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METHOD FOR QUANTITATIVE SPECTROMETRY, QUANTITATIVE SPECTROMETRY APPARATUS, AND PROGRAM

机译:定量光谱学方法,定量光谱学仪器和程序

摘要

A composition ratio of a component targeted for quantification in a liquid, solid, or gaseous mixture is determined without taking the effort of performing measurement while stepwise changing an addition concentration as in an existing standard addition method. A quantitative spectrometry apparatus 100 includes a measurement unit 110 that spectroscopically analyzes an analysis-target sample 10 containing a component targeted for quantification in an unknown composition ratio and a reference sample containing the component targeted for quantification in a known composition ratio to obtain an original spectrum and a reference spectrum, a first generation unit 130 that generates, from these spectra, hypothetical addition spectra including a plurality of hypothetical addition rates as coefficients, a second generation unit that generates a plurality of analysis-target spectra from the respective hypothetical addition spectra, an extraction unit 170 that extracts a signal intensity profile of the component targeted for quantification corresponding to the hypothetical addition rates by performing a process including multivariate analysis, and a determination unit 190 that determines the unknown composition ratio of the component targeted for quantification contained in the analysis-target sample 10 from the dependence of the signal intensity profile on the hypothetical addition rates.
机译:如在现有的标准添加方法中那样,在逐步改变添加浓度的情况下,无需费力地进行测定即可确定液体,固体或气体混合物中的定量对象成分的组成比。定量光谱仪 100 包括测量单元 110 ,测量单元 110 对包含未知成分的定量目标成分的分析目标样品 10 进行光谱分析。第一生成单元 130 ,该第一参考生成单元 130 从这些光谱中生成包括多个假设添加率作为系数;第二生成单元,从各个假设添加谱生成多个分析目标谱;提取单元 170 ,提取目标成分的信号强度曲线通过执行包含多变量分析的过程和确定未知成分的确定单元 190 来进行与假设添加率对应的定量信号强度曲线对假设添加率的依赖性,使分析目标样品 10 中包含的定量目标组分的比值。

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