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Keywords = inductively coupled plasma atomic emission spectrometry (ICP-OES)

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13 pages, 469 KiB  
Article
Voltametric Analysis of Ergosterol Isolated from Wild-Growing and Cultivated Edible Mushrooms from Serbia and Korea
by Svetlana Đogo Mračević, Jelena Mutić, Vesna Stanković and Slavica Ražić
Molecules 2025, 30(9), 2010; https://doi.org/10.3390/molecules30092010 - 30 Apr 2025
Viewed by 480
Abstract
Thanks to several components with health-promoting properties, mushrooms are recognized as a practical functional food and a valuable source of nutrients for the food industry. Ergosterol, the major sterol in edible mushrooms and a precursor of vitamin D2 with proven pharmacological activity and [...] Read more.
Thanks to several components with health-promoting properties, mushrooms are recognized as a practical functional food and a valuable source of nutrients for the food industry. Ergosterol, the major sterol in edible mushrooms and a precursor of vitamin D2 with proven pharmacological activity and nutritional value, has become a very important topic in chemical and medical research. The main objectives of this study were to determine the ergosterol content in different species of Serbian wild mushrooms and in commercial mushrooms from Korean and Serbian grocery stores using square-wave voltammetry, to compare the concentrations in different parts of white button mushrooms, and to determine a possible relationship between Zn, Cu and Fe and ergosterol contents. The ergosterol contents varied between 0.01 and 7.04 mg/g (dry mass) of the mushrooms and were generally higher in cultivated mushrooms than in wild mushrooms. In addition, the ergosterol concentration was higher in the stems than in the caps of the mushrooms examined. Iron, Zn and Cu contents varied between the mushroom species at 8.5–479.9, 13.1–149.7 and 1.62–93.03 mg/kg, respectively, and principal component analysis (PCA) extracted two factors explaining 79.14% of the total variance, suggesting a direct relationship between iron and ergosterol content. This is the first comprehensive study to analyze and evaluate ergosterol concentrations in edible mushrooms from Korea and Serbia. Full article
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15 pages, 4551 KiB  
Article
New Insights into a Vanadium Precipitation Process by Hydrolysis Based on Manganese Salt Pretreatment
by Mengxia Liu, Tao Jiang, Jing Wen, Zibi Fu, Tangxia Yu, Guangdong Yang, Sanyuan Xia and Hao Xiao
Materials 2024, 17(24), 6223; https://doi.org/10.3390/ma17246223 - 20 Dec 2024
Viewed by 1072
Abstract
Vanadium precipitation is the key step in producing vanadium products from vanadium solution. The sustainable development of the vanadium industry requires new environmentally friendly processes for vanadium precipitation. In this study, NaVO3 solution was pretreated with manganese salt to preliminarily separate the [...] Read more.
Vanadium precipitation is the key step in producing vanadium products from vanadium solution. The sustainable development of the vanadium industry requires new environmentally friendly processes for vanadium precipitation. In this study, NaVO3 solution was pretreated with manganese salt to preliminarily separate the vanadium and sodium components. The product of vanadium extraction by manganese salt was dissolved by acid to produce manganese vanadate solution. After vanadium precipitation by hydrolysis, manganese removal, and calcination, the target product V2O5 was obtained. Scanning electron microscopy (SEM), X-ray diffraction (XRD), inductively coupled plasma emission spectrometry (ICP-OES), and atomic absorption spectrometry (AAS) were used to perform the characterization and analyses. The results showed that vanadium and manganese have a strong binding ability. The rate of vanadium extraction by manganese salt reached 99.75%, and the product of vanadium extraction by manganese salt was Mn2V2O7, with a sodium content of only 0.089%, confirming the effective separation of vanadium and sodium. The acid dissolution rate of the vanadium extraction product reached 99.95%, and the rate of vanadium precipitation by hydrolysis reached 97.87%. After manganese removal and calcination, the purity of the V2O5 product reached 98.92%. In addition, the recyclability of manganese sulfate and ammonium sulfate was analyzed. The process reduced the production of ammonia–nitrogen wastewater, laying a foundation for researching new technologies for extracting vanadium from vanadium slag. Full article
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8 pages, 1213 KiB  
Article
Investigation of Elemental Composition in White Wine Treated with Varying Doses of Bentonite
by Elisaveta Mladenova, Ivan Bakardzhiyski and Eva Dimitrova
Beverages 2024, 10(4), 114; https://doi.org/10.3390/beverages10040114 - 25 Nov 2024
Cited by 2 | Viewed by 976
Abstract
The mineral composition of wine is affected by numerous factors, including treatments with bentonite to control colloidal hazes. In this study, 10 parallel samples of white wine (Chardonnay, 2021 vintage year) were treated with pre-selected bentonite (activated calcium bentonite) at increasing doses, from [...] Read more.
