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Experimental and Simulation Studies on Hematite Interaction with Na-Metasilicate Pentahydrate

Iron ore is a fundamental pillar in construction globally, however, its process is highly polluting and deposits are becoming less concentrated, making reusing or reprocessing its sources a sustainable solution to the current industry. A rheological analysis was performed to understand the effect of...

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Autores principales: Quezada, Gonzalo R., Toro, Norman, Krishna, R. S., Mishra, Subhabrata, Robles, Pedro, Salazar, Ivan, Mathe, Enoque, Jeldres, Ricardo I.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10142535/
https://www.ncbi.nlm.nih.gov/pubmed/37110863
http://dx.doi.org/10.3390/molecules28083629
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author Quezada, Gonzalo R.
Toro, Norman
Krishna, R. S.
Mishra, Subhabrata
Robles, Pedro
Salazar, Ivan
Mathe, Enoque
Jeldres, Ricardo I.
author_facet Quezada, Gonzalo R.
Toro, Norman
Krishna, R. S.
Mishra, Subhabrata
Robles, Pedro
Salazar, Ivan
Mathe, Enoque
Jeldres, Ricardo I.
author_sort Quezada, Gonzalo R.
collection PubMed
description Iron ore is a fundamental pillar in construction globally, however, its process is highly polluting and deposits are becoming less concentrated, making reusing or reprocessing its sources a sustainable solution to the current industry. A rheological analysis was performed to understand the effect of sodium metasilicate on the flow curves of concentrated pulps. The study was carried out in an Anton Paar MCR 102 rheometer, showing that, in a wide range of dosages, the reagent can reduce the yield stress of the slurries, which would result in lower energy costs for transporting the pulps by pumping. To understand the behavior observed experimentally, computational simulation has been used by means of quantum calculations to represent the metasilicate molecule and the molecular dynamics to study the adsorption of metasilicate on the hematite surface. It has been possible to obtain that the adsorption is stable on the surface of hematite, where increasing the concentration of metasilicate increases its adsorption on the surface. The adsorption could be modeled by the Slips model where there is a delay in adsorption at low concentrations and then a saturated value is reached. It was found that metasilicate requires the presence of sodium ions to be adsorbed on the surface by means of a cation bridge-type interaction. It is also possible to identify that it is absorbed by means of hydrogen bridges, but to a lesser extent than the cation bridge. Finally, it is observed that the presence of metasilicate adsorbed on the surface modifies the net surface charge, increasing it and, thus, generating the effect of dispersion of hematite particles which experimentally is observed as a decrease in rheology.
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spelling pubmed-101425352023-04-29 Experimental and Simulation Studies on Hematite Interaction with Na-Metasilicate Pentahydrate Quezada, Gonzalo R. Toro, Norman Krishna, R. S. Mishra, Subhabrata Robles, Pedro Salazar, Ivan Mathe, Enoque Jeldres, Ricardo I. Molecules Article Iron ore is a fundamental pillar in construction globally, however, its process is highly polluting and deposits are becoming less concentrated, making reusing or reprocessing its sources a sustainable solution to the current industry. A rheological analysis was performed to understand the effect of sodium metasilicate on the flow curves of concentrated pulps. The study was carried out in an Anton Paar MCR 102 rheometer, showing that, in a wide range of dosages, the reagent can reduce the yield stress of the slurries, which would result in lower energy costs for transporting the pulps by pumping. To understand the behavior observed experimentally, computational simulation has been used by means of quantum calculations to represent the metasilicate molecule and the molecular dynamics to study the adsorption of metasilicate on the hematite surface. It has been possible to obtain that the adsorption is stable on the surface of hematite, where increasing the concentration of metasilicate increases its adsorption on the surface. The adsorption could be modeled by the Slips model where there is a delay in adsorption at low concentrations and then a saturated value is reached. It was found that metasilicate requires the presence of sodium ions to be adsorbed on the surface by means of a cation bridge-type interaction. It is also possible to identify that it is absorbed by means of hydrogen bridges, but to a lesser extent than the cation bridge. Finally, it is observed that the presence of metasilicate adsorbed on the surface modifies the net surface charge, increasing it and, thus, generating the effect of dispersion of hematite particles which experimentally is observed as a decrease in rheology. MDPI 2023-04-21 /pmc/articles/PMC10142535/ /pubmed/37110863 http://dx.doi.org/10.3390/molecules28083629 Text en © 2023 by the authors. https://creativecommons.org/licenses/by/4.0/Licensee MDPI, Basel, Switzerland. This article is an open access article distributed under the terms and conditions of the Creative Commons Attribution (CC BY) license (https://creativecommons.org/licenses/by/4.0/).
spellingShingle Article
Quezada, Gonzalo R.
Toro, Norman
Krishna, R. S.
Mishra, Subhabrata
Robles, Pedro
Salazar, Ivan
Mathe, Enoque
Jeldres, Ricardo I.
Experimental and Simulation Studies on Hematite Interaction with Na-Metasilicate Pentahydrate
title Experimental and Simulation Studies on Hematite Interaction with Na-Metasilicate Pentahydrate
title_full Experimental and Simulation Studies on Hematite Interaction with Na-Metasilicate Pentahydrate
title_fullStr Experimental and Simulation Studies on Hematite Interaction with Na-Metasilicate Pentahydrate
title_full_unstemmed Experimental and Simulation Studies on Hematite Interaction with Na-Metasilicate Pentahydrate
title_short Experimental and Simulation Studies on Hematite Interaction with Na-Metasilicate Pentahydrate
title_sort experimental and simulation studies on hematite interaction with na-metasilicate pentahydrate
topic Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10142535/
https://www.ncbi.nlm.nih.gov/pubmed/37110863
http://dx.doi.org/10.3390/molecules28083629
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