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用于激光诱导击穿光谱拟合的近似沃伊特函数公式。

Approximate Voigt function formula for laser-induced breakdown spectroscopy fitting.

作者信息

Chen Siying, Jia Yiwen, Chen He, Guo Pan, Xu Qixiang, Wang Lifu, Zhang Yinchao

出版信息

Appl Opt. 2021 May 10;60(14):4120-4126. doi: 10.1364/AO.416677.

Abstract

Accurate and rapid spectrum fitting is very important for quantitatively analyzing laser-induced breakdown spectroscopy (LIBS). The Voigt function is often used to fit LIBS spectral lines. We propose a new approximate Voigt function formula. Based on the classic Lorentz-Gauss linear combination formula, a summation term was added that contained a specific convolution operation to improve the Voigt function's calculation and fitting accuracy. This formula can be used for the approximate calculation of the Voigt function with an overall accuracy of 0.31% and a full width at half-maximum internal accuracy of 0.25% when the ratio of Lorentzian linewidth to Gaussian linewidth is 1:1. The formula was then applied to LIBS data processing to fit four element spectral lines of calcium (Ca-393.37, 396.85, and 422.67 nm) and potassium (K-766.49 nm). The fitting results showed that this new approximate formula could fit at least seven data points, and compared with the complex plane partition method and the classic linear combination formula, the new formula had better fitting speed and accuracy.

摘要

准确快速的光谱拟合对于激光诱导击穿光谱(LIBS)的定量分析非常重要。Voigt函数常用于拟合LIBS光谱线。我们提出了一种新的近似Voigt函数公式。基于经典的洛伦兹 - 高斯线性组合公式,添加了一个包含特定卷积运算的求和项,以提高Voigt函数的计算和拟合精度。当洛伦兹线宽与高斯线宽之比为1:1时,该公式可用于Voigt函数的近似计算,整体精度为0.31%,半高宽内部精度为0.25%。然后将该公式应用于LIBS数据处理,以拟合钙(Ca - 393.37、396.85和422.67 nm)和钾(K - 766.49 nm)的四条元素光谱线。拟合结果表明,这个新的近似公式至少可以拟合七个数据点,并且与复平面分区法和经典线性组合公式相比,新公式具有更好的拟合速度和精度。

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