论文标题

使用晶格Boltzmann方法理解锂离子电池电极的电解质填充

Understanding Electrolyte Filling of Lithium-Ion Battery Electrodes on the Pore Scale Using the Lattice Boltzmann Method

论文作者

Lautenschlaeger, Martin P., Prifling, Benedikt, Kellers, Benjamin, Weinmiller, Julius, Danner, Timo, Schmidt, Volker, Latz, Arnulf

论文摘要

电解质填充是电池制造过程中时间关键时期的步骤,也会影响电池性能。填充过程中的潜在物理现象主要发生在孔尺度上,并且很难在实验上研究。在本文中,一种计算方法,即\ \晶格Boltzmann方法,用于研究3D锂离子电池阴极中的填充过程和相应的孔尺度现象。使用均质化方法模拟了通过纳米多孔粘合剂的电解质流动。除过程时间外,还研究了结构和物理化学特性的影响。这些是粒径,粘合剂分布以及活性材料和粘合剂的体积分数以及润湿行为。优化的填充条件是通过毛细管压力饱和关系讨论的。它显示了上述影响因子如何影响电解质饱和度。此外,详细分析了所包含的残余气相的量和气体聚集物的相应尺寸分布。这两个因素均显示对可能对电池性能产生不利影响的机制产生强大影响。此处获得的结果表明,如何通过适应过程参数以及电极和电解质设计来优化电池性能的填充过程,最终电解质饱和度以及电池性能。

Electrolyte filling is a time-critical step during battery manufacturing that also affects the battery performance. The underlying physical phenomena during filling mainly occur on the pore scale and are hard to study experimentally. In this paper, a computational approach, i.e.\ the lattice Boltzmann method, is used to study the filling process and corresponding pore-scale phenomena in 3D lithium-ion battery cathodes. The electrolyte flow through the nanoporous binder is simulated using a homogenization approach. Besides the process time, the influence of structural and physico-chemical properties is investigated. Those are the particle size, the binder distribution, and the volume fraction and wetting behavior of active material and binder. Optimized filling conditions are discussed by capillary pressure-saturation relationships. It is shown how the aforementioned influencing factors affect the electrolyte saturation. Moreover, the amount of the entrapped residual gas phase and the corresponding size distribution of the gas agglomerates are analyzed in detail. Both factors are shown to have a strong impact on mechanisms that can adversely affect the battery performance. The results obtained here indicate how the filling process, the final electrolyte saturation, and potentially also the battery performance can be optimized by adapting process parameters and the electrode and electrolyte design.

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