Contact-electro-catalysis for the degradation of organic pollutants using pristine dielectric powders

Mechanochemistry has been studied for some time, but research on the reactivity of charges exchanged by contact-electrification (CE) during mechanical stimulation remains scarce. Here, we demonstrate that electrons transferred during the CE between pristine dielectric powders and water can be utilized to directly catalyze reactions without the use of conventional catalysts. Specifically, frequent CE at Fluorinated Ethylene Propylene (FEP) - water interface induces electron-exchanges, thus forming reactive oxygen species for the degradation of an aqueous methyl orange solution. Contact-electro-catalysis, by conjunction of CE, mechanochemistry and catalysis, has been proposed as a general mechanism, which has been demonstrated to be effective for various dielectric materials, such as Teflon, Nylon-6,6 and rubber. This original catalytic principle not only expands the range of catalytic materials, but also enables us to envisage catalytic processes through mechano-induced contact-electrification.

Computing Topological Descriptors and Polynomials of Certain 2D Chemical Structures

In the fields of mathematical chemistry, a topological index, also known as a connectivity index, is a type of a molecular descriptor that is calculated based on the molecular graph of a chemical compound. Topological indices are an analytical framework of a graph which portray its topology and are mostly equal graphs. Topological indices (TIs) are numeral quantities that are used to foresee the natural correlation among the physicochemical properties of the chemical compounds in their fundamental network. TIs show an essential role in the theoretical abstract and environmental chemistry and pharmacology. In this paper, we compute many latest developed degree-based TIs. An analogy among the computed different versions of the TIs with the help of the numerical values and their graphs is also included .In this article, we compute the first Zagreb index, second Zagreb index, hyper Zagreb index, ABC Index, GA Index, and first Zagreb polynomial and second Zagreb polynomial of chemical graphs polythiophene, nylon 6,6, and the backbone structure of DNA.

Molecular separation of ions from aqueous solutions using modified nanocomposites

Herein, two novel porous polymer matrix nanocomposites were synthesized and used as adsorbents for heavy metal uptake. Methacrylate-modified large mesoporous silica FDU-12 was incorporated in poly(methyl methacrylate) matrix through an in-situ polymerization approach. For another, amine-modified FDU-12 was composited with Nylon 6,6 via a facile solution blending protocol. Various characterization techniques including small-angle X-ray scattering, FTIR spectroscopy, field emission-scanning electron microscopy, transmission electron microscopy, porosimetry, and thermogravimetric analysis have been applied to investigate the physical and chemical properties of the prepared materials. The adsorption of Pb(II) onto the synthesized nanocomposites was studied in a batch system. After study the effect of solution pH, adsorbent amount, contact time, and initial concentration of metal ion on the adsorption process, kinetic studies were also conducted. For both adsorbents, the Langmuir and pseudo-second-order models were found to be the best fit to predict isotherm and kinetics of adsorption. Based on the Langmuir model, maximum adsorption capacities of 105.3 and 109.9 mg g−1 were obtained for methacrylate-modified FDU-12/poly(methyl methacrylate) and amine-modified FDU-12/Nylon 6,6, respectively.

Transient Confinement of the Quaternary Tetramethylammonium Tetrafluoroborate Salt in Nylon 6,6 Fibres: Structural Developments for High Performance Properties

