Chemical Methods Research Articles

Computational supported experimental insights in adsorption of Congo Red using ZnO/doped ZnO in aqueous solution

The rapid growth of industrialisation has led to the discharge of harmful effluents into water bodies, severely disrupting the balance of ecosystems. The detection and removal of dyes from wastewater remains a significant challenge. In this study, we report the synthesis of zinc oxide (ZnO) and its doped derivatives through a facile chemical method, followed by comprehensive characterisation and analysis to assess their potential in various applications. The structural properties of the synthesised materials were confirmed by X-ray diffraction (XRD), which verified their crystalline nature and phase purity. Morphological analysis using field emission scanning electron microscopy (FE-SEM) coupled with energy dispersive X-ray analysis (EDAX) revealed well-defined nanostructures and uniform elemental distribution. The adsorption ability of the synthesized adsorbents was investigated through electrochemical methods, cyclic voltammetry and Tafel plots, which demonstrated enhanced conductivity and charge transfer characteristics. Additionally, theoretical studies through molecular modelling and molecular dynamic simulations were employed to elucidate the interactions between Congo red molecules and the surface of the synthesized compounds. Adsorption experiments were conducted to evaluate the efficacy of ZnO and its doped variants as adsorbents. To investigate any structural or functional changes after dye adsorption FTIR and XRD were compared, provided a deeper insight into the adsorption mechanism. This multi-faceted approach highlights the potential of ZnO-based materials for effective wastewater treatment and other environmental applications.

Influences of blue and red light irradiations on Cd phytoexcretion using Festuca arundinacea.

Although phytoremediation is more economical when compared with traditional physical and chemical soil remediation methods, it remains very expensive when considering the substantial area of the contaminated field. If the quantity of harvested residues can be reduced after each phytoremediation cycle, the practicability and commercial implementation of this environment friendly method can be improved. In this study, cadmium excretion on the leaf surface of Festuca arundinacea was evaluated under various blue and red light conditions. The results indicated that the percentage of decaying and deceased leaves increased by 8.5%, 31.1%, 59.7%, and 35.9% at a blue light ratio of 10%, 50%, 75%, and 100%, respectively, when compared with the control. The highest cadmium concentration was found in decaying and deceased leaves under 75% blue light treatment. Light treatments also altered the excreted cadmium amount on different leaf types. Under all treatments including the control, significantly more cadmium can be washed off from emerging and mature leaves than from decaying and deceased leaves, owing to the detoxification mechanism of the plant (p < 0.05). The differences in cadmium excretion on senescent and dead leaves under all treatments were not statistically significant, but the mass of cadmium excretion on young leaves under 75% and 100% blue light irradiation were significantly higher than that under other treatments (p < 0.05). Herein, a novel phytoremediation method involving the harvesting decaying and deceased leaves and washing emerging and mature leaves was proposed to decrease the costs of plant residue disposal.

Research Progress on the Safety of LIBs Separators

Over the years, the electrification of transport has forced improvements in energy storage batteries. Lithium-ion batteries (LIBs) are widely used in aerospace, smart devices, electronic communications, and transport because of their high capacity, good cyclability, and environmental friendliness. However, battery safety is a massive issue in people's daily lives. LIBs occasionally suffer from spontaneous combustion and explosion. This is mainly caused by short circuits within the battery. The diaphragm, as the material separating the positive and negative electrodes, prevents the positive and negative electrodes from coming into direct contact, thus avoiding short circuits. The performance of the diaphragm determines the safety of LIBs. Therefore, this paper first introduces the causes of the thermal runaway of lithium-ion batteries and its relationship with diaphragms. Then, this paper presents the essential characteristics and types of high-safety diaphragms. Finally, this paper also summarises the physical and chemical modification methods of diaphragm materials in LIBs. This will help improve the safety of lithium-ion batteries, increase the electrification of transportation, and eliminate concerns about using LIBs.

