混合泊松分布单粒子ICP-MS数据反卷积的贝叶斯估计

IF 3.1 2区 化学 Q2 CHEMISTRY, ANALYTICAL
Yoshinari Suzuki, Midori Kondo, Masae Harimoto, Yusuke Okamoto, Yu-ki Tanaka, Yasumitsu Ogra and Hiroshi Akiyama
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引用次数: 0

摘要

单颗粒ICP-MS (spICP-MS)是测定无机纳米颗粒(NP)质量分布和颗粒数浓度的常用方法。然而,spICP-MS在某些情况下难以应用,特别是在需要区分溶解离子信号和相对较小的np信号的情况下。为了对spICP-MS数据进行反卷积,采用银(Ag)、二氧化铈(CeO2)和二氧化硅(SiO2) NPs建立了spICP-MS分析的贝叶斯估计方法。假设spICP-MS数据的信号分布可以用混合泊松分布描述,采用贝叶斯估计方法对信号分布进行参数化。然后将分析结果与常规标准得到的结果进行比较。当设置仪器参数使峰宽在4个时间事件范围内,不偏离当前贝叶斯模型的假设时,贝叶斯估计方法的估计结果优于基于常规准则的方法,特别是对于高浓度颗粒数的样品。此外,应用特定的信息先验分布使我们能够获得合理的估计结果,即使信号计数为6或更少,背景计数很高。由于获得了Ag-NP、CeO2-NP和SiO2-NP的适当NP信息,因此对于ICP-MS检测的无机NP可以普遍采用贝叶斯估计方法。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

Bayesian estimation to deconvolute single-particle ICP-MS data with a mixed Poisson distribution†

Bayesian estimation to deconvolute single-particle ICP-MS data with a mixed Poisson distribution†

Single-particle ICP-MS (spICP-MS) is an established method for the determination of inorganic nanoparticle (NP) mass distributions and particle number concentrations. However, spICP-MS is not applicable to some cases, especially cases that require distinguishing signals from dissolved ions and signals from relatively small NPs. To deconvolute spICP-MS data, which is obtained by setting the dwell time similar to the particle event duration time, a Bayesian estimation method was developed for spICP-MS analysis using silver (Ag) and silica (SiO2) NPs. The signal distributions of the spICP-MS data were parameterised using a Bayesian estimation method on the assumption that they could be described by mixed Poisson distributions. Analytical results were then compared to results obtained with conventional criteria. When the instrument parameters were set so that the particle-event duration was within 2 readings and hence did not deviate from the assumptions of the current Bayesian model, better estimation results could be obtained with the Bayesian estimation method than with methods based on conventional criteria, especially for a sample with high particle number concentration. Furthermore, applying the specific informative prior distribution enabled us to obtain reasonable estimation results, even when the signal counts were 6 or less and the background counts were high. Because appropriate NP information was obtained for Ag-NP and SiO2-NP, the Bayesian estimation method can be universally adopted with inorganic NPs detectable by ICP-MS.

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来源期刊
CiteScore
6.20
自引率
26.50%
发文量
228
审稿时长
1.7 months
期刊介绍: Innovative research on the fundamental theory and application of spectrometric techniques.
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