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Using a materials genome approach on the basis of the density functional theory, we have formulated a new class of inorganic electrolytes for fast diffusion of Li+ ions, through fine-tuning of lattice chemistry of anti-perovskite…

Chemical Physics · Physics 2017-07-20 Zhuo Wang , Hongjie Xu , Minjie Xuan , Guosheng Shao

All-solid-state lithium-ion batteries have renewed interest in high-performance solid electrolytes. Li3PS4 (Li2S-P2S5) glasses are among the most studied due to their high ionic conductivity, traditionally ascribed to rotational motion of…

Materials Science · Physics 2026-02-27 J. Pawelko , X. Rocquefelte , A. Tetenoire , D. Le Coq , L. Calvez , E. Furet

Recent experimental studies confirmed that a long searched conventional superconducting phase in graphene can be induced via lithium deposition. However, the canonical character of the lithium-decorated graphene (LiC$_{6}$) superconductor…

Superconductivity · Physics 2019-06-26 Dominik Szczȩśniak , Radosław Szczȩśniak

Sodium-ion batteries are a cost-effective and sustainable alternative to lithium-ion systems for large-scale energy storage. Hard carbon (HC) anodes, composed of disordered graphitic and amorphous domains, offer high capacity but exhibit…

Discovering new superionic materials is essential for advancing solid-state batteries, which offer improved energy density and safety compared to the traditional lithium-ion batteries with liquid electrolytes. Conventional computational…

Solid-ion conductors (SICs) comprising non-ionic plastic crystals and lithium salts often require compositing with polymers to render them processable for use in solid-state lithium-metal batteries. Here, we show that polymer-doped plastic…

Layered two-dimensional materials like graphene are highly appealing for lithium battery applications owing to their high surface-volume ratios. However, a critical issue that limits their practical applications is the confined motion of…

Materials Science · Physics 2019-01-23 Andrey Kistanov , Devesh Kripalani , Yongqing Cai , Sergey Dmitriev , Kun Zhou , Yong-Wei Zhang

The development of multifunctional solid-state materials is key to advancing lithium-ion batteries with enhanced safety and simplified architectures. Here, we report a scalable, highly efficient (near $100\%$), solvent-free mechanochemical…

It has been shown recently that the overpotential originating from ionic conduction of alkali-ions through the inner dense solid-electrolyte interphase (SEI) is strongly non-linear. An empirical equation was proposed to merge the measured…

Applied Physics · Physics 2018-01-31 Michael Hess

The electrical conductivity changes of the Si(111)-(6x6)Au surface at early stage of Pb deposition was studied experimentally and theoretically as a function of coverage. Pb deposition onto a Si(111)-(6x6)Au surface induce strong change of…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 T. Kwapinski , Z. Korczak , M. Jalochowski

One prominent structural feature of ionic liquids near surfaces is formation of alternating layers of anions and cations. However, how this layering responds to applied potential is poorly understood. We focus on the structure of…

The existence of passivating layers at the interfaces is a major factor enabling modern lithium-ion (Li-ion) batteries. Their properties determine the cycle life, performance, and safety of batteries. A special case is the solid electrolyte…

Chemical Physics · Physics 2021-06-07 Zeeshan Ahmad , Victor Venturi , Hasnain Hafiz , Venkatasubramanian Viswanathan

When an ionic liquid adsorbs onto a porous electrode, its ionic arrangement is deeply modified due to a screening of the Coulombic interactions by the metallic surface and by the confinement imposed upon it by the electrode's morphology. In…

Optically driven quantum materials exhibit a variety of non-equilibrium functional phenomena [1-11], which are potentially associated with unique transport properties. However, these transient electrical responses have remained largely…

Superconductivity · Physics 2023-01-18 E. Wang , J. D. Adelinia , M. Chavez-Cervantes , T. Matsuyama , M. Fechner , M. Buzzi , G. Meier , A. Cavalleri

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…

Soft Condensed Matter · Physics 2026-01-07 Amaury Coste , Thomas Meyer , Claire Villevielle , Fannie Alloin , Stefano Mossa , Benoit Coasne

Lee, Kim, and coworkers have recently claimed room-temperature and ambient-pressure superconductivity in a copper-doped lead apatite material named LK-99. However, the polycrystalline material synthesized has a significant fraction of…

Superconductivity · Physics 2023-09-11 Prashant K. Jain

Highly conductive solid electrolytes are one key component for the development of safe and high-power all-solid-state batteries. Enormous progress has been achieved in the field of lithium solid electrolytes. Meanwhile, their ion…

Materials Science · Physics 2017-12-14 Marc Duchardt , Uwe Ruschewitz , Stefanie Dehnen , Bernhard Roling

${\beta}$- Eucryptite (LiAlSiO4) is a potential electrolyte for Li- ion battery due to its high Li- ion conductivity and very small volume thermal expansion coefficient. We have performed ab-initio molecular dynamics simulations of $\beta$-…

Materials Science · Physics 2018-03-26 Baltej Singh , Mayanak K. Gupta , Ranjan Mittal , Samrath L. Chaplot

The transport properties and electrical bandgap of nominally undoped ~75-nm-thick CrN layers simultaneously grown on AlN(0001) and AlN(11\bar{2}2) templates using plasma-assisted molecular beam epitaxy are investigated. The layers grown on…

Materials Science · Physics 2025-11-26 Duc V. Dinh , Jens Herfort , Andreas Fiedler , Oliver Brandt

Ion transport across solid solid interfaces is often slower than through the bulk of a material, impeding the charge and discharge rate of batteries. Designing highly conductive interfaces is challenging due to the need to probe ion…