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通过神经网络函数从微观颜色信息推断拓扑缺陷附近的分子取向/有序变化。

Inference of molecular orientation/ordering change nearby topological defects by the neural network function from the microscopic color information.

机构信息

Department of Applied Chemistry, Chuo University, Tokyo, 112-8551, Japan.

出版信息

Sci Rep. 2021 Apr 27;11(1):9108. doi: 10.1038/s41598-021-88535-7.

Abstract

Topological defects in liquid crystals (LCs) dominate molecular alignment/motion in many cases. Here, the neural network (NN) function has been introduced to predict the LC orientation condition (orientation angle and order parameter) at local positions around topological defects from the phase/polarization microscopic color images. The NN function was trained in advance by using the color information of an LC in a planar alignment cell for different orientation angles and temperatures. The photo-induced changes of LC molecules around topological defects observed by the time-resolved measurement was converted into the image sequences of the orientation angle and the order parameter change. We found that each pair of brushes with different colors around topological defects showed different orientation angle and ordering changes. The photo-induced change was triggered by the photoisomerization reaction of molecules, and one pair of brushes increased in its order parameter just after light irradiation, causing gradual rotation in the brush. The molecules in the other pair of brushes were disordered and rotated by the effect of the initially affected region. This combination approach of the time-resolved phase/polarization microscopy and the NN function can provide detailed information on the molecular alignment dynamics around the topological defects.

摘要

液晶(LC)中的拓扑缺陷在许多情况下主导着分子的排列/运动。在这里,引入了神经网络(NN)函数,以便根据拓扑缺陷周围局部位置的相/偏振微观彩色图像预测 LC 的取向条件(取向角和序参量)。NN 函数通过使用平面排列单元中 LC 的颜色信息进行了预先训练,这些颜色信息对应于不同的取向角和温度。通过时间分辨测量观察到的拓扑缺陷周围 LC 分子的光致变化被转换为取向角和序参量变化的图像序列。我们发现,拓扑缺陷周围的每对具有不同颜色的刷子表现出不同的取向角和有序变化。光致变化是由分子的光致异构反应触发的,一对刷子在光照射后其序参量增加,导致刷子逐渐旋转。另一对刷子中的分子由于初始受影响区域的影响而变得无序并旋转。这种时间分辨的相/偏振显微镜和 NN 函数的组合方法可以提供有关拓扑缺陷周围分子排列动力学的详细信息。

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