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首页> 外文期刊>The journal of physical chemistry, C. Nanomaterials and interfaces >Anisotropic Phase Boundary Morphology in Nanoscale Olivine Electrode Particles
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Anisotropic Phase Boundary Morphology in Nanoscale Olivine Electrode Particles

机译:纳米橄榄石电极颗粒的各向异性相边界形态

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Li-insertion-induced phase transformation in nanoscale olivine particles is studied by phase-field simulations in this paper. We show that the anisotropic growth morphology observed in experiments is thermodynamically controlled by the elastic energy arising from the misfit strain between the Li-rich and Li-poor olivine phases and kinetically influenced by the Li surface-reaction kinetics. The one-dimensional Li difiusivity inherent to the olivine structure is found to kinetically stabilize the phase boundary morphology after Li insertion termintates and facilitate ex-situ observation. Our calculations suggest that examination of the phase boundary morphology provides an effective approach to determine the limiting process of the Li intercalation kinetics in olivine nanoparticles.
机译:本文通过相场模拟研究了锂插入引起的纳米橄榄石颗粒的相变。我们表明,在实验中观察到的各向异性生长形态是由富锂和贫锂橄榄石相之间的失配应变产生的弹性能热力学控制的,并且受锂表面反应动力学的动力学影响。发现橄榄石结构固有的一维Li扩散性可在Li插入终止后动态稳定相边界形态并促进异位观察。我们的计算表明,相边界形态的检查提供了一种确定橄榄石纳米颗粒中Li嵌入动力学极限过程的有效方法。

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