计算器
选择(遗传算法)
拉曼光谱
计算机科学
数据挖掘
人工智能
光学
物理
操作系统
作者
Grégory Setnikar,Julien Samson,Marie-Aude Méasson
出处
期刊:SoftwareX
[Elsevier BV]
日期:2022-07-01
卷期号:19: 101152-101152
标识
DOI:10.1016/j.softx.2022.101152
摘要
Raman spectroscopy is known to be a powerful technique to obtain the symmetries of excitations of condensed matter crystalline systems thanks to the polarization-dependence selection rules of the Raman signal. To be computed, the selection rules require systematic matrix multiplications, based on group theory. This is time consuming, especially when various configurations of lights polarizations and crystal orientation have to be checked. The software "Raman Selection Rules Calculator" addresses the need of fast calculations of Raman selection rules in the most general cases, including for non-trivial orientation. The software has been designed to be easy to use and accessible on a large number of platforms, Windows, Mac, Linux and on-line.
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