Defects-engineered tailoring of tri-doped interlinked metal-free bifunctional catalyst with lower gibbs free energy of OER/HER intermediates for overall water splitting

Controllable tailoring of metal-free/carbon-based nanostructures tends an encouraging way to enhance the bifunctional activity of electrodes, but a great challenge owing to the sluggish kinetics of oxygen evolution reaction (OER) and hydrogen evolution reaction (HER). Herein, a facile tempted-defects assisted fractionation strategy is presented to synthesize N, S, and O tri-doped metal-free catalyst (DE-TDAP). Due to this effective tempted-defects and heteroatoms interlinking in DE-TDAP, it delivers the lowest overpotential toward both the OER (346 mV) and HER (154 mV) at 10 mA cm^?2. Remarkably, the DE-TDAP-electrode carries only a cell voltage of 1.81 V at 10 mA cm^?2 for overall water splitting and long-term stability. Considerably, the density functional theory (DFT) calculation exposes that the tailored-defects in tri-doped interlinking could enhance bifunctional catalytic performance devising from lower Gibbs free energy of OER/HER intermediates on active sites. This struggle henceforth provides a perceptive understanding of the synergetic principles of heteroatom-interlinking-tailoring nanostructures in water splitting.     

Toxicity of Zn-Fe Layered Double Hydroxide to Different Organisms in the Aquatic Environment

The application of layered double hydroxide (LDH) nanomaterials as catalysts has attracted great interest due to their unique structural features. It also triggered the need to study their fate and behavior in the aquatic environment. In the present study, Zn-Fe nanolayered double hydroxides (Zn-Fe LDHs) were synthesized using a co-precipitation method and characterized by X-ray diffraction (XRD), Fourier transform infrared spectroscopy (FT-IR), scanning electron microscopy (SEM), and nitrogen adsorption-desorption analyses. The toxicity of the home-made Zn-Fe LDHs catalyst was examined by employing a variety of aquatic organisms from different trophic levels, namely the marine photobacterium Vibrio fischeri, the freshwater microalga Pseudokirchneriella subcapitata, the freshwater crustacean Daphnia magna, and the duckweed Spirodela polyrhiza. From the experimental results, it was evident that the acute toxicity of the catalyst depended on the exposure time and type of selected test organism. Zn-Fe LDHs toxicity was also affected by its physical state in suspension, chemical composition, as well as interaction with the bioassay test medium.     

A Pencil Graphite Electrode In Situ Modified by Monovalent Copper: a Promising Tool for the Determination of Methylxanthines

A pencil graphite electrode (PeGE) exhibits a promising tool for the electrochemical analysis of xanthine (Xan) and its N‐methyl derivatives (1‐, 3‐, 7‐ and 9‐mXan). The changes in their level in blood, serum, urine, as products of purine catabolism, can indicate the development of some diseases. Sensitivity‐enhanced voltammetric detection of mXans was achieved by forming of complex with Cu(I) and application of elimination procedure. The Cu(I)‐mXan complex was identified by means of titration of electrochemically produced cuprous ions by mXan. Our approach enables separation of overlapped mXan oxidation signals. Based on the obtained results, we found that the effect of methyl group position on the xanthine skeleton was significant and it was also discussed.     

Dyeing of cotton with thyme and pomegranate peel

Application of natural dyes for textiles is increasing due to awareness of environment, ecology, and pollution control. The purpose of this study is to determine the color, antimicrobial, and fastness properties of cotton fabrics dyed with thyme and pomegranate peel without a mordanting process. In this way, it was planned to avoid use of metallic mordants (heavy-metal salts) and prevent heavy-metal pollution for ecological production. Additionally, a variety of the most commonly used mordants, namely potassium aluminum sulfate, copper(II) sulfate, iron(II) sulfate, and tin(II) chloride, were used for mordanting of cotton fabrics in order to compare the differently mordanted and unmordanted dyed fabrics’ color efficiencies (K/S) and CIE L ^* a ^* b ^* color values. It was found that mordant type had an effect on color efficiency and the color coordinates of fabrics dyed with both thyme and pomegranate fruit peel. Moreover, the antimicrobial properties of the fabrics only dyed directly with thyme and pomegranate peel without any mordanting process were determined to demonstrate the usability of these natural dye sources without use of any mordanting agents. The obtained antimicrobial activities were compared with undyed samples. Undyed samples showed no antimicrobial activity, whereas significant antimicrobial activity was obtained after the dyeing procedure using thyme and pomegranate peel on unmordanted fabrics. Washing, rubbing, perspiration, and lightfastness properties of dyed fabrics were also evaluated. Thyme and pomegranate fruit peel as natural dye sources revealed sufficient results even for unmordanted samples.     

