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ELECTRONIC STATE OF IONS IN MECHANOCHEMICALLY PREPARED INTERCALATION LITHIUM-TRANSITION METAL OXIDE COMPOUNDS

机译:机械化学制备的嵌入锂过渡金属氧化物化合物的电子状态

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Although being commercially realized, lithium-ion batteries are still the object of intense study aimed of further improving their electrochemical characteristics. The charge-discharge processes strongly depend on the crystal and electronic structure of the intercalation lithium-transition metal oxides used as cathode materials. Last years a great deal of attention was devoted to preparation of these compounds with unusual ordering (structural, magnetic, charge) and electronic state of transition metal ions, and a structure more stable to intercalation/deintercalation of lithium ions at discharge/charge processes, preventing a structural distortion and, thus, providing better electrochemical behavior. This can be achieved by a disordering of their structure. It was shown that the processes of disordering are followed by the processes of ordering of cations in these systems. For example, some authors showed that in the mixed lithium-manganese spinels LiMn_(2-x)Me_xO_4, where Me=Mg, Fe, the cation ordering in B-sites occurs. In the delithiated Li_(1-x)Mn_2O_4 and L_(1-x)CoO_2 the ordering of lithium vacancies was observed. While the processes of cation-cation long-range ordering occurring due to the interaction of d-electrons (long-range electron delocalization) are widely studied, the processes of short-range ordering (short-range delocalization) are poorly highlighted.
机译:虽然商业地实现了,但锂离子电池仍然是激烈的研究的目的,旨在进一步提高其电化学特性。电荷放电方法强烈取决于嵌入锂过渡金属氧化物的晶体和电子结构,用作阴极材料。去年,致力于在过渡金属离子的不寻常的排序(结构,磁,电荷)和电子状态下,致力于制备这些化合物,以及在放电/充电过程中锂离子的嵌入/脱嵌的结构更稳定,防止结构失真,从而提供更好的电化学行为。这可以通过其结构的失调来实现。结果表明,排序过程之后是这些系统中阳离子的排序过程。例如,一些作者表明,在混合锂 - 锰尖端LiMn_(2-X)Me_xO_4中,其中Me = Mg,Fe,发生在B场中的阳离子排序。在脱发的Li_(1-x)Mn_2O_4和L_(1-x)COO_2中,观察到锂空位的排序。虽然广泛研究了由于D-电子的相互作用而发生的阳离子阳离子远程排序的过程,但是突出显示的短距离排序(短程临床化)的过程。

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