Prediction of As, Cd, Cr, Hg, Ni, and Se Concentrations in Organic Amendments Using Portable X-ray Fluorescence and Multivariate Modeling

Portable X-ray fluorescence (pXRF) has been a widely used technique in various applications. However, its use for the analysis of organic amendments (composts, sewage sludges, organic fertilizers) is scarce. In these matrices, concentrations of some elements are below their detection limit. The obje...

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Main Authors: Rafael López-Núñez, Fátima Ajmal-Poley, Pilar Burgos-Doménech
Format: Article
Language:English
Published: MDPI AG 2020-08-01
Series:Applied Sciences
Subjects:
Online Access:https://www.mdpi.com/2076-3417/10/17/5726
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author Rafael López-Núñez
Fátima Ajmal-Poley
Pilar Burgos-Doménech
author_facet Rafael López-Núñez
Fátima Ajmal-Poley
Pilar Burgos-Doménech
author_sort Rafael López-Núñez
collection DOAJ
description Portable X-ray fluorescence (pXRF) has been a widely used technique in various applications. However, its use for the analysis of organic amendments (composts, sewage sludges, organic fertilizers) is scarce. In these matrices, concentrations of some elements are below their detection limit. The objective of this work was to find multiple linear regression equations that were able to predict the aqua-regia-soluble concentrations of the elements As, Cd, Cr, Hg, Ni, and Se using the pXRF readings of other measurable elements as predictor variables. For this, a set of 30 samples of organic amendments (composts, sewage sludges, and organic fertilizers) from the Manure and Refuse Sample Exchange Programme of the Wageningen Evaluating Programs for Analytical Laboratories (MARSEP-WEPAL) was used. Several amendment type-dependent single or multiple linear functions were found based on 1, 2, or 3 predictors. The predictor readings corresponded to the concentration of elements of geogenic (Fe, Si, Ti, Cl, Zr Al, Ca, S, Mn, and Ba), anthropogenic (Zn and Pb), and agricultural (P and K) origin. The regression coefficients of these functions were r = 0.90–0.99; therefore, they allowed for the quantitative determination of the target elements. These results will allow for fast and reliable analysis of organic amendments using pXRF that is valid for quality control in treatment plants.
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spelling doaj.art-126759dd47ba4f0585479d32962940712023-11-20T10:34:03ZengMDPI AGApplied Sciences2076-34172020-08-011017572610.3390/app10175726Prediction of As, Cd, Cr, Hg, Ni, and Se Concentrations in Organic Amendments Using Portable X-ray Fluorescence and Multivariate ModelingRafael López-Núñez0Fátima Ajmal-Poley1Pilar Burgos-Doménech2Instituto de Recursos Naturales y Agrobiología de Sevilla (IRNAS-CSIC), Avda, Reina Mercedes 10, 41012 Sevilla, SpainInstituto de Recursos Naturales y Agrobiología de Sevilla (IRNAS-CSIC), Avda, Reina Mercedes 10, 41012 Sevilla, SpainInstituto de Recursos Naturales y Agrobiología de Sevilla (IRNAS-CSIC), Avda, Reina Mercedes 10, 41012 Sevilla, SpainPortable X-ray fluorescence (pXRF) has been a widely used technique in various applications. However, its use for the analysis of organic amendments (composts, sewage sludges, organic fertilizers) is scarce. In these matrices, concentrations of some elements are below their detection limit. The objective of this work was to find multiple linear regression equations that were able to predict the aqua-regia-soluble concentrations of the elements As, Cd, Cr, Hg, Ni, and Se using the pXRF readings of other measurable elements as predictor variables. For this, a set of 30 samples of organic amendments (composts, sewage sludges, and organic fertilizers) from the Manure and Refuse Sample Exchange Programme of the Wageningen Evaluating Programs for Analytical Laboratories (MARSEP-WEPAL) was used. Several amendment type-dependent single or multiple linear functions were found based on 1, 2, or 3 predictors. The predictor readings corresponded to the concentration of elements of geogenic (Fe, Si, Ti, Cl, Zr Al, Ca, S, Mn, and Ba), anthropogenic (Zn and Pb), and agricultural (P and K) origin. The regression coefficients of these functions were r = 0.90–0.99; therefore, they allowed for the quantitative determination of the target elements. These results will allow for fast and reliable analysis of organic amendments using pXRF that is valid for quality control in treatment plants.https://www.mdpi.com/2076-3417/10/17/5726pXRFcompostsewage sludgeorganic fertilizeraqua regia extractionchemometry
spellingShingle Rafael López-Núñez
Fátima Ajmal-Poley
Pilar Burgos-Doménech
Prediction of As, Cd, Cr, Hg, Ni, and Se Concentrations in Organic Amendments Using Portable X-ray Fluorescence and Multivariate Modeling
Applied Sciences
pXRF
compost
sewage sludge
organic fertilizer
aqua regia extraction
chemometry
title Prediction of As, Cd, Cr, Hg, Ni, and Se Concentrations in Organic Amendments Using Portable X-ray Fluorescence and Multivariate Modeling
title_full Prediction of As, Cd, Cr, Hg, Ni, and Se Concentrations in Organic Amendments Using Portable X-ray Fluorescence and Multivariate Modeling
title_fullStr Prediction of As, Cd, Cr, Hg, Ni, and Se Concentrations in Organic Amendments Using Portable X-ray Fluorescence and Multivariate Modeling
title_full_unstemmed Prediction of As, Cd, Cr, Hg, Ni, and Se Concentrations in Organic Amendments Using Portable X-ray Fluorescence and Multivariate Modeling
title_short Prediction of As, Cd, Cr, Hg, Ni, and Se Concentrations in Organic Amendments Using Portable X-ray Fluorescence and Multivariate Modeling
title_sort prediction of as cd cr hg ni and se concentrations in organic amendments using portable x ray fluorescence and multivariate modeling
topic pXRF
compost
sewage sludge
organic fertilizer
aqua regia extraction
chemometry
url https://www.mdpi.com/2076-3417/10/17/5726
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