Backtracking and exchange of information: Methods to enhance a beam search algorithm for assembly line scheduling

Beam search (BS) is used as a heuristic to solve various combinatorial optimization problems, ranging from scheduling to assembly line balancing. In this paper, we develop a backtracking and an exchange-of-information (EOI) procedure to enhance the traditional beam search method. The backtracking enables us to return to previous solution states in the search process with the expectation of obtaining better solutions. The EOI is used to transfer information accumulated in a beam to other beams to yield improved solutions.     

Phase diagrams in mixed spin-3/2 and spin-2 Ising system with two alternative layers within the effective-field theory

The phase diagrams in the mixed spin-3/2 and spin-2 Ising system with two alternative layers on a honeycomb lattice are investigated and discussed by the use of the effective-field theory with correlations. The interaction of the nearest-neighbour spins of each layer is taken to be positive (ferromagnetic interaction) and the interaction of the adjacent spins of the nearest-neighbour layers is considered to be either positive or negative (ferromagnetic or anti-ferromagnetic interaction). The temperature dependence of the layer magnetizations of the system is examined to characterize the nature (continuous or discontinuous) of the phase transitions and obtain the phase transition temperatures. The system exhibits both second-and first-order phase transitions besides triple point (T P ), critical end point (E), multicritical point (A), isolated critical point (C) and reentrant behaviour depending on the interaction parameters. We have also studied the temperature dependence of the total magnetization to find the compensation points, as well as to determine the type of behaviour, and N-type behaviour in N′eel classification nomenclature existing in the system. The phase diagrams are constructed in eight different planes and it is found that the system also presents the compensation phenomena depending on the sign of the bilinear exchange interactions.     

Cascade-exciton model analysis of level density parameter dependence in proton induced fission cross sections of some sub-actinide nuclei

Fission cross sections strongly depend on the ratio of the level density parameter in fission to neutron emission, a_f/a_n. In this work, a cascade-exciton model implemented in the code CEM95 has been used to observe this effect for proton induced fission cross sections of tungsten, lead and bismuth. The method was employed using different level density parameter ratios for each fission cross section calculation. The calculated fission cross sections are compared with the available experimental data in the literature. It has been observed that a change of the ratio of the level density parameter, a_f/a_n, is necessary with the incident energy of the proton, to best estimate the fission cross sections in CEM95.     

Selective O-demethylation during bromination of (3,4-dimethoxyphenyl)(2,3,4-trimethoxyphenyl)methanone

(3,4-Dimethoxyphenyl)(2,3,4-trimethoxyphenyl)methanone was synthesized and its bromination was investigated in different conditions. Nine new products (bromophenol derivatives) were isolated in the reactions. These bromophenol derivatives were obtained by selective O-demethylation in its bromination with bromine. The products and their formations were discussed.     

Terahertz spectroscopy of AuFe spin glasses

The electrodynamic response of spin glasses (in the form of thin AuFe films) in the terahertz frequency range has been studied using backward-wave oscillator (BWO) spectroscopy (10–40 cm^?1) and optical ellipsometry (5000–33000 cm^?1) techniques at temperatures from 5 to 295 K. The room-temperature dynamic conductivity spectra of AuFe films are typical of metals and can be described within the framework of the Drude theory of conduction by free charge carriers. Changes in the microscopic parameters of charge carriers in AuFe films with increasing iron content, which are related to additional scattering of carriers on the impurity magnetic moments, have been studied on the quantitative level, including the carrier relaxation frequency and characteristic time, plasma frequency, and conductivity. It is established that the spin-glass phase at a temperature of ～5 K exhibits dispersion of the conductivity in the frequency range 10–40 cm^?1, which can be related to the appearance of a mobility gap in the subsystem of free electrons involved in the RKKY interaction between magnetic centers (Fe atoms).