The mineral composition of wine is affected by numerous factors, including treatments with bentonite to control colloidal hazes. In this study, 10 parallel samples of white wine (Chardonnay, 2021 vintage year) were treated with pre-selected bentonite (activated calcium bentonite) at increasing doses, from 0.3 to 3.0 g/L. Following acid mineralization, the content of some important elements was determined. The elements Al, Ba, Cd, Cu, Cr, Fe, Mg, Mn, P, Pb, and Zn were measured by inductively coupled plasma with optical emission spectrometry (ICP-OES), while flame atomic absorption spectrometry (FAAS) was used for the determination of Ca, K, and Li. Depending on the applied dose, the bentonite changed the concentration of the determined elements in different ways. Results indicated that higher doses of bentonite led to an increase in Al, Ca, and Fe content, while Cu and Zn initially rose with low doses before declining to near-baseline levels with higher doses. Full article
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15 pages, 4796 KiB  
Article
Risk Assessment of Nephrotoxic Metals in Soil and Water in Areas with High Prevalence of Chronic Kidney Disease in Panama
by Benedicto Valdés-Rodríguez, Virginia Montero-Campos, Matthew G. Siebecker, Amanda Jo Zimmerman, Mauricio Vega-Araya, Sharon P. Ulate Chacón and Dalys Rovira
Geosciences 2024, 14(8), 221; https://doi.org/10.3390/geosciences14080221 - 20 Aug 2024
Viewed by 1877
Abstract
Mesoamerican nephropathy (MeN) is a non-traditional chronic kidney disease in some areas of Mesoamerica. The health risk from nephrotoxic metals, such as arsenic (As), lead (Pb), mercury (Hg), vanadium (V), cadmium (Cd), rubidium (Rb), chromium (Cr), and nickel (Ni), was assessed in drinking [...] Read more.
Mesoamerican nephropathy (MeN) is a non-traditional chronic kidney disease in some areas of Mesoamerica. The health risk from nephrotoxic metals, such as arsenic (As), lead (Pb), mercury (Hg), vanadium (V), cadmium (Cd), rubidium (Rb), chromium (Cr), and nickel (Ni), was assessed in drinking water and soils. These metals, even at low concentrations, have the capacity to induce epigenetic damage and a nephrotoxic effect. The quantification of metals in soils was made through X-ray fluorescence spectrometry (XRF) and inductively coupled plasma optical emission spectrophotometry (ICP-OES), while the quantification of metals in water was carried out through inductively coupled plasma mass spectrometry (ICPMS) and atomic absorption (AA) spectrometry. The levels of As, Hg, Cd, and V in water were within the permissible limits, whereas Pb was found to be double and triple the value recommended by the World Health Organization. The non-carcinogenic risk from As in soil was evaluated using the Hazard Index (HI), and the route of ingestion was found to be the most important route. The results indicate that consuming water or ingesting soil particles with Pb and As poses a health risk to humans. Therefore, these findings identify the presence of toxicants in an exposure scenario and justify further research into these metals in people and the analysis of exposure routes. Full article
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15 pages, 1605 KiB  
Article
Investigation of the Complexation Activity of 2,4-Dithiouracil with Au(III) and Cu(II) and Biological Activity of the Newly Formed Complexes
by Petya Marinova, Dimitar Stoitsov, Nikola Burdzhiev, Slava Tsoneva, Denica Blazheva, Aleksandar Slavchev, Evelina Varbanova and Plamen Penchev
Appl. Sci. 2024, 14(15), 6601; https://doi.org/10.3390/app14156601 - 28 Jul 2024
Cited by 2 | Viewed by 1401
Abstract
The goal of this study is to synthesize, determine the structure, and examine the antimicrobial properties of novel Cu(II) and Au(III) complexes of 2,4-dithiouracil and its derivatives. These complexes were obtained by mixing aqueous solutions of the corresponding metal salts with the ligand [...] Read more.
