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• W1982933738 abstract "The mutual effects of Cu(II) and phosphate on their interaction with γ-Al2O3 are investigated by using batch experiments combined with density functional theory (DFT) calculations. The results of batch experiments show that coexisting phosphate promotes the retention of Cu(II) on γ-Al2O3, whereas phosphate retention is not affected by coexisting Cu(II) at low initial phosphate concentrations (≤3.6 mg P/L). Cu-phosphate aqueous complexes control Cu(II) retention through the formation of type B ternary surface complexes (where phosphate bridges γ-Al2O3 and Cu(II)) at pH 5.5. This deduction is further supported by the results of DFT calculations. More specifically, the DFT calculation results indicate that the type B ternary surface complexes prefer to form outer-sphere or monodentate inner-sphere binding mode under our experimental conditions. The enhancement of phosphate retention on γ-Al2O3 in the presence of Cu(II) at high initial phosphate concentrations (>3.6 mg P/L) may be attributed to the formation of 1:2 Cu(II)-phosphate species and/or surface precipitates. Understanding the mutual effects of phosphate and Cu(II) on their mobility and transport in mineral/water environments is more realistic to design effective remediation strategies for reducing their negative impacts on aquatic/terrestrial environments." @default.
• W1982933738 created "2016-06-24" @default.
• W1982933738 creator A5018343864 @default.
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• W1982933738 date "2012-10-01" @default.
• W1982933738 modified "2023-10-16" @default.
• W1982933738 title "Mutual effects of copper and phosphate on their interaction with γ-Al2O3: Combined batch macroscopic experiments with DFT calculations" @default.
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• W1982933738 doi "https://doi.org/10.1016/j.jhazmat.2012.08.032" @default.
• W1982933738 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/22954600" @default.
• W1982933738 hasPublicationYear "2012" @default.
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