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The most essential concept in concurrent multiscale methods involving atomistic-continuum coupling is how to define the relation between atomistic and continuum regions. A well-known coupling method that has been frequently employed in…

介观与纳米尺度物理 · 物理学 2022-07-27 Pouya Towhidi , Manouchehr Salehi

The formation and stability of the solid electrolyte interphase (SEI) play a central role in determining the long-term performance and safety of modern electrochemical energy storage systems. Despite decades of research, the SEI's…

This paper is concerned with the analysis of effective thermomechanical properties of multi- layered materials of interest for solid oxide fuel cells (SOFC) and lithium ions batteries fabrication. The recently developed asymptotic…

材料科学 · 物理学 2016-08-04 A. Bacigalupo , L. Morini , A. Piccolroaz

Solid-state batteries (SSB) are emerging as next-generation electrochemical energy storage devices. Achieving high energy density in SSB relies on solid polymer electrolytes (SPE) that are electrochemically stable against both lithium metal…

软凝聚态物质 · 物理学 2026-01-07 Amaury Coste , Thomas Meyer , Claire Villevielle , Fannie Alloin , Stefano Mossa , Benoit Coasne

A major challenge in the molecular simulation of electric double layer capacitors (EDLCs) is the choice of an appropriate model for the electrode. Typically, in such simulations the electrode surface is modeled using a uniform fixed charge…

计算物理 · 物理学 2015-06-22 Zhenxing Wang , Yang Yang , David L. Olmsted , Mark Asta , Brian B. Laird

The study of ion transport in electrochemically active materials for energy storage systems requires simulations on quantum- atomistic- and mesoscales. The methods accessing these scales not only have to be effective but also well…

Li-Ion Solid-State Electrolytes (Li-SSEs) are a promising solution that resolves the critical issues of conventional Li-Ion Batteries (LIBs) such as poor ionic conductivity, interfacial instability, and dendrites growth. In this study, a…

材料科学 · 物理学 2022-02-15 Seungpyo Kang , Minseon Kim , Kyoungmin Min

Solid-solid collapse transition in open framework structures is ubiquitous in nature. The real difficulty in understanding detailed microscopic aspects of such transitions in molecular systems arises from the interplay between different…

软凝聚态物质 · 物理学 2015-06-15 Rakesh S. Singh , Biman Bagchi

Networks, which represent agents and interactions between them, arise in myriad applications throughout the sciences, engineering, and even the humanities. To understand large-scale structure in a network, a common task is to cluster a…

社会与信息网络 · 计算机科学 2019-05-22 Zachary M. Boyd , Mason A. Porter , Andrea L. Bertozzi

Electrochemical strains are a ubiquitous feature of solid state ionic devices ranging from ion batteries and fuel cells to electroresistive and memristive memories. Recently, we proposed a scanning probe microscopy (SPM) based approach,…

材料科学 · 物理学 2015-06-03 A. N. Morozovska , E. A. Eliseev , S. V. Kalinin

The rolling pad instability is caused by electromagnetic interactions in systems of horizontal layers with strongly different electric conductivities. We analyze the instability for a simplified model of a liquid metal battery (LMB), a…

流体动力学 · 物理学 2020-01-08 Linyan Xiang , Oleg Zikanov

The evolution of electric vehicles (EVs) is reshaping the automotive industry, advocating for more sustainable transportation practices. Accurately predicting EV charging behavior is essential for effective infrastructure planning and…

系统与控制 · 电气工程与系统科学 2025-11-07 Xiachong Lin , Arian Prabowo , Imran Razzak , Hao Xue , Matthew Amos , Sam Behrens , Flora D. Salim

Mathematical modeling of lithium-ion batteries (LiBs) is a primary challenge in advanced battery management. This paper proposes two new frameworks to integrate physics-based models with machine learning to achieve high-precision modeling…

计算工程、金融与科学 · 计算机科学 2024-08-23 Hao Tu , Scott Moura , Yebin Wang , Huazhen Fang

Accurate simulations of a condensed system of ions or polar molecules are concerned with proper handlings of the involved electrostatics. For such a Coulomb system at a charged planar interface, the Coulomb interaction averaged over the…

化学物理 · 物理学 2024-07-29 Zhonghan Hu

Liquid metal batteries (LMBs) are a promising grid-scale storage device however, the scalability of this technology and its electrochemical performance is limited by mass transport overpotentials. In this work, a numerical model of a…

流体动力学 · 物理学 2024-10-15 Declan Finn Keogh , Mark Baldry , Victoria Timchenko , John Reizes , Chris Menictas

Battery thermal management systems (BTMSs) are critical for efficient and safe operation of lithium-ion batteries (LIBs), especially for fast charging/discharging applications that generate significant heating within the cell. Forced…

流体动力学 · 物理学 2025-02-04 Piyush Mani Tripathi , Amy M. Marconnet

The modeling of superconducting magnetic bearing (SMB) is of great significance for predicting and optimizing its levitation performance before construction. Although lots of efforts have been made in this area, it still remains some space…

超导电性 · 物理学 2018-08-01 Loïc Quéval , Kun Liu , Wenjiao Yang , Víctor M. R. Zermeño , Guangtong Ma

Ionic liquids are widely used as electrolytes in electrochemical devices. In this context, many experimental and theoretical approaches have been recently developed for characterizing their interface with electrodes. In this perspective…

材料科学 · 物理学 2017-09-13 Céline Merlet , Benjamin Rotenberg , Paul Madden , Mathieu Salanne

The Statistical Model of the Early Stage, SMES, describes a transition between confined and deconfined phases of strongly interacting matter created in nucleus-nucleus collisions. The model was formulated in the late 1990s for central Pb+Pb…

核理论 · 物理学 2023-07-19 R. V. Poberezhnyuk , M. Gazdzicki , M. I. Gorenstein

The advantages and disadvantages of Battery Swapping Stations (BSS) for heavy-duty trucks are poorly understood, relative to Fast Charging Stations (FCS) systems. This study evaluates these two charging mechanisms for electric heavy-duty…

系统与控制 · 电气工程与系统科学 2025-12-23 Ruiting Wang , Antoine Martinez , Zaid Allybokus , Wente Zeng , Nicolas Obrecht , Scott Moura