The goal of this study is to synthesize, determine the structure, and examine the antimicrobial properties of novel Cu(II) and Au(III) complexes of 2,4-dithiouracil and its derivatives. These complexes were obtained by mixing aqueous solutions of the corresponding metal salts with the ligand dissolved in DMSO and aqueous NaOH, using a metal-to-ligand ratio of 1:4:2. The structures of the new compounds were analyzed by melting point determination, microwave plasma atomic emission spectrometry (MP-AES) for Cu and Au, inductively coupled plasma optical emission spectrometry (ICP-OES) for S, attenuated total reflection (ATR), solution and solid-state NMR, and Raman spectroscopy. The data for 2,4-dithiouracil obtained from the 1H NMR, 13C NMR, distortionless enhancement by polarization transfer spectrum (DEPT-135), proton–proton homonuclear correlation spectrum (1H-1H COSY), long-range 1H-13C heteronuclear multiple bond correlation experiment (HMBC), and heteronuclear single quantum coherence spectra (HSQC) aided the interpretation of the NMR data for the gold and copper complexes. Furthermore, the antimicrobial effect of the free ligands and their complexes was assessed against Gram-positive and Gram-negative bacteria, as well as yeasts. Full article
(This article belongs to the Section Chemical and Molecular Sciences)
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20 pages, 639 KiB  
Review
Recent Advances in the Determination of Major and Trace Elements in Plants Using Inductively Coupled Plasma Optical Emission Spectrometry
by Marin Senila
Molecules 2024, 29(13), 3169; https://doi.org/10.3390/molecules29133169 - 3 Jul 2024
Cited by 13 | Viewed by 3845
Abstract
Interest in measuring major and trace elements in plants has increased in recent years because of growing concerns about the elements’ contribution to daily intakes or the health risks posed by ingesting vegetables contaminated by potentially toxic elements. The recent advances in using [...] Read more.
Interest in measuring major and trace elements in plants has increased in recent years because of growing concerns about the elements’ contribution to daily intakes or the health risks posed by ingesting vegetables contaminated by potentially toxic elements. The recent advances in using inductively coupled plasma atomic emission spectrometry (ICP-OES) to measure major and trace elements in plant samples are reviewed in the present work. The sample preparation before instrumental determination and the main advantages and limitations of ICP-OES are described. New trends in element extraction in liquid solutions using fewer toxic solvents and microextractions are observed in recently published literature. Even though ICP-OES is a well-established and routine technique, recent innovations to increase its performance have been found. Validated methods are needed to ensure the obtaining of reliable results. Much research has focused on assessing principal figures of merit, such as limits of detection, quantification, selectivity, working ranges, precision in terms of repeatability and reproducibility, and accuracy through spiked samples or certified reference materials analysis. According to the published literature, the ICP-OES technique, 50 years after the release of the first commercially available equipment, remains a powerful and highly recommended tool for element determination on a wide range of concentrations. Full article
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21 pages, 9618 KiB  
Article
Trace Elements Distribution in the k7 Seam of the Karaganda Coal Basin, Kazakhstan
by Aiman Kopobayeva, Irina Baidauletova, Altynay Amangeldikyzy and Nazym Askarova
Geosciences 2024, 14(6), 143; https://doi.org/10.3390/geosciences14060143 - 24 May 2024
Cited by 8 | Viewed by 2027
Abstract
We investigated the distribution patterns and evaluated the average contents of trace elements in the k7 seam of the Karaganda coal basin in Central Kazakhstan. This paper presents the results of studying the geochemistry of 34 elements in 85 samples of the [...] Read more.
