2022
DOI: 10.1016/j.mineng.2022.107668
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Utilization of a novel bisphosphonic acid surfactant for reverse froth flotation of magnesite and dolomite

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Cited by 17 publications
(6 citation statements)
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“…In this paper, the chemical properties of TPA + were analyzed at the atomic level using DFT to provide further insight into the interaction mechanism of the collector. A commonly used visual method to observe the electron distribution of molecules is the MEP . The HOMO and LUMO geometries of the analyzed TPA molecule after optimization and the MEP maps are shown in Figure .…”
Section: Resultsmentioning
confidence: 99%
“…In this paper, the chemical properties of TPA + were analyzed at the atomic level using DFT to provide further insight into the interaction mechanism of the collector. A commonly used visual method to observe the electron distribution of molecules is the MEP . The HOMO and LUMO geometries of the analyzed TPA molecule after optimization and the MEP maps are shown in Figure .…”
Section: Resultsmentioning
confidence: 99%
“…DFT calculations are a functional and reliable tool to optimize and calculate the structure of the collector molecule and predict the interaction between the collector and mineral. , The optimized geometric structures and maps of HOMO and LUMO and MEP maps of the DPA and DA are illustrated in Figure . The calculated net atomic charges of two collectors are illustrated in Table . …”
Section: Resultsmentioning
confidence: 99%
“…Zeta potential can reflect the adsorption of collector on mineral surface and the interaction between the collector and mineral in flotation. 47,50 Zeta potential of lepidolite and the interaction between lepidolite and DA and DPA is shown in Figure 8b. It could be seen that the isoelectric point of lepidolite occurs around pH = 3, which was consistent with the relevant report.…”
Section: ■ Introductionmentioning
confidence: 99%
“…Such an understanding is pivotal for comprehensively elucidating the flotation behaviors of these minerals under diverse conditions, deciphering the interactions between flotation chemicals and minerals, and advancing the efficacy of MT flotation separation. 16 This research focuses on the investigation of quartz, magnesite, dolomite, and calcite, utilizing the Materials Studio software based on density-functional theory to simulate the properties of mineral crystal structure, calculated energy bands, Mulliken population, electric charge density, density of states, and common cleavage surfaces. The outcomes of this research are of paramount significance as they contribute to a comprehensive understanding of the distinctions in the flotation properties among these four minerals from a fundamental perspective.…”
Section: Introductionmentioning
confidence: 99%
“…Consequently, achieving a systematic comprehension of the surface properties and surface electronic structures of quartz, magnesite, dolomite, and calcite at the atomic level holds substantial significance. Such an understanding is pivotal for comprehensively elucidating the flotation behaviors of these minerals under diverse conditions, deciphering the interactions between flotation chemicals and minerals, and advancing the efficacy of MT flotation separation 16 …”
Section: Introductionmentioning
confidence: 99%