Study on the occurrence characteristics of arsenic in copper matte

The occurrence characteristics of arsenic in matte phase are unclear, which leads to the current treatment technology not being able to remove arsenic from matte phase significantly, thus causing a large amount of arsenic to affect smelting links such as copper converting and electrolytic refining. This paper uses instrumental analysis such as XRD, SEM-EDS, MLA and chemical analysis methods such as chemical phase extraction to comprehensively analyze the occurrence characteristics of arsenic in matte phase. The results show that the occurrence states of arsenic in matte are mainly arsenic sulfide, arsenic oxide, arsenate and residual arsenic. Most of the arsenic is in residual state in matte; arsenic in matte is extremely stable and difficult to exchange with the outside world; in high-grade matte, the arsenic content is relatively high. The main occurrence state of arsenic is copper-based complex alloy compounds, in which the arsenic content is about 1-10%. Since the metal bond between Cu-As is extremely stable, it is difficult to separate arsenic from it, which is also the key to the difficulty in completely removing arsenic from matte.

Root exudation of glyphosate in Eucalyptus urophylla S.T. Blake

Glyphosate stands out in the eucalyptus management, which makes it essential to know its behavior, its effects on the plant, and possible environmental impacts. This study aimed to identify and quantify the root exudation of glyphosate and aminomethylphosphonic acid (AMPA) by Eucalyptus urophylla with chromatographic and biological methods. The five glyphosate doses were tested (0, 360, 720, 1080 and 1440 g a.e ha−1) on E. urophylla plants. The physiological and intoxication evaluations were performed after herbicide application. Water samples remaining from the pots were used for chemical quantification of root exudation of glyphosate and AMPA in high-performance liquid chromatography. Cucurbita pepo plants were used as bioindicators of glyphosate in the water remaining in the pots after applying herbicide. The increase in glyphosate doses promoted linear growth in E. urophylla intoxication and significantly reduced total dry mass and root production. E. urophylla plants had their photosynthetic, transpiratory, and stomatal conductance rates reduced as the herbicide doses increased. The AMPA root exudation was not detected, but it was possible to identify the presence of glyphosate by bioassay and chemical methods. Root exudation of glyphosate by eucalyptus can result in lesser herbicide action in plant control and cause contamination of deeper soil layers.

Chemical Tools for Probing the Ub/Ubl Conjugation Cascades.

Conjugation of ubiquitin (Ub) and structurally related ubiquitin-like proteins (Ubls), essential for many cellular processes, employs multi-step reactions orchestrated by specific E1, E2 and E3 enzymes. The E1 enzyme activates the Ub/Ubl C-terminus in an ATP-dependent process that results in the formation of a thioester linkage with the E1 active site cysteine. The thioester-activated Ub/Ubl is transferred to the active site of an E2 enzyme which then interacts with an E3 enzyme to promote conjugation to the target substrate. The E1-E2-E3 enzymatic cascades utilize labile intermediates, extensive conformational changes, and vast combinatorial diversity of short-lived protein-protein complexes to conjugate Ub/Ubl to various substrates in a regulated manner. In this review, we discuss various chemical tools and methods used to study the consecutive steps of Ub/Ubl activation and conjugation, which are often too elusive for direct studies. We focus on methods developed to probe enzymatic activities and capture and characterize stable mimics of the transient intermediates and transition states, thereby providing insights into fundamental mechanisms in the Ub/Ubl conjugation pathways.

A Single-Crystal Antimony Trioxide Dielectric for 2D Field-Effect Transistors.

The remarkable potential of two-dimensional (2D) materials in sustaining Moore's law has sparked a research frenzy. Extensive efforts have been made in the research of utilizing 2D semiconductors as channel materials in field-effect transistors. However, the next generation of integrated devices requires the integration of gate dielectrics with wider bandgaps and higher dielectric constants. Here, insulating α-Sb2O3 single-crystal nanosheets are synthesized by one-step chemical vapor deposition method. Importantly, the α-Sb2O3 single-crystal dielectric exhibits a high dielectric constant of 11.8 and a wide bandgap of 3.78 eV. Besides, the atomically smooth interface between α-Sb2O3 and MoS2 enables the fabrication of dual-gated field-effect transistors with the top gate dielectric of α-Sb2O3 nanosheets. The field-effect transistors exhibit a switching ratio of exceeding 108, which achieves the manipulation of field-effect transistors by using 2D dielectric materials. These results hold significant implications for optimizing the performances of 2D devices and innovating microelectronics.