We investigated the distribution patterns and evaluated the average contents of trace elements in the k7 seam of the Karaganda coal basin in Central Kazakhstan. This paper presents the results of studying the geochemistry of 34 elements in 85 samples of the k7 seam. The study employed a suite of advanced high-resolution analytical methods, including atomic emission spectrometry with inductively coupled plasma (ICP–OES) and mass spectrometry with inductively coupled plasma (ICP–MS), along with their processing and interpretation. It was determined that the concentrations of trace elements in the k7 seam are primarily associated with lithophile elements, revealing high concentrations of Li, V, Sc, Zr, Hf, and Ba. Additionally, increased concentrations of Nb, Ta, Se, Te, Ag, and Th were observed compared to the coal Clarke. Specific Nb(Ta)–Zr(Hf)–Li mineralization accompanied by a group of associated metals (Ba, V, Sc, etc.) was identified. The study revealed lateral and vertical heterogeneity of the rare elements’ distributions in coals, attributed to the formation dynamics of the coal basin. A correlation between Li and Al2O3 with a less positive relationship with K2O suggests the affinity of certain elements (Li, Ta, Nb, and Ba) to kaolinite. Clay layers showed increased radioactivity, with Th—13.2 ppm and U—2.6 ppm, indicating the possible presence of volcanogenic pyroclastic rocks characterized by radioactivity. Taken together, these data reveal the features of the rock composition of the source area, which is considered a mineralization source. According to geochemical data, it was found that the source area mainly consists of igneous felsic rocks, indicating that the formation occurred under conditions of a volcanic arc. This study’s novelty lies in estimating the average trace elements in the k7 seam, with elevated concentrations of certain elements that suggest promising prospects for industrial extraction from coals and coal wastes. These findings offer insights into considering coal as a potential source of raw material for rare metal production, guiding the industrial processing of key elements within coal. The potential extraction of metals from coal deposits, including from dumps, holds significance for industrial and commercial technologies, as processing critical coal elements can reduce disposal costs and mitigate their environmental impact. Full article
(This article belongs to the Topic Petroleum Geology and Geochemistry of Sedimentary Basins)
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18 pages, 7023 KiB  
Article
Physico-Chemical Properties of CdTe/Glutathione Quantum Dots Obtained by Microwave Irradiation for Use in Monoclonal Antibody and Biomarker Testing
by M. A. Ruiz-Robles, Francisco J. Solís-Pomar, Gabriela Travieso Aguilar, Maykel Márquez Mijares, Raine Garrido Arteaga, Olivia Martínez Armenteros, C. D. Gutiérrez-Lazos, Eduardo G. Pérez-Tijerina and Abel Fundora Cruz
Nanomaterials 2024, 14(8), 684; https://doi.org/10.3390/nano14080684 - 16 Apr 2024
Cited by 2 | Viewed by 2177
Abstract
In this report, we present the results on the physicochemical characterization of cadmium telluride quantum dots (QDs) stabilized with glutathione and prepared by optimizing the synthesis conditions. An excellent control of emissions and the composition of the nanocrystal surface for its potential application [...] Read more.
In this report, we present the results on the physicochemical characterization of cadmium telluride quantum dots (QDs) stabilized with glutathione and prepared by optimizing the synthesis conditions. An excellent control of emissions and the composition of the nanocrystal surface for its potential application in monoclonal antibody and biomarker testing was achieved. Two samples (QDYellow, QDOrange, corresponding to their emission colors) were analyzed by dynamic light scattering (DLS), and their hydrodynamic sizes were 6.7 nm and 19.4 nm, respectively. Optical characterization by UV-vis absorbance spectroscopy showed excitonic peaks at 517 nm and 554 nm. Photoluminescence spectroscopy indicated that the samples have a maximum intensity emission at 570 and 606 nm, respectively, within the visible range from yellow to orange. Infrared spectroscopy showed vibrational modes corresponding to the functional groups OH-C-H, C-N, C=C, C-O, C-OH, and COOH, which allows for the formation of functionalized QDs for the manufacture of biomarkers. In addition, the hydrodynamic radius, zeta potential, and approximate molecular weight were determined by dynamic light scattering (DLS), electrophoretic light scattering (ELS), and static light scattering (SLS) techniques. Size dispersion and the structure of nanoparticles was obtained by Transmission Electron Microscopy (TEM) and by X-ray diffraction. In the same way, we calculated the concentration of Cd2+ ions expressed in mg/L by using the Inductively Coupled Plasma Atomic Emission Spectrometry (ICP-OES). In addition to the characterization of the nanoparticles, the labeling of murine myeloid cells was carried out with both samples of quantum dots, where it was demonstrated that quantum dots can diffuse into these cells and connect mostly with the cell nucleus. Full article
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14 pages, 3841 KiB  
Article
Microstructure and Efflorescence Resistance of Metakaolin Geopolymer Modified by 5A Zeolite
by Yuwei Lu, Luxia Song, Yuan Xu, Ping Duan and Xiaoming Wang
Materials 2023, 16(22), 7243; https://doi.org/10.3390/ma16227243 - 20 Nov 2023
Viewed by 2112
Abstract
In order to reduce the degree of efflorescence in alkali-activated metakaolin geopolymers, a modified 5A zeolite with cation-exchange properties was used to reduce the content of free alkali metal cations in the geopolymer. This work aims to investigate the effect of different dosages [...] Read more.
