论文标题
在火焰喷射热解中粒子形成的理论单液滴模型
Theoretical single droplet model for particle formation in flame spray pyrolysis
论文作者
论文摘要
在当前的工作中,我们开发了一个单滴模型来描述多组分 - 液滴燃烧中的颗粒形成。研究了不同溶液特性的气体到颗粒转换和液滴转换途径,以及种群平衡模型和液滴干燥模型。对于没有前体的多组分液滴,液滴燃烧受到液相的物种扩散的限制。该模型可以很好地预测以前的PDA测量值观察到的液滴收缩史。对于比其热分解温度低的沸点的前体,液滴中的前体可以通过气对粒子转换途径转变为纳米颗粒。人口平衡模型表明,产生的纳米颗粒尺寸依赖于前体质量分数和停留时间,这与蒸气喂养的气溶胶火焰合成一致。对于倾向于在液体中分解或沉淀的前体,它会经过液滴到粒子转换途径。液滴行为可以通过液滴蒸发时间和前体反应或沉淀时间的比率进行分类。对于短蒸发时间的小液滴,纳米颗粒的形成遵守单粒粒子规则。对于长时间蒸发时间的大液滴,降水,热分解和蒸发之间的竞争决定了最终的纳米颗粒形态。这项研究中建立的单滴模型可以潜在地指导前体设计,并与整个火焰喷雾燃烧器的湍流火焰模拟结合。
In the current work, we develop a single droplet model to describe particle formation in multicomponent-liquid droplet combustion. Both the gas-to-particle conversion and droplet-to-particle conversion routes of different solution properties are investigated, together with the population balance model and the droplet drying model. For multi-component droplets without precursors, the droplet combustion is limited by the species diffusion in the liquid phase. The model can well predict the droplet shrinkage history observed by previous PDA measurements. For the precursor with a low boiling point than its thermal decomposition temperature, the precursor in the droplet can then transform into nanoparticles through the gas-to-particle conversion route. The population balance model reveals that the generated nanoparticle size relies on both the precursor mass fraction and the residence time, which is consistent with the vapor-fed aerosol flame synthesis. For the precursor that tends to decompose or precipitate in the liquid, it then undergoes the droplet-to-particle conversion route. The droplet behavior can be classified by the ratio of droplet evaporation time and precursor reaction or precipitation time. For small droplets with short evaporation time, the nanoparticle formation obeys the one-droplet-one-particle rule. For large droplets with long evaporation time, the competition among precipitation, thermal decomposition, and evaporation determines the final nanoparticle morphology. The single droplet model established in this study can potentially guide the precursor design and be coupled with the turbulent flame simulation of the whole flame spray pyrolysis burner.