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狭缝受限条件下形成球状物的二嵌段共聚物:动态密度泛函理论研究

Sphere-forming diblock copolymers in slit confinement: A dynamic density functional theory study.

作者信息

Tan Hongge, Song Qinggong, Niu Xiaohui, Wang Ziyu, Gao Wenfang, Yan Dadong

机构信息

College of Science, Civil Aviation University of China, Tianjin 300300, China.

出版信息

J Chem Phys. 2009 Jun 7;130(21):214901. doi: 10.1063/1.3141985.

Abstract

With mean-field dynamic density functional theory, we study the morphologies of sphere-forming diblock copolymers confined between two homogeneous surfaces. The effects of the film thickness and the surface field strength on the phase behavior of sphere-forming copolymer film are investigated. The morphologies deviating from the bulk sphere-forming structure are revealed, including cylinders oriented perpendicular to the surface, cylinders oriented parallel to the surface, perforated lamellae and lamellae by varying the film thickness, and surface field strength. We also construct the phase diagram of surface reconstruction, in which some interesting phase transitions are presented. Besides, we compare the present phase diagram with the relevant phase diagram of cylinder-forming block copolymer film.

摘要

利用平均场动态密度泛函理论,我们研究了限制在两个均匀表面之间的形成球形的双嵌段共聚物的形态。研究了膜厚度和表面场强对形成球形共聚物膜相行为的影响。通过改变膜厚度和表面场强,揭示了偏离本体球形结构的形态,包括垂直于表面取向的圆柱体、平行于表面取向的圆柱体、穿孔片层和片层。我们还构建了表面重构的相图,其中呈现了一些有趣的相变。此外,我们将当前的相图与形成圆柱体的嵌段共聚物膜的相关相图进行了比较。

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