Fabrication of a highly efficient CuO/ZnCo2O4/CNTs ternary composite for photocatalytic degradation of hazardous pollutants.

In the current study, CuO, ZnCo2O4, CuO/ZnCo2O4, and CuO/ZnCo2O4/CNTs photocatalysts were prepared to remove crystal violet (CV) and colorless pollutants (diclofenac sodium and phenol) from wastewater. Herein, sol-gel and co-precipitation methods were used to synthesize CuO and ZnCo2O4, respectively. The sonication method was used to synthesize CuO/ZnCo2O4 and a CNTs-based composite (CuO/ZnCo2O4/CNTs). From the UV-Vis spectra of CuO, ZnCo2O4, CuO/ZnCo2O4, and CuO/ZnCo2O4/CNTs, the optical band gap value was calculated to be 2.11, 2.18, 1.71 and 1.63 eV respectively. The photocatalytic results revealed that CuO/ZnCo2O4/CNTs exhibited higher degradation of 87.7% against CV dye, 82% against diclofenac sodium, and 72% against phenol as compared to other prepared photocatalysts. The OH˙ radical is identified as the active species in the photocatalytic process over CuO/ZnCo2O4/CNTs. The impact of several parameters, such as pH, concentration, and catalyst dosage, has also been investigated. The better activity of the CNTs-based composite was due to the synergic effect of both CuO/ZnCo2O4 nanocomposite and carbon nanotubes. Therefore, the synthesized CuO/ZnCo2O4/CNTs photocatalyst has the potential to degrade organic wastewater effluents effectively.

The degradation of bisphenol-A organic pollutant using the dispersal of TiO2 nanorods onto the partial reduction of graphene oxide nanosheets.

The notion of innovative combinations of semiconducting metal oxides for photocatalytic destruction is a key factor in the removal of environmental contaminants. However, for the first time, the combination was made possible for the aforementioned reason by embedding one-dimensional titanium dioxide (TiO2) semiconductor nanorods on two-dimensional rGO (reduced graphene oxide) nanosheets utilizing hydrothermal and a modified Hummers' method. By applying several sophisticated procedures, the properties of these catalysts were found, and then the degradation of BPA (bisphenol-A) was examined with UV and visible light sources. Further, all the analyses were performed on pure TiO2 material. As a result of the synergistic interaction between TiO2 and rGO, the rGO-TiO2 catalyst produced a favorable photocatalytic outcome. The structural investigation of rGO-TiO2 has confirmed that the TiO2 was in anatase phase along with GO and rGO peaks, and the morphological characterization showed that the TiO2 nanorods were integrated randomly into the rGO nanosheets along with defective sites. Also, adding rGO to TiO2 causes charge separation, and π-π interactions to improve the visible light absorption range. In this study, the main model organic component in the photocatalytic degradation is bisphenol-A (BPA). During visible light irradiation, the OH radicals were finally produced by the redox reactions. Furthermore, the rGO surface adsorbs the phenol molecules due to graphene π-π interactions, thus narrowing the band gap and increasing the efficiency of BPA degradation.

Biochar supported nano core-shell (TiO2/CoFe2O4) for wastewater treatment.

The porous structure of biochar, its large surface area, and its anti-oxidant properties are extensively used for pollutant removal strategies. The literature to date has reported that the biochar assisted metal-oxide core-shells have a dominating degradation ability under solar irradiation. Therefore, this study is significantly focused on cinnamon biochar as an active anti-oxidant agent incorporated in titania-cobalt ferrite nanocore-shell (Biochar/TiO2/CoFe2O4) structures for the first time in wastewater treatment against chlorophenol pollutants. Pure materials, core-shells, and biochar aided composites were synthesized by chemical methods, and their characteristics were analyzed using various instrumentation techniques. The diffraction outcomes of Biochar/TiO2/CoFe2O4 showed the mixed phases containing biochar, TiO2, and CoFe2O4. The morphological characteristics revealed that the biochar creates porosity and a peripheral layer covering the core-shell. Meanwhile, absorption studies of TiO2/CoFe2O4 core-shell and Biochar/TiO2/CoFe2O4 samples achieved 65% and 92% degradation efficiencies when exposed to visible light against chlorophenol pollutants, respectively. All these results confirm the presence of distinct functional groups as well as the combined synergistic effects that activated the charge separation, resulting in the successful destruction of water pollutants. In addition, the highly efficient Biochar/TiO2/CoFe2O4 sample was recycled, and the efficiency was maintained stable for five repeated degradation processes. Thus, Biochar/TiO2/CoFe2O4 will be utilized to expand the possibilities for biofuel generation and energy storage devices.

Nanosized core-shell (NiFe2O4/TiO2) heterostructure for enhanced photodegradation against polycyclic aromatic hydrocarbons.