In order to reduce the degree of efflorescence in alkali-activated metakaolin geopolymers, a modified 5A zeolite with cation-exchange properties was used to reduce the content of free alkali metal cations in the geopolymer. This work aims to investigate the effect of different dosages of modified 5A zeolite on the microstructure and properties of geopolymer by using compressive strength testing, pore structure analysis (BET), and SEM-EDS. The cation content in the leachate was evaluated using inductively coupled plasma atomic emission spectrometry (ICP-OES). The efflorescence area of the geopolymer was calculated using Image Pro Plus (IPP) software to evaluate the effect of modified 5A zeolite on the degree of efflorescence of the geopolymer and to reveal the effect of modified 5A zeolite on the migration patterns of Na+ and Ca2+ in the geopolymer. The results showed that modified 5A zeolite with a 4 wt.% content could optimize the pore structure and enhance the mechanical properties of MK geopolymer through internal curing and micro-aggregate effects, which could also exchange cations with the pore solution to form (N, C)-A-S-H gels. The Na+ leaching was reduced by 19.4%, and the efflorescence area of the MK geopolymer was reduced by 57.3%. Full article
(This article belongs to the Special Issue Mechanical Behaviour and Durability Performance of Concrete Materials)
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18 pages, 3306 KiB  
Article
Exposure Assessment of Essential and Potentially Toxic Metals in Wheat-Based Sweets for Human Consumption: Multivariate Analysis and Risk Evaluation Studies
by Mahmood Ahmed, Syed Salman Shafqat, Amna Javed, Mudassar Sanaullah, Abdul Shakoor, Muhammad Imtiaz Shafiq, Syeda Kiran Shahzadi, Tanveer A. Wani and Seema Zargar
Molecules 2023, 28(21), 7365; https://doi.org/10.3390/molecules28217365 - 31 Oct 2023
Cited by 16 | Viewed by 3158
Abstract
In recent years, there has been a growing concern about the negative impact of unforeseen contaminants such as metals in commonly consumed food items, which pose a threat to human well-being. Therefore, it is of utmost importance to evaluate the levels of these [...] Read more.
