Anticorrosive coating based on poly(vinyl acetate) formed by electropolymerization on the copper surface

The poly(vinyl acetate) (PVAC) film was obtained by electropolymerization on the copper electrode using cyclic voltammetry performed in mixed electrolyte based on water/ethyl alcohol/acetic acid containing vinyl acetate (VAc) and benzoyl peroxide as polymerization initiator. The coatings were characterized by optical microscopy, scanning electron microscopy (SEM) and infrared (IR) spectroscopy. The corrosion was induced in hydrochloric acid solution using potentiodynamic measurements and electrochemical impedance spectroscopy (EIS). The microscopic and SEM images revealed the PVAC coating formation and IR spectroscopy confirmed that it exhibits the same characteristic bands as a standard PVAC sample. From the potentiodynamic polarization, the PVAC protective performance of 78% was computed. The EIS measurements showed the occurrence of the surface adsorbed layer with a higher impedance response to the frequency and a phase angle maximum shifted to lower values than those of uncoated samples. In addition, the VAc electropolymerization mechanism was discussed and the PVAC adsorption mechanism on the copper surface was proposed. © 2018 Wiley Periodicals, Inc. J. Appl. Polym. Sci. 2019 , 136, 47320.     

Nanotube transistors as direct probes of the trap dynamics at dielectric-organic interfaces of interest in organic electronics and solar cells

The high sensitivity of nanotube transistors is used for the first time as a probe to study charge dynamics at a dielectric/polymer (polythiophene) interface, an inorganic/organic junction of particular importance for organic solar cells, and organic field effect transistors (OFETs). A carbon nanotube field effect transistor is coated with a thin film of a photoconductive polymer and photoexcited so as to generate carriers in the structure. Comparison between devices using SiO2 and TiO2 as gate dielectric reveals the critical role of the dielectric and clearly elucidates the relative contributions of the polymer and the dielectric layers on the separation, trapping, and relaxation of photogenerated charges.     

Catalytic Activity of Thallium on Electrochemical Degradation of Metronidazole from Aqueous Solutions

The platinum/thallium electrode was prepared by thallium electrodeposition on platinum substrate in order to use it for the increase of the electrochemical degradation rate of some drugs, such as, in our study, metronidazole (MNZ). The platinum/thallium electrode was characterized by chronoamperometry, electrochemical impedance spectroscopy (EIS), and scanning electron microscopy coupled with energy-dispersive X-ray spectroscopy. 2D progressive nucleation mechanism of thallium layer development was found by chronoamperometry. The value of charge transfer resistance of 537.2 Ω cm² and the double-layer capacitance value of 2.9 mF cm^?2 were deduced by EIS. The scanning electron microscopy showed a relatively fine-grained structure and the uniform distribution of the thallium granules. The electrochemical degradation of metronidazole has been performed using galvanostatic technique associated with UV-Vis spectrophotometry. The degradation degree of metronidazole reached a higher level on platinum/thallium electrode than that on platinum plate, indicating its improved performance and electrocatalytic activity of thallium coating. Moreover, the electrochemical degradation mechanism of this drug was proposed, the best way to fit the experimental data being the kinetics model of the first-order reactions.     

Anodic passivity of some titanium base alloys in aggressive environments

The passivity of titanium, binary Ti‐15Mo and ternary Ti‐15Mo‐5Al alloys in hydrochloric acid solutions was studied by potentiostatic, potentiodynamic, linear polarization and electrochemical impedance spectroscopy (EIS) techniques. The anodic passivity of binary Ti‐15Mo and ternary Ti‐15Mo‐5Al titanium alloys differs from that of the base metal in hydrochloric acid solutions. The corrosion potentials of both alloys are nobler than of the titanium because the beneficial effect of molybdenum. The critical passivation current density for binary Ti‐15Mo alloy is higher than of titanium; this fact can be explained by the instability of the constituent phases in hydrochloric acid solutions. Ternary Ti‐15Mo‐5Al alloy exhibits two critical passivation current densities (i_cr1 and i_cr2) with higher values than of the base metal and two critical passivation potentials (E_cr1 and E_cr2); at the first critical passivation potential (E_cr1) the porous titanium trioxide (Ti₃O₅) is formed and at the second critical passivation potential (E_cr2) this oxide is converted to a still higher valence oxide, the compact and protective titanium dioxide (TiO₂). The dissolution current densities in the passive range of alloys are higher than of the base metal due the dissolution of the alloying elements in this potential range. The alloys are more resistant than titanium presenting lower corrosion rates. A three time constants equivalent circuit was fitted: one time constant is for the double layer capacity (C_dl) and for the passive film (R_p); another time constant is for the charge transfer reactions visualised by a constant phase element (CPE) and a resistance (R₁); the third time constant is for diffusion processes through the passive film represented by a resistance (R₂) and a Warburg element (W).     