Comparative Study on the Effectiveness of Poly Aluminium Chloride (PAC), Aluminium Sulfate, and Iron Sulfate in Livestock Wastewater Treatment

This study investigates the effectiveness of chemical coagulation methods for treating livestock wastewater, a significant environmental concern due to the high levels of organic and inorganic pollutants it contains. The coagulants employed in this research include Poly Aluminium Chloride (PAC), Aluminum Sulfate (Al₂(SO₄)₃·18H₂O), and Iron Sulfate (FeSO₄·7H₂O). Experimental results demonstrate that the treatment with PAC achieved the highest reduction in Chemical Oxygen Demand (COD), with values decreasing from an initial concentration of 1431.32 mg/L to 700.18 mg/L, corresponding to a removal efficiency of 77.38%. Similarly, Biochemical Oxygen Demand (BOD₅) values decreased from 1734.43 mg/L to 417.33 mg/L, achieving a removal efficiency of 75.68%. The Total Suspended Solids (TSS) also showed a significant reduction, reaching 112.02 mg/L after treatment, well below the regulatory limit of 150 mg/L as stipulated by QCVN 62-MT:2016/BTNMT. While Aluminum Sulfate and Iron Sulfate demonstrated some level of effectiveness, their results did not meet the regulatory standards, with residual COD, BOD₅, and TSS concentrations remaining above permissible limits. This study concludes that PAC is the most effective coagulant for livestock wastewater treatment, suggesting further optimization and potential application in agricultural settings to mitigate the environmental impact of livestock operations.

π-Conjugation as a Direct Estimate of Lewis Acidity.

A computational approach to directly estimate the relative acidity of a given Lewis acid is presented. This approach is based on the strength of the π-conjugation in trans-crotonaldehyde-Lewis acid complexes, the species used in the well-known Childs' Lewis acidity scale. It is found that the π-conjugative strength values given by the Energy Decomposition Analysis - Natural Orbital for Chemical Valence method strongly correlate not only with the variation of the bond lengths in the system, which are greatly affected by the nature of the Lewis acid but also with the downfield shifts experienced by the different nuclei of the conjugated system upon binding to the Lewis acid. These strong correlations indicate that the (easy-to-compute) π-conjugation energies can be used as an alternative Lewis acidity scale.

Research Progress in the Synthesis of N-Acyl Amino Acid Surfactants: A Review

This paper reviews the research progress in the synthesis of N-acyl amino acid surfactants, including chemical synthesis methods, enzymatic synthesis methods, chemo-enzymatic methods, and fermentation methods. Chemical synthesis is currently the main route for laboratory and industrial synthesis, including methods such as direct dehydration condensation of fatty acids, amidation of fatty acid anhydrides, carbonyl addition of fatty amides, amidation of fatty acid activated esters, amidation of fatty acid methyl esters, amidation of oils and fats, hydrolysis of fatty nitriles, and Schotten–Baumann condensation. Enzymatic synthesis has the advantages of mild reaction conditions and being green and pollution-free, but the yield is relatively low. The chemo-enzymatic method combines the advantages of enzymatic and chemical methods, but it has not been widely promoted. Fermentation methods have low production costs and are environmentally friendly but the technology is not yet mature. This paper elaborates on the principles, advantages, and disadvantages of each synthesis method and provides an outlook on future research directions.

Minor Lignans with Inhibitory Activity against LPS-induced NO Production from Schisandra chinensis.

Phytochemical investigation into the fruits of Schisandra chinensis led to the isolation of seven new minor lignans, schisanchignans A-G (1-7), including one benzofuran type (1), three aryltetralin type (2-4) and three tetrahydrofuran type (5-7). Their structures were established by comprehensive spectroscopic analyses, and the absolute configurations were determined by electronic circular dichroism technique including quantum chemical calculation method. Of note, this is the first report of nor-benzofuran and aryltetralin types of lignans from S. chinensis. Compounds 1, 3 and 4 exhibited mild inhibitory activity against the lipopolysaccharide-induced production of nitric oxide in murine RAW264.7 cells.

Synthesis and characterization of p-CuO/n-ZnO heterostructured composite thin films for the detection of formaldehyde gas.