In recent years, there has been a growing concern about the negative impact of unforeseen contaminants such as metals in commonly consumed food items, which pose a threat to human well-being. Therefore, it is of utmost importance to evaluate the levels of these contaminants to guarantee the safe consumption of these food items. The goal of the current research is to determine the levels of essential (EMs: Mg, Ca, Mn, Fe, Co, Cu, and Zn) and potentially toxic metals (PTMs: Al, Cr, Ni, As, Cd, and Pb) in various brands of wheat-based sweets. One hundred samples were collected and analysed via flame atomic absorption spectrometry (FAAS) and inductively coupled plasma–optical emission spectrometry (ICP-OES). Also, the current study was to investigate the distribution, correlation, and multivariate analysis of 13 metals (Mg, Ca, Mn, Fe, Co, Cu, Zn, Al, Cr, Ni, As, Cd, and Pb). Hierarchical cluster analysis (HCA) and principal component analysis (PCA) were used to interpret the metals’ association. The concentration (mg/kg) ranges of EMs were, in order, Mg (12.70–65.67), Ca (24.02–209.12), Mn (1.32–9.61), Fe (4.55–111.23), Co (0.32–8.94), Cu (2.12–8.61), and Zn (2.60–19.36), while the concentration (mg/kg) ranges of PTMs were, in order, Al (0.32–0.87), Cr (0.17–5.74), Ni (0.36–1.54), Cd (0.16–0.56), and Pb (0.14–0.92), and As was not detected in any sample under investigation. The HCA data revealed that Co, Al, and Ni form clusters with other metals. Sweets are prepared at high temperatures, and the elevated temperatures can increase the likelihood of Ni and Al leaching from stainless steel. Tolerable dietary intake (TDI) values for Ni were higher than the values established by the European Food Safety Authority (EFSA). The CR value found for the Ni and Cr was at the threshold level of cancer risk, if an amount of 25 g were to be used over a lifetime. In a nutshell, this study highlights the monitoring of EM and PTM levels in wheat-based sweets, and from a food safety perspective, the study is important for consumers of wheat-based sweets. Full article
(This article belongs to the Section Analytical Chemistry)
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12 pages, 3282 KiB  
Article
Assessment of Cultivated Soil Contamination by Potentially Toxic Metals as a Result of a Galvanizing Plant Failure
by Anna Świercz, Mirosław Szwed, Łukasz Bąk, Adam Gawlik and Jakub Zamachowski
Sustainability 2023, 15(12), 9288; https://doi.org/10.3390/su15129288 - 8 Jun 2023
Cited by 4 | Viewed by 1828
Abstract
Zinc is one of the more mobile metals in the soil and thus involves the risk of entering the food chain. Zinc compounds are used in the galvanization process, which is assumed to be safe for the environment. However, random events or failures [...] Read more.
Zinc is one of the more mobile metals in the soil and thus involves the risk of entering the food chain. Zinc compounds are used in the galvanization process, which is assumed to be safe for the environment. However, random events or failures such as unsealing bathtubs with liquid zinc or hydrochloric acid, as well as violent fires in industrial halls, may pose a real threat to the environment, including human health. Therefore, this research was carried out to determine the content of zinc and selected potentially toxic metals in arable soils after a failure in a galvanizing plant located in the village of Dębska Wola (southeastern Poland). In addition, the potential risk associated with excessive accumulation of identified pollutants in the environment was assessed. In order to determine the level of contamination, soil samples were taken, and basic physical and chemical properties were analysed. The concentrations of Zn, Pb, and Cd in the soil were determined using the atomic emission spectrometry technique with inductively coupled plasma (ICP-OES), and pH measurements were performed using the potentiometric method after prior wet mineralisation of the research samples. The analysed samples had a varied pH of the organic–mineral horizon from pHH2O 4.66 to pHH2O 5.33 and from pHKCl 3.89 to pHKCl 5.06. As a result of a failure, toxic metal fumes were released into the atmosphere, causing concentrations of Zn in the soil samples from 0–5 cm in the range of 1201–2007 mg∙kg−1, as well as Pb (109–509 mg∙kg−1) and Cd (4.6–17 mg∙kg−1). High contents of zinc and lead found in several soil samples are of anthropogenic nature and require detailed monitoring in order to eliminate the risk associated with their accumulation. The study area should be re-analysed to determine the rate of reclamation of degraded soils. Full article
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17 pages, 4745 KiB  
Article
Formation of Gold Nanoclusters from Goldcarbonyl Chloride inside the Metal-Organic Framework HKUST-1
by Zeinab Mohamed Hassan, Wei Guo, Alexander Welle, Robert Oestreich, Christoph Janiak and Engelbert Redel
Molecules 2023, 28(6), 2716; https://doi.org/10.3390/molecules28062716 - 17 Mar 2023
Cited by 5 | Viewed by 2592
Abstract
Gas-phase infiltration of the carbonylchloridogold(I), Au(CO)Cl precursor into the pores of HKUST-1 ([Cu3(BTC)2(H2O)2], Cu-BTC) SURMOFs (surface-mounted metal-organic frameworks; BTC = benzene-1,3,5-tricarboxylate) leads to Au(CO)Cl decomposition within the MOF through hydrolysis with the aqua ligands on [...] Read more.