Double Variational Binding—(SMILES) Conformational Analysis by Docking Mechanisms for Anti-HIV Pyrimidine Ligands

Variational quantitative binding–conformational analysis for a series of anti-HIV pyrimidine-based ligands is advanced at the individual molecular level. This was achieved by employing ligand-receptor docking algorithms for each molecule in the 1,3-disubstituted uracil derivative series that was studied. Such computational algorithms were employed for analyzing both genuine molecular cases and their simplified molecular input line entry system (SMILES) transformations, which were created via the controlled breaking of chemical bonds, so as to generate the longest SMILES molecular chain (LoSMoC) and Branching SMILES (BraS) conformations. The study identified the most active anti-HIV molecules, and analyzed their special and relevant bonding fragments (chemical alerts), and the recorded energetic and geometric docking results (i.e., binding and affinity energies, and the surface area and volume of bonding, respectively). Clear computational evidence was also produced concerning the ligand-receptor pocket binding efficacies of the LoSMoc and BraS conformation types, thus confirming their earlier presence (as suggested by variational quantitative structure-activity relationship, variational-QSAR) as active intermediates for the molecule-to-cell transduction process.     

Post-dryout heat transfer to high-pressure water flowing upward in vertical channels with various flow obstacles

Post-dryout heat transfer to high pressure water was investigated experimentally in vertical tubes and annuli containing various flow obstacles. The operational conditions during the experiments were as follows: mass flux from 500 to 1750 kg/m² s, pressure from 5 to 9 MPa, inlet subcooling from 10 to 40 K and heat flux up to 1.5 MW/m². Five different test sections were used in experiments: three annular test sections with inner diameter 12.7 mm and outer diameter 24.3 mm, containing cylindrical and grid flow obstacles in the upper part, and two tubular test sections with inner diameter 24.3 mm with and without pin flow obstacles. The heated length in all test sections was 3650 mm. The wall temperature was measured with 88 thermocouples located along the inner rod and the outer tube surfaces. Due to the presence of flow obstacles, only developing post-dryout heat transfer was observed. Selected post-dryout heat transfer correlations were compared to the experimental data. It has been concluded that all tested correlations predict significantly higher wall temperatures than those obtained in the present experiment. A simple correction function to the Saha model has been suggested which significantly improves the agreement between the correlation and the present data.     

Eco-friendly flame retardant epoxy nanocomposites based on polyphosphonate and halloysite nanotubes

The preparation of a novel polyphosphonate (PSFR) is described here, starting from phenylphosphonic dichloride and an equimolecular mixture containing equal amounts of two bisphenols, namely 4,4′-dihydroxydiphenyl sulfone and 2-(6-oxido-6H-dibenzo<c,e><1,2>oxaphosphorin-6-yl)-1,4-benzenediol, following the polycondensation reaction in solution. Then, new environmental-friendly nanocomposites having improved flame retardancy have been prepared by incorporating PSFR and halloysite nanotubes (HNTs) into epoxy resin. The effect of PSFR and HNTs contents on the chemical and physical characteristics of epoxy nanocomposites was investigated. The success of the reactions was monitored by infrared spectroscopy (FTIR) while microscopic related techniques (SEM) gave information on the morphology of the products. The thermosets exhibit glass transition temperatures in the range of 62.4–97.1°C and thermal decomposition temperatures in the interval of 296–359°C. The appearance of the char residues obtained by pyrolysis was studied by SEM measurements. The flammability behavior has been studied by microscale combustion calorimetry (MCC) tests. A considerable improvement in the flame retardancy of the thermosets was obtained by simultaneous incorporation of HNTs (10 wt%) and PSFR (equivalent of 1 wt% P) into epoxy resin.     

Combination of freeze drying and molecular inclusion techniques improves the bioaccessibility of microencapsulated anthocyanins from black rice (Oryza sativa L.) and lavender (Lavandula angustifolia L.) essential oils in a model food system

Black rice and lavender are promising sources of bioactives, in terms of anthocyanins and essential oils. Their bioaccessibility were improved by microencapsulation, followed by mixing in order to benefit both from colour and flavour, along with radical scavenging and biological properties. The mixed powder showed a satisfactory anthocyanins of 2.55 mg g⁻¹ DW, leading to a radical scavenging activity of 65.14 mmol g⁻¹ DW. The powder displayed an inhibitory effect against α-glucosidase (~49%) and α-amylase (39%), respectively, with a controlled release in intestinal environment. To further examine the functional properties, the powder was added to a food model system. During storage, a release in anthocyanins and flavonoids were found, leading to an increase in radical scavenging activity. The sensorial analysis showed that supplemented biscuits were appreciated for colour and lavender aroma. The obtained results were promising in tailoring the health benefits of secondary metabolites, underutilised in human’s nutrition due to their low stability and bioavailability.