A temporary confinement of the quaternary tetramethylammonium tetrafluoroborate (TMA BF4) salt among polyamide molecules has been used for the preparation of aliphatic polyamide nylon 6,6 fibres with high-modulus and high-strength properties. In this method, the suppression or the weakening of the hydrogen bonds between the nylon 6,6 segments has been applied during the conventional low-speed melt spinning process. Thereafter, after the complete hot-drawing stage, the quaternary ammonium salt is fully extracted from the drawn 3 wt.% salt-confined fibres and the nascent fibres are, subsequently, thermally stabilized. The structural developments that are acquired in the confined-nylon 6,6 fibres are ascribed to the developments of the overall fibres’ properties due to the confinement process. Surprisingly, unlike the neat nylon 6,6 fibres, the X-ray diffraction (XRD) patterns of the as-spun salt-confined fibres have shown diminishing of the (110)/(010) diffraction plane that obtained pseudohexagonal-like β’ structural phase. Moreover, the β’ pseudohexagonal-like to α triclinic phase transitions took-place due to the hot-drawing stage (draw-induced phase transitions). Interestingly, the hot-drawing of the as-spun salt-confined nylon 6,6 fibres achieved the same maximum draw ratio of 5.5 at all of the drawing temperatures of 120, 140 and 160 °C. The developments that happened produced the improved values of 43.32 cN/dtex for the tensile-modulus and 6.99 cN/dtex for the tensile-strength of the reverted fibres. The influences of the TMA BF4 salt on the structural developments of the crystal orientations, on the morphological structures and on the improvements of the tensile properties of the nylon 6,6 fibres have been intensively studied.

A comprehensive and updated review of studies on the oxidation of cyclohexane to produce ketone-alcohol (KA) oil

Oxidation of cyclohexane is an essential chemical reaction for the industrial manufacture of cyclohexanol and cyclohexanone. These two compounds, together known as ketone–alcohol (KA) oil, are the main feedstock for nylon 6 and nylon 6,6 productions. Several types of catalysts and reaction conditions have been used for cyclohexane oxidation. This paper presents a thorough literature review of catalytic materials used for cyclohexane oxidation to produce KA oil using oxygen, air and other oxidizing agents as well as utilizing different solvents. This review covers research and development reported over the years 2014–2020. This review aims to comprehend the type of catalysts, solvents, oxidants and other reaction parameters used for the oxidation of cyclohexane. Three types of cyclohexane oxidation processes namely thermocatalytic, photocatalytic and microwave-assisted catalytic have been reported. The results of the review showed that metal and metal oxide loaded silica catalysts performed excellently and provided high selectivity of KA oil and cyclohexane conversion. The use of peroxides is not feasible due to their high price compared to air and oxygen. Gold nanoparticles supported on silica performed with high selectivity and good conversion. The use of hydrochloric acid as an additive was found very effective to enhance the photocatalytic oxidation of cyclohexane. Water on the catalyst surface enhanced the reactivity of the photocatalysts since it helps in the generation of hydroxyl radicals.

Tuning the Structure of Nylon 6,6 Electrospun Bundles to Mimic the Mechanical Performance of Tendon Fascicles

Tendon and ligament injuries are triggered by mechanical loading, but the specific mechanisms are not yet clearly identified. It is well established however, that the inflection and transition points in tendon stress-strain curves represent thresholds that may signal the onset of irreversible fibrillar sliding. This phenomenon often results in a progressive macroscopic failure of these tissues. With the aim to simulate and replace tendons, electrospinning has been demonstrated to be a suitable technology to produce nanofibers similar to the collagen fibrils in a mat form. These nanofibrous mats can be easily assembled in higher hierarchical levels to reproduce the whole tissue structure. Despite the fact that several groups have developed electrospun tendon-inspired structures, an investigation of the inflection and transition point mechanics is missing. Comparing their behavior with that of the natural counterpart is important to adequately replicate their behavior at physiological strain levels. To fill this gap, in this work fascicle-inspired electrospun nylon 6,6 bundles were produced with different collector peripheral speeds (i.e., 19.7 m s–1; 13.7 m s–1; 7.9 m s–1), obtaining different patterns of nanofibers alignment. The scanning electron microcopy revealed a fibril-inspired structure of the nanofibers with an orientation at the higher speed similar to those in tendons and ligaments (T/L). A tensile mechanical characterization was carried out showing an elastic-brittle biomimetic behavior for the higher speed bundles with a progressively more ductile behavior at slower speeds. Moreover, for each sample category the transition and the inflection points were defined to study how these points can shift with the nanofiber arrangement and to compare their values with those of tendons. The results of this study will be of extreme interest for the material scientists working in the field, to model and improve the design of their electrospun structures and scaffolds and enable building a new generation of artificial tendons and ligaments.