Degradation of xanthene-based dyes by photoactivated persulfate: experimental and computational studies.

Dyes are naked-eye detectable even at low concentration levels and can cause environmental damage when released into aquatic effluents; therefore, methods for removing the residual color from the aquatic media are always a current issue. In this paper, degradation of three xanthene dyes, Rhodamine B, Eosin Y, and Sodium Fluorescein, using photoactivated persulfate was evaluated at pH 3.0 and 11.0. The dyes' degradation followed a pseudo-first-order reaction. Although the solution is completely decolorized in 40 min at pH 3.0, achieving 75% mineralization requires a longer reaction time of 180 min. Furthermore, GC-MS analyses indicate that degradation products are mainly low-molecular weight acids, CO2 and H2O. Experiments carried out in dark and under UV irradiation showed substantial contribution of radical (SO4•- and HO•) and non-radical pathways to dye degradation in both pH. Additionally, to get more insights into the degradation pathways, HOMO-LUMO energy gaps of the dyes were calculated by DFT using MPW1PW91/MidiXo level of theory and, in general, the lower the bandgap, the faster the degradation. Fukui functions revealed that the preferential sites to radical attack were the xanthene or the benzoate portion depending on the pH, wherein attack to the xanthene ring provided better kinetic and mineralization results.

Treatment influence on green coconut shells for removal of metal ions: pilot-scale fixed-bed column.

This work investigates copper, nickel and zinc ion biosorption in single- and multi-component systems in a fixed-bed column using green coconut shells (CS). Approximately 85% of biosorbents are in a particle size ranging from 0.25 to 2 mm. Operational parameters selected include a flow rate of 200 mL min-1 and a bed height of 100 cm, which were selected for a shorter execution time and good adsorption capacity. Empty-bed contact time and Thomas models were applied, showing a good fit with the experimental data. The column adsorption capacity increased after the green CS powder was treated in a column with NaOH at a concentration of 0.1 mol L-1. The highest values of adsorption capacities founded were 0.69, 0.45 and 0.39 mmol L-1 for Cu(II), Ni(II) and Zn(Il), respectively, using green CS treated inside a column with NaOH of 0.1 M. The pH and chemical oxygen demand were monitored in the treatment solution and indicated that the adjustment of these parameters is necessary before disposal of these solutions. A study of desorption using an acid solution was carried out for recovery of metal ions.