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Knowing the transport properties of iron under realistic conditions present in the Earth's core is essential for the geophysical modeling of Earth's magnetic field generation. Besides by extreme pressures and temperatures, transport may be…

Strongly Correlated Electrons · Physics 2025-07-15 German G. Blesio , Leonid V. Pourovskii , Markus Aichhorn , Monica Pozzo , Dario Alfè , Jernej Mravlje

In the present work, we investigate oxygen vacancies (V$_\mathrm{O}$) in Co$_3$O$_4$, both in the bulk phase and under liquid-phase ethylene glycol oxidation, by combining theoretical and experimental techniques. Density functional theory…

Polymer electrolytes (PEs) are promising candidates for use in next-generation high-voltage batteries, as they possess advantageous elastic and electrochemical properties. However, PEs still suffer from low ionic conductivity and need to be…

Higher energy density and longer lifetime are the requirements for next-generation lithium-ion batteries. A promising anode material is silicon, which offers high specific capacity, but its significant volume change during lithiation and…

We propose a framework to study the spatio-temporal evolution of liquid-liquid phase separation of weak polyelectrolytes in ionic solutions. Unlike strong polyelectrolytes, which carry a fixed charge, the charge state of weak…

Soft Condensed Matter · Physics 2025-03-19 Giulia Laura Celora , Ralf Blossey , Andreas Munch , Barbara Wagner

The two-dimensional electron gas (2DEG) in reduced strontium titanate offers a versatile platform for oxide electronics, yet its dissipation mechanisms under field driven charge fluctuations remain poorly understood. Here, we combine…

Materials Science · Physics 2026-05-13 Akash Gupta , Marcin Kisiel , Remy Pawlak , Ernst Meyer

Analytical model for impedance of oxygen transport in the gas--diffusion layer (GDL) and cathode channel of a PEM fuel cell is developed. The model is based on transient oxygen mass conservation equations coupled to the proton current…

Chemical Physics · Physics 2021-11-09 Andrei Kulikovsky

The phase separation of oppositely-charged polyelectrolytes in solution is of current interest . In this work we study the driving force for polyelectrolyte complexation using molecular dynamics simulations. We calculate the potential of…

Biomolecules · Quantitative Biology 2020-01-08 Aditya N. Singh , Arun Yethiraj

Solid oxide fuel cells are efficient energy conversion devices essential to clean energy development, yet their broad application is limited by material challenges, including sluggish oxygen reduction kinetics at intermediate temperatures,…

Materials Science · Physics 2026-02-18 Yueyuan Gu , Juan Shi , Dilshod Nematov , Aoqi Liu , Yanru Yin , Hailu Dai , Lei Bi

The efficacy of the electrical conductivity relaxation (ECR) technique for investigating the oxygen transport properties of mixed conducting oxides has been evaluated. Fifteen mol% samarium doped ceria (SDC15), for which approximate values…

Materials Science · Physics 2014-01-06 Chirranjeevi Balaji Gopal , Sossina M. Haile

We report the observation in the direct space of the transport of a few thousand charges submitted to a tunable electric field along the surface of a silicon oxide layer. Charges are both deposited and observed using the same Electrostatic…

Condensed Matter · Physics 2007-05-23 J. S. Lambert , G. De Loubens , C. Guthmann , M. Saint-Jean , T. Melin

The intricate role of shear viscosity and ion-pair relaxations on ionic conductivity mechanisms and the underlying changes induced by salt concentration ($c$) in organic liquid electrolytes remain poorly understood despite their widespread…

The quest for safe high-energy batteries with "5V-class" cathodes and lithium metal anodes drives research into solid electrolytes. However, reasons for the large charge transfer resistances -- the major bottleneck of all-solid-state…

Chemical Physics · Physics 2021-01-26 Katharina Becker-Steinberger , Simon Schardt , Birger Horstmann , Arnulf Latz

Possible mechanisms of overlimiting current in unsupported electrolytes, exceeding diffusion limitation, have been intensely studied for their fundamental significance and applications to desalination, separations, sensing, and energy…

Fluid Dynamics · Physics 2015-06-22 Sungmin Nam , Inhee Cho , Joonseong Heo , Geunbae Lim , Martin Z. Bazant , Gunyong Sung , Sung Jae Kim

Shock electrodialysis (shock ED), an emerging electrokinetic process for water purification, leverages the new physics of deionization shock waves in porous media. In previous work, a simple leaky membrane model with surface conduction can…

Fluid Dynamics · Physics 2021-03-16 Huanhuan Tian , Mohammad A. Alkhadra , Martin Z. Bazant

In this study, we address the challenge of electrolyte degradation in all-solid-state humidified Li-$O_2$ batteries, which offer high theoretical energy density and potential cost advantages over conventional lithium-ion batteries.…

A common, yet unmodelled experimental phenomenon is explained first through the experimental data and then through modelling efforts. The phenomenon is a large, temporary loss in voltage during constant current discharge. This effect can be…

Chemical Physics · Physics 2024-08-31 Michael Cornish , Monica Marinescu , Dharshannan Sugunan

Modelling the ionic transport in battery cells requires precise parametrization of the involved electrolytes. For carbonate-based electrolytes, however, the evaluation of their parameters suffers from interphase effects between the bulk…

Osmotic transport in nanoconfined aqueous electrolytes provides new venues for water desalination and "blue energy" harvesting; the osmotic response of nanofluidic systems is controlled by the interfacial structure of water and electrolyte…

Chemical Physics · Physics 2022-08-16 Laurent Joly , Robert H. Meißner , Marcella Iannuzzi , Gabriele Tocci

The so-called negative electron compressibility refers to the lowering of the chemical potential of a metallic system when the carrier density increases. This effect has often been invoked in the past to explain the enhancement of the…

Mesoscale and Nanoscale Physics · Physics 2019-06-19 Javier Junquera , Pablo García-Fernández , Massimiliano Stengel