufacturing using an electron beam by numerical simulations. The underlying physical model and the corresponding three dimensional thermal free surface lattice Boltzmann…

Computational Engineering, Finance, and Science · Computer Science 2015-03-31 Matthias Markl , Regina Ammer , Ulrich Rüde , Carolin Körner

The interface plays a critical role in electrochemical systems, driving the development of various theories to investigate properties at nanoscale and microscale levels, including the electrictrochemical double layer (EDL) theory and…

Materials Science · Physics 2025-04-08 Yitao He

Distributions of potential and lithium content inside lithium ion batteries highly affects their performance and durability. An increased heterogeneity of the lithium distribution is expected in thick electrodes with high energy densities…

Accurate estimation of the internal states of lithium-ion batteries is key towards improving their management for safety, efficiency and longevity purposes. Various approaches exist in the literature in this context, among which designing…

Systems and Control · Electrical Eng. & Systems 2023-08-21 Mira Khalil , Romain Postoyan , Stéphane Raël

An application for high-performance computing (HPC) is shown that is relevant in the field of battery development. Simulations of electrolyte wetting and flow are conducted using pore network models (PNM) and the lattice Boltzmann method…

Computational Engineering, Finance, and Science · Computer Science 2024-01-22 Benjamin Kellers , Martin P. Lautenschlaeger , Julius Weinmiller , Lukas Krumbein , Simon Hein , Timo Danner , Arnulf Latz

Laser-structuring techniques like Direct Laser Interference Patterning show great potential for optimizing electrodes for water electrolysis. Therefore, a systematic experimental study based on statistical design of experiments is performed…

We report real-time average stress measurements on composite silicon electrodes made with two different binders [Carboxymethyl cellulose (CMC), and polyvinylidene fluoride (PVDF)] during electrochemical lithiation and delithiation. During…

Inspired by the wisdom of metallurgists in designing new alloys, the Integrated Computational Materials Engineering (ICME) based design strategy is proposed for development of Si based anodes for Li-ion batteries (LIBs). The strategy starts…

Materials Science · Physics 2020-12-08 Keke Chang , Yong Du

Newly designed Li-ion battery cathode materials with high capacity and greater flexibility in chemical composition will be critical for the growing electric vehicles market. Cathode structures with cation disorder were once considered…

Rechargeable batteries that incorporate shaped three-dimensional electrodes have been shown to have increased power and energy densities for a given footprint area when compared to a conventional geometry, i.e., a planar cathode and anode…

Li-ion battery degradation processes are multi-scale, heterogeneous, dynamic and involve multiple cell components through cross talk mechanisms. Correlated operando characterization capable of measuring several key parameters are needed to…

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…

As the core determinant of lithium-ion battery performance, electrode materials play a crucial role in defining the battery's capacity, cycling stability, and durability. During charging and discharging, electrode materials undergo complex…

Materials Science · Physics 2025-08-15 Liqi Wang , Ruijuan Xiao , Hong Li