The global level of attention has been raised for photocatalytic pollutant removal technologies for degrading organic pollutants because of rising concerns about their toxicity. In this study, NiFe2O4/TiO2 core shells and pure samples of NiFe2O4 and TiO2 were synthesized using the sol-gel process and used to degrade naphthalene which is one among the polycyclic aromatic hydrocarbons (PAHs) pollutant. The synthesized materials were evaluated using a variety of analytical techniques, and the typical NiFe2O4/TiO2 core-shell results showed good purity and a lack of other impurity structures. Through morphological characterization, the core-shell structure of NiFe2O4/TiO2 has been established. However, the activity of visible light degradation was boosted by the generation of hydroxyl radicals after the electron-hole pair was delayed. Additionally, a lower band gap in NiFe2O4/TiO2 than in pure materials promotes photocatalytic activity. Similarly, photocatalytic naphthalene elimination by the core-shell achieved 67% efficiency after 150 min of visible light exposure. Furthermore, the produced core-shell has a high magnetic property, making separation from the photo-irradiated solutions easier; as a result, recycling was likely successful up to three cycles. The photocatalytic mechanism of the NiFe2O4/TiO2 composite was proposed. This research could also be applied to the degradation of other polycyclic aromatic hydrocarbon contaminants.

Evaluation of F-18 FDG radiopharmaceuticals through Molecular Docking and radiation effects.

Fluorodeoxyglucose (FDG), marked with the most used Positron Emission Tomography (PET) radiopharmaceutical Fluorine-18 (F-18), is a glucose analog and is taken to living cells through membrane glucose carriers. F-18 FDG involvement in tissue is proportional to glucose use. In many cancers, there is increased glucose use due to increased gluten expression and hexokinase activity. F-18 FDG PET is a proven method for diagnosis, staging, re-staging, and evaluation of treatment response in oncology. The purpose of this study is to find the effect of ionizing radiation on proteins in the mechanism of action of FDG and determine to Molecular mechanisms of F-18 FDG accumulation in metabolism. In the study, two different models were used together, the first method, the study was Molecular Docking method for modeling molecules deconstructed and the structure of FDG was energy minimized by utilizing the density functional theory, and the B3LYP functional was used with 6-311G basis set. The second method was the Monte Carlo method for modeling ionizing radiation interactive with the potential routes of FDG metabolism within the cell. It was determined that the Gibbs free energy (ΔG) change was compatible with the ionizing radiation factors for binding of FDG to the aphthous regions of Glucose-6-phosphate isomerase (G1), hexokinase (G2), and glucose transporter-1 (G3) were selected. In this study, the strong binding of FDG to protein influences the effect of radiation on the active site of enzymes. The G1 and G3 shown in the study interacted with only one charged amino acid FDG, and the absence of an aromatic residue around it can be considered among the results of this study as the cause of the low protective effect against ionizing radiation.

Ab-initio Study of structural, elastic, electronic and optical properties of hexahalometallate single crystals K2XBr6(X = Se, Pt).

Some physical properties of hexahalometallate K2XBr6(X = Se, Pt) were computed in the zinc blend structure using GGA-PBESOL. The cell constant of K2SeBr6 and K2PtBr6 is consistent to the experiment value quoted in the literature, where the error is 0.95% and 1%. K2SeBr6 and K2PtBr6 present covalent bonding, high anisotropy and are ductile. The elastic constants of K2SeBr6 and K2PtBr6 are significantly smaller due to their larger reticular distances, lower Coulomb forces and then they are soft and damage tolerant. The interatomic separation is greater in K2SeBr6 than in K2PtBr6, hence the Coulomb interaction in K2PtBr6 is greater than that of K2SeBr6. The internal coordinate of Br atom in K2PtBr6 is lower than that of the same atom in K2SeBr6, and this can be explained by the fact that it is inversely proportional to the atom radius of Se and Pt. There are two major plasmonic processes, with intensities 3.7 and 1.35 located around 53.5 nm and 72.8 nm for K2SeBr6 and K2PtBr6.

Selective Mechanical Transfer Deposition of Langmuir Graphene Films for High-Performance Silver Nanowire Hybrid Electrodes.

In this work, we present silver nanowire hybrid electrodes prepared through the addition of small quantities of pristine graphene by mechanical transfer deposition from surface-assembled Langmuir films. This technique is a fast, efficient, and facile method for modifying the optoelectronic performance of AgNW films. We demonstrate that it is possible to use this technique to perform two-step device production by selective patterning of the stamp used, leading to controlled variation in the local sheet resistance across a device. This is particularly attractive for producing extremely low cost sensors on arbitrarily large scales. Our aim is to address some of the concerns surrounding the use of AgNW films as replacements for indium tin oxide (ITO), namely, the use of scarce materials and poor stability of AgNWs against flexural and environmental degradation.