论文标题
蒸发薄膜混合物的相位模型
A phase-field model for the evaporation of thin film mixtures
论文作者
论文摘要
溶液处理的太阳能电池的性能在很大程度上取决于在膜干燥过程中形成的光伏层的几何结构和粗糙度。在干燥过程中,结晶和液体液体的相互作用导致纳米和微观尺度上的结构形成以及最终的粗糙膜。为了更好地了解如何通过工程工程改进膜结构,我们旨在通过相位模拟从理论上研究这些系统。我们引入了一个基于Cahn-Hilliard方程的蒸发模型,以耦合到液体蒸气相变的流体浓度的演变。我们证明了它与实验测量的干燥动力学匹配并研究模型参数的影响的能力。此外,还研究了溶剂混合物和溶剂 - 蒸气退火的蒸发。干膜粗糙度自然来自我们的一组方程式,如旋律分解和在结构化底物上干燥的初步模拟所示。
The performance of solution-processed solar cells strongly depends on the geometrical structure and roughness of the photovoltaic layers formed during film drying. During the drying process, the interplay of crystallization and liquid-liquid demixing leads to the structure formation on the nano- and microscale and to the final rough film. In order to better understand how the film structure can be improved by process engineering, we aim at theoretically investigating these systems by means of phase-field simulations. We introduce an evaporation model based on the Cahn-Hilliard equation for the evolution of the fluid concentrations coupled to the Allen-Cahn equation for the liquid-vapour phase transformation. We demonstrate its ability to match the experimentally measured drying kinetics and study the impact of the parameters of our model. Furthermore, the evaporation of solvent blends and solvent-vapour annealing are investigated. The dry film roughness emerges naturally from our set of equations, as illustrated through preliminary simulations of spinodal decomposition and film drying on structured substrates.