用于在高维合金空间中可视化性能的SymPlex图

IF 5.3 2区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY
John Cavin , Pravan Omprakash , Adrien Couet , Rohan Mishra
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引用次数: 0

摘要

传统的可视化工具,如相图和凸包,不适合多主元素合金(mpea)的可视化,因为它们的组成空间很大,不能很容易地投影到二维上。在这里,引入了SymPlex图来实现mpea在高维相空间中沿着特殊路径的各种属性的可视化。这些是极地热图,描绘了从母体等摩尔MPEA辐射到一组选定的低阶成分的高对称路径的性质。SymPlex图捕捉了沿着特殊路径的能量格局的变化,并有助于可视化添加或替代组件对合金稳定性的影响,这对于评估增材制造的加工路径特别有用。因此,SymPlex图可以通过显示高维相空间中成分及其性质之间的联系来帮助指导mpea的设计,并且更多的信息集中在等摩尔区域附近。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

SymPlex plots for visualizing properties in high-dimensional alloy spaces

SymPlex plots for visualizing properties in high-dimensional alloy spaces
Conventional visualization tools such as phase diagrams and convex hulls are ill-suited to visualize multiple principal element alloys (MPEAs) due to their large compositional space that cannot be easily projected onto two dimensions. Here, SymPlex plots are introduced to enable the visualization of various properties along special paths in high-dimensional phase spaces of MPEAs. These are polar heatmaps that plot properties along high-symmetry paths radiating from the parent equimolar MPEA to a set of chosen lower-order compositions. SymPlex plots capture the changes in the energy landscape along the special paths and help visualize the effect of addition or substitution of components on the alloy stability, which can be especially useful to assess processing pathways for additive manufacturing. Thus, SymPlex plots can help guide design of MPEAs by showing connections between compositions and their properties in the high-dimensional phase space with more information concentrated near the equimolar region.
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来源期刊
Scripta Materialia
Scripta Materialia 工程技术-材料科学:综合
CiteScore
11.40
自引率
5.00%
发文量
581
审稿时长
34 days
期刊介绍: Scripta Materialia is a LETTERS journal of Acta Materialia, providing a forum for the rapid publication of short communications on the relationship between the structure and the properties of inorganic materials. The emphasis is on originality rather than incremental research. Short reports on the development of materials with novel or substantially improved properties are also welcomed. Emphasis is on either the functional or mechanical behavior of metals, ceramics and semiconductors at all length scales.
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