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Ionic crystals, such as solid electrolytes and complex oxides, are central to modern technologies for energy storage, sensing, actuation, and other functional applications. An important fundamental issue in the atomic and quantum-scale…

Materials Science · Physics 2026-02-12 Shoham Sen , Yang Wang , Timothy Breitzman , Kaushik Dayal

While the spontaneous emission from independent emitters provides spatially uncorrelated photons - a typical manifestation of quantum randomness, the interference of the coherent scattering leads to a well-defined intensity pattern - a…

Quantum Physics · Physics 2025-12-04 K. Singh , A. Cidrim , A. Kovalenko , T. Pham , O. Číp , L. Slodička , R. Bachelard

The thermodynamics of the lattice model of intercalation of ions in crystals is considered in the mean field approximation. Pseudospin formalism is used for the description of interaction of electrons with ions and the possibility of…

Strongly Correlated Electrons · Physics 2009-07-08 T. S. Mysakovych , V. O. Krasnov , I. V. Stasyuk

Understanding the evolution of the physicochemical bulk properties during the Li deintercalation (charging) process is critical for optimizing battery cathode materials. In this study, we combine X-ray photoelectron spectroscopy (XPS),…

We present a coupled continuum formulation for the electrostatic, chemical, thermal, mechanical and fluid physics in battery materials. Our treatment is at the particle scale, at which the active particles held together by carbon-binders,…

Computational Physics · Physics 2018-07-26 Zhenlin Wang , Krishna Garikipati

We analyse the correlated back and forth dynamics and dynamic heterogeneities, i.e. the presence of fast and slow ions, for a lithium metasilicate system via computer simulations. For this purpose we define, in analogy to previous work in…

Disordered Systems and Neural Networks · Physics 2009-11-07 Andreas Heuer , Magnus Kunow , Michael Vogel , Radha D. Banhatti

Material properties depend sensitively on picometer scale atomic displacements introduced by local chemical fluctuations. Direct real-space, high spatial-resolution measurements of this compositional variation and corresponding distortion…

Materials Science · Physics 2015-02-17 Xiahan Sang , Everett D. Grimley , Changning Niu , Douglas L. Irving , James M. LeBeau

The efficient detection of light from trapped ions in free space is paramount for most of their applications. We propose a scheme to enhance the photon collection from linear ion strings. It employs the constructive interference of light…

Quantum Physics · Physics 2024-12-18 T. D. Tran , D. Babjak , A. Kovalenko , K. Singh , M. T. Pham , P. Obšil , A. Lešundák , O. Číp , L. Slodička

Traditional approaches to identify ion-transport pathways often presume equal probability of occupying all hopping sites and focus entirely on finding the lowest migration barrier channels between them. Although this strategy has been…

Materials Science · Physics 2023-01-27 Shashwat Anand , Tina Chen , Gerbrand Ceder

Molecular orientation fluctuations in ferroelectric smectic liquid crystals produce space charges, due to the divergence of the spontaneous polarization. These space charges interact with mobile ions, so that one must consider the coupled…

Soft Condensed Matter · Physics 2007-08-16 Robert A. Pelcovits , J. -B. Lee , R. B. Meyer

Interstitial atoms are ubiquitous in solids and they are widely incorporated into materials to tune their lattice structure, electronic transportation, and mechanical properties. Because the distribution of interstitial atoms in matrix…

Materials Science · Physics 2024-05-29 Jizhe Cui , Haozhi Sha , Liangze Mao , Kang Sun , Wenfeng Yang , Rong Yu

The role of inhomegeneity in determining the properties of correlated electron systems is poorly understood because of the dearth of structural probes of disorder at the nanoscale. Advances in both neutron and x-ray scattering…

Strongly Correlated Electrons · Physics 2025-03-19 Raymond Osborn , Damjan Pelc , Matthew Krogstad , Stephan Rosenkranz , Martin Greven

Intercalation of lithium atoms between layers of 2D materials can alter their atomic and electronic structure. We investigate effects of Li intercalation in twisted bilayers of the transition metal dichalcogenide MoS$_2$ through…

Mesoscale and Nanoscale Physics · Physics 2020-09-30 Zheyu Lu , Stephen Carr , Daniel T. Larson , Efthimios Kaxiras

It is of critical importance to understand the mechanical properties change of electrode materials during lithium intercalation in the mechanical design of Li-ion batteries, for the purpose of the high reliability and safety in their…

Materials Science · Physics 2020-01-07 Gao Xu , Yanyu Liu , Jiawang Hong , Daining Fang

Molecular-scale manipulation of electronic/ionic charge accumulation in materials is a preeminent challenge, particularly in electrochemical energy storage. Layered van der Waals (vdW) crystals exemplify a diverse family of materials that…

We demonstrate a spatial-imaging thermometry technique for ions in a one-dimensional Coulomb crystal by relating their imaged spatial extent along the linear radiofrequency ion trap axis to normal modes of vibration of coupled oscillators…

Atomic Physics · Physics 2016-02-11 V. Rajagopal , J. P. Marler , M. G. Kokish , B. C. Odom

Intending to solve the decade old problem of solar opacity, we report substantial photoabsorption uncertainty due to the effect of ion-ion correlations. By performing detailed opacity calculations of the solar mixture, we find that taking…

Solar and Stellar Astrophysics · Physics 2018-03-01 Menahem Krief , Yair Kurzweil , Alexander Feigel , Doron Gazit

We propose a simple linear scaling expression in reciprocal space for evaluating the ion--electron potential of crystalline solids. The expression replaces the long-range ion--electron potential with an equivalent localized charge…

Materials Science · Physics 2016-12-21 Xuecheng Shao , Wenhui Mi , Qiang Xu , Yanchao Wang , Yanming Ma

We consider the effect of mobile ions on the applied potential needed to reorient a lamellar system of two different materials placed between two planar electrodes. The reorientation occurs from a configuration parallel to the electrodes…

Soft Condensed Matter · Physics 2012-07-19 Gregory Garbès Putzel , David Andelman , Yoav Tsori , Michael Schick

Lithium ion batteries have been a central part of consumer electronics for decades. More recently, they have also become critical components in the quickly arising technological fields of electric mobility and intermittent renewable energy…

Computational Physics · Physics 2021-11-15 Chiara Panosetti , Simon B. Anniés , Cristina Grosu , Stefan Seidlmayer , Christoph Scheurer