Gas-phase infiltration of the carbonylchloridogold(I), Au(CO)Cl precursor into the pores of HKUST-1 ([Cu3(BTC)2(H2O)2], Cu-BTC) SURMOFs (surface-mounted metal-organic frameworks; BTC = benzene-1,3,5-tricarboxylate) leads to Au(CO)Cl decomposition within the MOF through hydrolysis with the aqua ligands on Cu. Small Aux clusters with an average atom number of x ≈ 5 are formed in the medium-sized pores of the HKUST-1 matrix. These gold nanoclusters are homogeneously distributed and crystallographically ordered, which was supported by simulations of the powder X-ray diffractometric characterization. Aux@HKUST-1 was further characterized by scanning electron microscopy (SEM) and infrared reflection absorption (IRRA) as well as Raman spectroscopy, time-of-flight secondary ion mass spectrometry (ToF-SIMS), X-ray photoelectron spectroscopy (XPS) and inductively coupled plasma optical emission spectroscopy (ICP-OES). Full article
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15 pages, 1564 KiB  
Article
Quality of Phosphate Rocks from Various Deposits Used in Wet Phosphoric Acid and P-Fertilizer Production
by Urszula Ryszko, Piotr Rusek and Dorota Kołodyńska
Materials 2023, 16(2), 793; https://doi.org/10.3390/ma16020793 - 13 Jan 2023
Cited by 37 | Viewed by 6975
Abstract
Phosphate rocks (PRs) play a crucial role in ensuring the availability of phosphorous for the world’s food needs. PRs are used to manufacture phosphoric acid in the wet process as well as P-fertilizers. The chemical and mineralogical compositions of PRs from Djebel Onk [...] Read more.
Phosphate rocks (PRs) play a crucial role in ensuring the availability of phosphorous for the world’s food needs. PRs are used to manufacture phosphoric acid in the wet process as well as P-fertilizers. The chemical and mineralogical compositions of PRs from Djebel Onk (Algeria), Khneifiss (Syria), Negev (Israel), Bou Craa (Morocco), and Khouribga (Morocco) are discussed in this study. PRs were characterized by inductively coupled plasma optical emission spectrometry (ICP-OES), cold vapor atomic absorption spectrometry (CVAAS), ion chromatography (IC), and X-ray diffraction (XRD), as well as gravimetric and potentiometric methods. All PRs were mainly composed of CaO, P2O5, SiO2, F, SO3, Na2O, MgO, Al2O3, Fe2O3, SrO, and K2O at the level of wt.%. The P2O5 content accounted for 28.7–31.2%, which indicates that these are beneficial rocks to a marketable product. The degree of PR purity expressed by the minor elements ratio index (MER index) varied from 2.46% to 10.4%, and the CaO/P2O5 weight ratio from 1.6 to 1.9. In addition, the occurrence of trace elements such as As, Cd, Cr, Cu, Hg, Mn, Ni, Pb, Ti, V, U, and Zn, as well as Cr(VI) and Cl ions at the level of mg∙kg−1 was found. Since PRs will be used to produce P-fertilizers, their composition was compared with the regulatory parameters set up by EU Regulation 2019/1009 related to the heavy metals (As, Cd, Pb, Ni, Hg, Cu, Zn) and Cr(VI) contents in inorganic fertilizers. The heavy metals and Cr(VI) content in all PRs did not exceed the limit values. XRD analysis revealed that fluorapatite, hydroxyapatite, carbonate fluorapatite, and carbonate hydroxyapatite were the dominant minerals. The accuracy and precision of the used methods were evaluated by analysis of standard reference materials (SRM) for Western Phosphate Rock (NIST 694). The recovery was 85.3% for U and 109% for K2O, and the RSD ranged from 0.67% to 12.8%. Full article
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15 pages, 3612 KiB  
Article
Chemometric Approach Based on Explainable AI for Rapid Assessment of Macronutrients in Different Organic Fertilizers Using Fusion Spectra
by Mahamed Lamine Guindo, Muhammad Hilal Kabir, Rongqin Chen, Jing Huang, Fei Liu, Xiaolong Li and Hui Fang
Molecules 2023, 28(2), 799; https://doi.org/10.3390/molecules28020799 - 13 Jan 2023
Cited by 8 | Viewed by 3355
Abstract
Wet chemical methods are usually employed in the analysis of macronutrients such as Potassium (K) and Phosphorus (P) and followed by traditional sensor techniques, including inductively coupled plasma optical emission spectrometry (ICP OES), flame atomic absorption spectrometry (FAAS), graphite furnace atomic absorption spectrometry [...] Read more.
