26,848 research outputs found

    Phase Separation Dynamics in Isotropic Ion-Intercalation Particles

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    Lithium-ion batteries exhibit complex nonlinear dynamics, resulting from diffusion and phase transformations coupled to ion intercalation reactions. Using the recently developed Cahn-Hilliard reaction (CHR) theory, we investigate a simple mathematical model of ion intercalation in a spherical solid nanoparticle, which predicts transitions from solid-solution radial diffusion to two-phase shrinking-core dynamics. This general approach extends previous Li-ion battery models, which either neglect phase separation or postulate a spherical shrinking-core phase boundary, by predicting phase separation only under appropriate circumstances. The effect of the applied current is captured by generalized Butler-Volmer kinetics, formulated in terms of diffusional chemical potentials, and the model consistently links the evolving concentration profile to the battery voltage. We examine sources of charge/discharge asymmetry, such as asymmetric charge transfer and surface "wetting" by ions within the solid, which can lead to three distinct phase regions. In order to solve the fourth-order nonlinear CHR initial-boundary-value problem, a control-volume discretization is developed in spherical coordinates. The basic physics are illustrated by simulating many representative cases, including a simple model of the popular cathode material, lithium iron phosphate (neglecting crystal anisotropy and coherency strain). Analytical approximations are also derived for the voltage plateau as a function of the applied current

    Electron transport in interacting hybrid mesoscopic systems

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    A unified theory for the current through a nanoscale region of interacting electrons connected to two leads which can be either ferromagnet or superconductor is presented, yielding Meir-Wingreen-type formulas when applied to specific circumstances. In such a formulation, the requirement of gauge invariance for the current is satisfied automatically. Moreover, one can judge unambiguously what quantities can be measured in the transport experiment

    Single-particle subband structure of Quantum Cables

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    We proposed a model of Quantum Cable in analogy to the recently synthesized coaxial nanocable structure [Suenaga et al. Science, 278, 653 (1997); Zhang et al. ibid, 281, 973 (1998)], and studied its single-electron subband structure. Our results show that the subband spectrum of Quantum Cable is different from either double-quantum-wire (DQW) structure in two-dimensional electron gas (2DEG) or single quantum cylinder. Besides the double degeneracy of subbands arisen from the non-abelian mirrow reflection symmetry, interesting quasicrossings (accidental degeneracies), anticrossings and bundlings of Quantum Cable energy subbands are observed for some structure parameters. In the extreme limit (barrier width tends to infinity), the normal degeneracy of subbands different from the DQW structure is independent on the other structure parameters.Comment: 12 pages, 9 figure

    Quantum Cable as transport spectroscopy of 1D DOS of cylindrical quantum wires

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    We considered the proposed Quantum Cable as a kind of transport spectroscopy of one-dimensional (1D) density of states (DOS) of cylindrical quantum wires. By simultaneously detecting the direct current through the cylindrical quantum wire and the leaked tunneling current into the neighboring wire at desired temperatures, one can obtain detailed information about 1D DOS and subband structure of cylindrical quantum wires.Comment: 7 pages, 4 figures, late
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