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实现嵌段共聚物自组装的数据驱动设计。

Enabling data-driven design of block copolymer self-assembly.

作者信息

Magosso Chiara, Murataj Irdi, Perego Michele, Seguini Gabriele, Audus Debra J, Milano Gianluca, Ferrarese Lupi Federico

机构信息

Department of Electronics and Telecommunications, Politecnico di Torino, 10129, Turin, Italy.

Advanced Materials Metrology and Life Sciences Division, INRiM (Istituto Nazionale di Ricerca Metrologica), 10135, Turin, Italy.

出版信息

Sci Data. 2025 Jun 21;12(1):1055. doi: 10.1038/s41597-025-05379-w.

Abstract

Here we present a database composed of scanning electron microscope images of self-assembled block copolymers. The fabrication process parameters, structural properties and microscope information are all contained in the image metadata, making a group of images a database on its own. This approach has numerous advantages including ease of sharing, reusability of information and resilience against user errors. This database follows the digital International System of Units principles and is complemented by a graphical user interface for process metadata insertion and an automated algorithm for image analysis to retrieve structural properties of the nanostructures. Databases such as this one, together with data-driven approaches, enable users to rationally design new materials with the desired properties by understanding the relationship between fabrication parameters and material structure. The here reported database, that contains around 1747 images of lamellar phase and lying down cylinders self-assembled block copolymers along with associated metadata, is structured so it can be continuously expanded by the research community including also samples with different block copolymers morphologies.

摘要

在此,我们展示了一个由自组装嵌段共聚物的扫描电子显微镜图像组成的数据库。制造工艺参数、结构特性和显微镜信息均包含在图像元数据中,使得一组图像本身就构成一个数据库。这种方法具有诸多优点,包括易于共享、信息可重复使用以及对用户错误具有抗性。该数据库遵循数字国际单位制原则,并辅以用于插入工艺元数据的图形用户界面和用于图像分析以检索纳米结构结构特性的自动化算法。这样的数据库与数据驱动方法一起,使用户能够通过理解制造参数与材料结构之间的关系,合理设计具有所需特性的新材料。这里报道的数据库包含约1747张层状相和躺卧圆柱状自组装嵌段共聚物的图像以及相关元数据,其结构设计使得研究界能够不断扩充,包括纳入具有不同嵌段共聚物形态的样品。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e182/12182569/4448834caf91/41597_2025_5379_Fig1_HTML.jpg

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