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分子动力学中晶体位错的三维可视化系统设计与实现

The Design and Implementation of 3D Visualization System for Crystal Dislocations in Molecular Dynamics

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【作者】 宁媛张鹏介军

【Author】 NING Yuan;ZHANG Peng;JIE Jun;School of Information and Control Engineering,Xi’an University of Architecture and Technology;College of Arts,Xi’an University of Architecture and Technology;

【机构】 西安建筑科技大学信息与控制工程学院西安建筑科技大学艺术学院

【摘要】 在材料科学中,位错线是晶体或晶格内滑移面上已滑动区的边界,位错线的识别对于鉴定晶体的性能有着重要的影响。该文将三维可视化技术应用到分子动力学领域,改进了原有的只能通过计算结果分析数据、通过二维图像简单观察数据的方法,设计了晶体位错可视化系统,使得晶体中各原子之间形成的三维结构易于观察,便于研究晶体位错等重要的材质特性,提高位错线的识别效率。

【Abstract】 In the material science, the dislocation lines are the boundary sliding of a crystal or a lattice slip plane,the identification of dislocation lines have a important impact for the property of crystals. The essay using the application of 3D visualization technology to the field of molecular dynamics and improving the conventional research ways, such as analyzing data by calculating results and observing the data by 2D images inconveniently, designing a visualization system for crystal dislocations. This way can make the 3D structure among atoms be observed easily, which is convenient to research the crystal dislocations and other important material properties, and improve the efficiency of the identification of dislocation lines.

  • 【文献出处】 电脑知识与技术 ,Computer Knowledge and Technology , 编辑部邮箱 ,2014年16期
  • 【分类号】TP391.41
  • 【下载频次】103
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