Understanding the interaction mechanisms of active compounds extracted from Tabernaemontana penduliflora on the surface of magnetite (111) nanoparticles in aqueous medium by DFT and MD approaches.

Computational techniques have been used to analyze the molecules of 10-hydroxycoronahydine (HC) and voacangine hydroxyindolenine (VH) molecules with the aim of studying the effect of base and temperature on their interaction mechanisms during synthesis green magnetite nanoparticles. Density functional theory (DFT) descriptors such as: energy gap, overall reactivity descriptors, dipole moment and adsorption energy have all been explored in depth to understand the nature of the interaction. The DFT results showed that the molecules studied (HC and VH) are interactive and stable in an aqueous medium, due to the fact that these molecules have free electronic doublets on the nitrogen atom and the bond of the aromatic ring.

Reduction of sludge formed during a coagulation treatment of Ridomil Gold by means of non-thermal quenched plasma pre-treatment.

Chemical coagulation and adsorption, despite many drawbacks, are actually the main techniques used for the removal of pollutants from aqueous solution; however, these techniques are becoming ineffective due to the exponential increase in the amount and complexity of discharged pollutants; thus, the sludge treatment process became a more complex challenge. The present study focuses on the way to reduce the quantity of sludge formed during the removal of Ridomil Gold, a widely used pesticide-fungicide in agriculture. Results revealed that pre-treatment of initial waste solution by the gliding arc (Glidarc), a source of non-thermal plasma, leads to a significant reduction of the sludge formed during the coagulation treatment.

Combined effects of long-living chemical species during microbial inactivation using atmospheric plasma-treated water.

Electrical discharges in humid air at atmospheric pressure (nonthermal quenched plasma) generate long-lived chemical species in water that are efficient for microbial decontamination. The major role of nitrites was evidenced together with a synergistic effect of nitrates and H(2)O(2) and matching acidification. Other possible active compounds are considered, e.

Impact on disinfection efficiency of cell load and of planktonic/adherent/detached state: case of Hafnia alvei inactivation by plasma activated water.

This paper describes the effects of initial microbial concentration and planktonic/adherent/detached states on the efficiency of plasma-activated water. This disinfecting solution was obtained by treating distilled water with an atmospheric pressure plasma produced by gliding electric discharges in humid air. The inactivation kinetics of planktonic cells of Hafnia alvei (selected as a bacterial model) were found to be of the first order.

Evidence of temporal postdischarge decontamination of bacteria by gliding electric discharges: application to Hafnia alvei.

This study aimed to characterize the bacterium-destroying properties of a gliding arc plasma device during electric discharges and also under temporal postdischarge conditions (i.e., when the discharge was switched off).