Stereographic Projection of Theoretical Orientation Relationships Between Crystals of Any Types in Phase Transformation and Precipitation

IF 1.5 4区 材料科学 Q3 Chemistry Crystal Research and Technology Pub Date : 2023-12-25 DOI:10.1002/crat.202300242
Youliang He
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Abstract

Stereographic projection is a classic technology to represent the angular relationships of lattice planes and directions. In some cases, it is necessary to project arbitrary lattice planes or directions of a crystal onto an arbitrary lattice plane of another crystal, e.g., when representing orientation relationships (ORs) in phase transformation or precipitation. Commercial EBSD (electron backscatter diffraction) software cannot illustrate theoretical orientation relationships based purely on the parallelism conditions. This work presents a generalized and unified formulation for stereographic projection of any lattice planes or directions onto any lattice planes of any crystals in the 32 point groups, which is utilized to represent the theoretical orientation relationships between any crystal types. Examples are given to illustrate the correlations of common orientation relationships in both cubic and hexagonal crystals. A procedure is also established to color code and simultaneously project all low-index Miller/Bravais planes or directions of a crystal onto an arbitrary lattice plane of the same crystal, which can be utilized to visualize the crystal symmetry and determine the standard stereographic triangle (SST). All these illustrations are realized in a computer program written in C++ using the OpenGL graphic libraries.

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相变和沉淀中任何类型晶体之间理论定向关系的立体投影
立体投影是表示晶格平面和方向角度关系的经典技术。在某些情况下,有必要将晶体的任意晶格平面或方向投影到另一晶体的任意晶格平面上,例如在表示相变或沉淀中的取向关系(ORs)时。商用 EBSD(电子反向散射衍射)软件不能纯粹根据平行度条件来说明理论取向关系。本研究提出了一种通用的统一表述方法,可将任意晶格平面或方向立体投影到 32 个点群中任意晶体的任意晶格平面上,并利用这种方法来表示任意晶体类型之间的理论取向关系。举例说明了立方晶体和六方晶体中常见取向关系的相关性。此外,还建立了一种程序,可对晶体的所有低指数米勒/布拉维平面或方向进行彩色编码,并同时投影到同一晶体的任意晶格平面上,从而使晶体对称性可视化,并确定标准立体三角形(SST)。所有这些图示都是通过使用 OpenGL 图形库以 C++ 编写的计算机程序实现的。
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来源期刊
CiteScore
2.50
自引率
6.70%
发文量
121
审稿时长
1.9 months
期刊介绍: The journal Crystal Research and Technology is a pure online Journal (since 2012). Crystal Research and Technology is an international journal examining all aspects of research within experimental, industrial, and theoretical crystallography. The journal covers the relevant aspects of -crystal growth techniques and phenomena (including bulk growth, thin films) -modern crystalline materials (e.g. smart materials, nanocrystals, quasicrystals, liquid crystals) -industrial crystallisation -application of crystals in materials science, electronics, data storage, and optics -experimental, simulation and theoretical studies of the structural properties of crystals -crystallographic computing
期刊最新文献
Issue Information: Crystal Research and Technology 10'2024 Correction to First-Principles Calculations to Investigate the Ground State, Mechanical Stability, Electronic Structure, and Optical Properties of Tl2SnX3 (X = S, Se, Te) Morphologically and Compositionally Controlled Cs2SbBr6 by Bi and Ag Substitution Copper Intercalation Effect on Thermoelectric Performance of Pristine Tin Selenide The Impact of Melt Transparency on Li2MoO4 Single Crystal Growth by the Czochralski Technique
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