LOMS.cz是高通量古典和组合的Judd-Ofelt分析和稀土光谱学的计算平台
Jan Hrabovsky1,2, Petr Varak3,4, Robin Krystufek5,6
1Faculty of Mathematics and Physics, Charles University, Ke Karlovu 5, 121 16, Prague, Czech Republic. mail@janhrabovsky.cz.
Scientific reports
|August 7, 2025
概括
LOMS.cz是一个新的开源平台,用于稀土光谱的Judd-Ofelt (JO) 计算标准化. 它通过自动化分析和实验验证来增强光子材料光学性质的预测.
科学领域:
- 频谱学是一种光谱学.
- 材料科学 材料科学 材料科学
- 计算物理 计算物理
背景情况:
- 贾德-奥菲尔特 (JO) 理论对于稀土过渡至关重要,但缺乏标准化的计算方法.
- 精确和可重复的JO参数的确定仍然是该领域的一个重大挑战.
研究的目的:
- 介绍LOMS.cz,一个开源计算平台,旨在标准化Judd-Ofelt计算.
- 为了解决在稀土光谱学中可靠的参数提取和光学特性预测的需求.
主要方法:
- 自动计算JO参数,过渡概率,分支比率和辐射寿命.
- 开发一个动态扩展的实验验证的JO参数数据库.
- 实施一种新的组合JO (C-JO) 分析算法,以确定最佳的频段组合.
主要成果:
- 使用LOMS.cz框架,证明了光谱参数的快速选.
- 在预测稀土材料的光学性质方面实现了更高的可靠性.
- 建立了一个标准化的平台,将自动化分析与实验验证相结合.
结论:
- LOMS.cz提供了一个标准化的计算框架,用于Judd-Ofelt计算.
- 该平台加速了基于稀土的光子和光电子材料的发现和优化.
- 自动化分析和实验验证的整合提高了研究的可复制性和效率.
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