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从过饱和水溶液中捕获的多面晶体的透射显微镜图像中解析三维生长速率。

Deconstructing 3D growth rates from transmission microscopy images of facetted crystals as captured within supersaturated aqueous solutions.

作者信息

Ma Cai Y, Jiang Chen, Ilett Thomas P, Hazlehurst Thomas A, Hogg David C, Roberts Kevin J

机构信息

Centre for the Digital Design of Drug Products, School of Chemical and Process Engineering University of Leeds LeedsLS2 9JT United Kingdom.

School of Computing University of Leeds LeedsLS2 9JT United Kingdom.

出版信息

J Appl Crystallogr. 2024 Sep 25;57(Pt 5):1557-1565. doi: 10.1107/S1600576724008173. eCollection 2024 Oct 1.

DOI:10.1107/S1600576724008173
PMID:39387086
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC11460390/
Abstract

Here, a morphologically based approach is used for the characterization of 3D growth rates of facetted crystals from the solution phase. Crystal images of single crystals of the β-form of l-glutamic acid are captured during their growth at a relative supersaturation of 1.05 using transmission optical microscopy. The crystal growth rates estimated for both the {101} capping and {021} prismatic faces through image processing are consistent with those determined using reflection light mode [Jiang, Ma, Hazlehurst, Ilett, Jackson, Hogg & Roberts (2024 ▸). , 3277-3288]. The growth rate in the {010} face is, for the first time, estimated from the shadow widths of the {021} prismatic faces and found to be typically about half that of the {021} prismatic faces. Analysis of the 3D shape during growth reveals that the initial needle-like crystal morphology develops during the growth process to become more tabular, associated with the Zingg factor evolving from 2.9 to 1.7 (>1). The change in relative solution supersaturation during the growth process is estimated from calculations of the crystal volume, offering an alternative approach to determine this dynamically from visual observations.

摘要

在此,采用基于形态学的方法来表征溶液相中多面晶体的三维生长速率。使用透射光学显微镜在相对过饱和度为1.05的条件下,拍摄L-谷氨酸β-型单晶在生长过程中的晶体图像。通过图像处理估算出的{101}封端面和{021}棱柱面的晶体生长速率,与使用反射光模式测定的结果一致[Jiang, Ma, Hazlehurst, Ilett, Jackson, Hogg & Roberts (2024 ▸). , 3277 - 3288]。首次根据{021}棱柱面的阴影宽度估算出{010}面的生长速率,发现其通常约为{021}棱柱面生长速率的一半。对生长过程中三维形状的分析表明,最初的针状晶体形态在生长过程中逐渐演变为更扁平的形状,这与辛氏因子从2.9演变为1.7(>1)有关。根据晶体体积的计算估算出生长过程中相对溶液过饱和度的变化,提供了一种从视觉观察动态确定该变化的替代方法。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ac7d/11460390/2fbcbd988c7c/j-57-01557-fig6.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ac7d/11460390/fa29d67f2805/j-57-01557-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ac7d/11460390/17e65d15fd87/j-57-01557-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ac7d/11460390/50ba7c8af6e8/j-57-01557-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ac7d/11460390/6796ae0b8492/j-57-01557-fig4.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ac7d/11460390/68dc4b7149ac/j-57-01557-fig5.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ac7d/11460390/2fbcbd988c7c/j-57-01557-fig6.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ac7d/11460390/fa29d67f2805/j-57-01557-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ac7d/11460390/17e65d15fd87/j-57-01557-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ac7d/11460390/50ba7c8af6e8/j-57-01557-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ac7d/11460390/6796ae0b8492/j-57-01557-fig4.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ac7d/11460390/68dc4b7149ac/j-57-01557-fig5.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ac7d/11460390/2fbcbd988c7c/j-57-01557-fig6.jpg

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