基于螺旋生长模型和晶格玻尔兹曼法探索溶解对多维粒度分布的影响

IF 3.9 3区 工程技术 Q2 ENGINEERING, CHEMICAL
Shiyang Chai, Zehua Ren, Sibei Ji, Xinyu Zheng, Li Zhou, Lei Zhang* and Xu Ji, 
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引用次数: 0

摘要

在结晶过程中,晶体形态是衡量晶体产品质量的重要指标之一。然而,现有的晶体粒度分布忽略了这一关键信息。本文提出了一种基于螺旋生长模型和晶格玻尔兹曼法(LBM)的多维粒度分布预测方法。首先,利用螺旋生长模型建立主要晶面的生长动力学方程。然后,将建立的动力学方程与多维粒子平衡模型相结合。然后,利用 LBM 对上述模型进行求解。最后,将上述模型应用于两种情况(苯甲酸和布洛芬),进一步探讨溶解效应对粒度分布的影响,并通过结晶实验进行验证。结果表明,在颗粒数量较多的粒度范围内,模拟值与实验值吻合良好。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

Exploring the Influence of Solvation on Multidimensional Particle Size Distribution Based on the Spiral Growth Model and the Lattice Boltzmann Method

Exploring the Influence of Solvation on Multidimensional Particle Size Distribution Based on the Spiral Growth Model and the Lattice Boltzmann Method

In the crystallization process, crystal morphology is one of the important indicators to measure the quality of the crystal products. However, the existing crystal size distribution ignores this key information. In this paper, a multidimensional particle size distribution prediction method based on the spiral growth model and the Lattice Boltzmann method (LBM) is proposed. First, the spiral growth model is used to establish the growth kinetic equations of the main crystal faces. Then, the established kinetic equations are combined with the multidimensional particle balance model. Next, the above model is solved by LBM. Finally, the above model is applied to two cases (benzoic acid and ibuprofen) to further explore the influence of the solvation effect on the particle size distribution and verified by crystallization experiments. The results show that the simulation and experimental values are in good agreement in the size range with a large number of particles.

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来源期刊
Industrial & Engineering Chemistry Research
Industrial & Engineering Chemistry Research 工程技术-工程:化工
CiteScore
7.40
自引率
7.10%
发文量
1467
审稿时长
2.8 months
期刊介绍: ndustrial & Engineering Chemistry, with variations in title and format, has been published since 1909 by the American Chemical Society. Industrial & Engineering Chemistry Research is a weekly publication that reports industrial and academic research in the broad fields of applied chemistry and chemical engineering with special focus on fundamentals, processes, and products.
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