{"title":"漫反射红外光谱相对误差的浓度依赖性","authors":"Z. Krivácsy, J. Hlavay","doi":"10.1016/0584-8539(93)E0031-Q","DOIUrl":null,"url":null,"abstract":"<div><p>A mathematical model between the relative error in the Kubelka—Munk (K—M) function and the sample concentration has been determined if the K—M function is linear with the sample concentration, <em>c</em>≤ w/w%. The theoretical model has been investigated by measuring 3–5 parallels at different sample concentrations and calculating the RSD for the selected absorption bands. Quartz (<em>d</em><sub>ave</sub> = 1.3 μm) and calcite (<em>d</em><sub>ave</sub> = 3.3 μm) as analytes and KBr (<em>d</em><sub>ave</sub> = 9.9 μm) as embedding material were used. The result of the model and the experiments were in a good agreement. It has been shown that the RSD for absorption bands with small sensitivity can increase up to ±20–60%. The precision of the quantitative analysis in diffuse reflectance infrared Fourier transform spectrometry (DRIFTS) can be improved by applying more sensitive absorption bands and parallel measurements at one standard concentration</p></div>","PeriodicalId":82782,"journal":{"name":"Spectrochimica acta. Part A: Molecular spectroscopy","volume":"50 13","pages":"Pages 2197-2202"},"PeriodicalIF":0.0000,"publicationDate":"1994-11-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://sci-hub-pdf.com/10.1016/0584-8539(93)E0031-Q","citationCount":"1","resultStr":"{\"title\":\"Concentration dependence of the relative error in diffuse reflectance infrared spectrometry\",\"authors\":\"Z. Krivácsy, J. Hlavay\",\"doi\":\"10.1016/0584-8539(93)E0031-Q\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><p>A mathematical model between the relative error in the Kubelka—Munk (K—M) function and the sample concentration has been determined if the K—M function is linear with the sample concentration, <em>c</em>≤ w/w%. The theoretical model has been investigated by measuring 3–5 parallels at different sample concentrations and calculating the RSD for the selected absorption bands. Quartz (<em>d</em><sub>ave</sub> = 1.3 μm) and calcite (<em>d</em><sub>ave</sub> = 3.3 μm) as analytes and KBr (<em>d</em><sub>ave</sub> = 9.9 μm) as embedding material were used. The result of the model and the experiments were in a good agreement. It has been shown that the RSD for absorption bands with small sensitivity can increase up to ±20–60%. The precision of the quantitative analysis in diffuse reflectance infrared Fourier transform spectrometry (DRIFTS) can be improved by applying more sensitive absorption bands and parallel measurements at one standard concentration</p></div>\",\"PeriodicalId\":82782,\"journal\":{\"name\":\"Spectrochimica acta. Part A: Molecular spectroscopy\",\"volume\":\"50 13\",\"pages\":\"Pages 2197-2202\"},\"PeriodicalIF\":0.0000,\"publicationDate\":\"1994-11-01\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"https://sci-hub-pdf.com/10.1016/0584-8539(93)E0031-Q\",\"citationCount\":\"1\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Spectrochimica acta. Part A: Molecular spectroscopy\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://www.sciencedirect.com/science/article/pii/0584853993E0031Q\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"\",\"JCRName\":\"\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Spectrochimica acta. Part A: Molecular spectroscopy","FirstCategoryId":"1085","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/0584853993E0031Q","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
Concentration dependence of the relative error in diffuse reflectance infrared spectrometry
A mathematical model between the relative error in the Kubelka—Munk (K—M) function and the sample concentration has been determined if the K—M function is linear with the sample concentration, c≤ w/w%. The theoretical model has been investigated by measuring 3–5 parallels at different sample concentrations and calculating the RSD for the selected absorption bands. Quartz (dave = 1.3 μm) and calcite (dave = 3.3 μm) as analytes and KBr (dave = 9.9 μm) as embedding material were used. The result of the model and the experiments were in a good agreement. It has been shown that the RSD for absorption bands with small sensitivity can increase up to ±20–60%. The precision of the quantitative analysis in diffuse reflectance infrared Fourier transform spectrometry (DRIFTS) can be improved by applying more sensitive absorption bands and parallel measurements at one standard concentration