Wet chemical methods are usually employed in the analysis of macronutrients such as Potassium (K) and Phosphorus (P) and followed by traditional sensor techniques, including inductively coupled plasma optical emission spectrometry (ICP OES), flame atomic absorption spectrometry (FAAS), graphite furnace atomic absorption spectrometry (GF AAS), and inductively coupled plasma mass spectrometry (ICP-MS). Although these procedures have been established for many years, they are costly, time-consuming, and challenging to follow. This study studied the combination of laser-induced breakdown spectroscopy (LIBS) and visible and near-infrared spectroscopy (Vis-NIR) for the quick detection of PK in different varieties of organic fertilizers. Explainable AI (XAI) through Shapley additive explanation values computation (Shap values) was used to extract the valuable features of both sensors. The characteristic variables from different spectroscopic devices were combined to form the spectra fusion. Then, PK was determined using Support Vector Regression (SVR), Partial Least Squares Regression (PLSR), and Extremely Randomized Trees (Extratrees) models. The computation of the coefficient of determination (R2), root mean squared error (RMSE), and residual prediction deviation (RPD) showed that FUSION was more efficient in detecting P (R2p = 0.9946, RMSEp = 0.0649% and RPD = 13.26) and K (R2p = 0.9976, RMSEp = 0.0508% and RPD = 20.28) than single-sensor detection. The outcomes indicated that the features extracted by XAI and the data fusion of LIBS and Vis-NIR could improve the prediction of PK in different varieties of organic fertilizers. Full article
(This article belongs to the Special Issue Chemometrics in Analytical Chemistry)
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20 pages, 7789 KiB  
Article
Mechanical Properties and Microstructure Analysis of Cement Mortar Mixed with Iron Ore Tailings
by Junsheng Li, Wenyuan Ren, Aijun Zhang, Shuangcun Li, Jianping Tan and Hongtai Liu
Buildings 2023, 13(1), 149; https://doi.org/10.3390/buildings13010149 - 6 Jan 2023
Cited by 11 | Viewed by 2474
Abstract
In order to study the feasibility and sand substitution mechanism of cement mortar mixed with iron ore tailings (IOT), iron ore tailings cement mortars (referred to as IOTC) with IOT content of 0%, 25%, and 50% were made and tested. First, the basic [...] Read more.
In order to study the feasibility and sand substitution mechanism of cement mortar mixed with iron ore tailings (IOT), iron ore tailings cement mortars (referred to as IOTC) with IOT content of 0%, 25%, and 50% were made and tested. First, the basic properties of IOT used were measured to verify the theoretical feasibility. Second, the uniaxial compressive and tensile strengths, as well as the crack resistance performance of IOTC under different curing ages and different sand substitution rates were tested. Third, the techniques of inductively coupled plasma atomic emission spectrometry (ICP-OES), X-ray diffraction (XRD), nuclear magnetic resonance (NMR), scanning electron microscopy and energy-dispersive spectroscopy (SEM-EDS) were used to study the influence of curing age and different sand substitution rates on the chemical, mineralogical, and microstructural characteristics of IOTC. The sand substitution mechanism of IOT was then discussed. The research results proved the feasibility of using IOT to substitute standard sand in cement mortar. Within substitution rate of 0–50%, the mechanical properties increased with the increase of substitution rate. Though limited chemical effects were found by adding IOT, in comparison with standard sand mortar, more hydration products were found and the pore size distribution was changed for IOTC, which corresponds to its mechanical improvement. Full article
(This article belongs to the Section Building Materials, and Repair & Renovation)
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