We report the synthesis and characterization of pure CuO and CuO-ZnO nanostructured composite thin films sprayed on particle-free glass substrates using chemical spray pyrolysis method. The films were systematically analyzed through microstructural, morphological, chemical, and gas-sensing studies. X-ray diffraction (XRD) studies confirmed the polycrystalline nature of the films, with a predominant monoclinic phase along the (002) direction. Key structural parameters, such as crystallite size, dislocation density, strain, and the number of crystallites per unit area, were reported from XRD analysis. Field emission scanning electron microscopy (FESEM) revealed a bundled-like morphology with uniform particle distribution, enhancing the surface area for effective gas interaction. X-ray photoelectron spectroscopy (XPS) results indicated that Cu and Zn ions existed predominantly in the 2+ oxidation state, contributing to the films' reactivity. Significantly, the gas sensing studies were investigated with static liquid distribution method, highlighting the remarkable performance of the 30 wt.% CuO-ZnO composite thin film. This composite exhibited a substantial response to 5 ppm formaldehyde at ambient conditions, showing a recovery time of 22 seconds and a response time of 15 seconds. These findings underscore the potential of CuO-ZnO composites for efficient formaldehyde gas sensing applications, marking a notable advancement in the field of environmental monitoring.

Mechanical properties of poly(ethylene succinate) thin films incorporated with chemical synthesis copper oxide nanoparticles

This study investigates the synthesis and characterization of poly(ethylene succinate) (PES) thin films and their composites with copper oxide (CuO) nanoparticles. CuO nanoparticles were synthesized using a chemical synthesis method, achieving an average size of 20 nm. PES/CuO composites were prepared by incorporating CuO at various concentrations of 0, 1, 3, and 5 wt%. The thin films were produced through solution polymerization followed by casting. Mechanical testing revealed that the tensile strength of pure PES was 25 MPa, while incorporating 1 wt% CuO increased the tensile strength to 30 MPa. At 3 wt%, the tensile strength reached 35 MPa, and at 5 wt%, it peaked at 40 MPa, demonstrating a significant enhancement in mechanical properties. The elongation at break also improved, increasing from 200% for pure PES to 250% for the 5 wt% CuO composite. Characterization of the materials was performed using Fourier transform infrared spectroscopy (FTIR), X-ray diffraction (XRD), and scanning electron microscopy (SEM) to analyze structural and morphological properties. The results confirm that the PES/CuO composites exhibit enhanced mechanical properties, indicating their potential for diverse applications in sustainable materials and biomedical fields.

Antimicrobial Activity of Diffusible Substances Produced by Lactococcus lactis Against Bacillus cereus in a Non-Contact Co-Culture Model

The symptoms of foodborne illness caused by Bacillus cereus often go unreported, complicating the effectiveness of conventional chemical and physical methods used to inhibit its growth in food production. This challenge, combined with the increasing use of lactic acid bacteria (LAB) in the food industry and consumer preference for minimally processed products, prompted this study. The antibacterial activity of diffusible substances produced by Lactococcus lactis ATCC 11454 against Bacillus cereus NC11143 and Escherichia coli K-12 MG1655 was investigated using a non-contact co-culture model utilising deMann Rogosa and Sharpe broth, with glucose as a carbon source. This study employed plate counting and flow cytometry to assess the impact of these substances on bacterial growth and to analyse their composition and antimicrobial efficacy. The co-culture of Lactococcus lactis ATCC 11454 resulted in the production of a stable antimicrobial peptide, which was heat resistant and acid tolerant. Purification was achieved via ammonium sulphate precipitation and preparative HPLC, yielding a peptide with a molecular mass of 3.3 kDa, with daughter ion fractions similar to nisin A. Antimicrobial activity studies demonstrated that the diffusible substances effectively inhibited B. cereus growth over a period of eight days and exhibited bactericidal activity, killing 99% of the B. cereus cells. Additionally, these substances also inhibited Escherichia coli K-12 MG1655 grown under similar conditions. Comparative analysis revealed that in the co-culture assay, L. lactis produced a 50% higher yield of the antimicrobial peptides compared to pure cultures. Similarly, the specific growth rate of L. lactis was four times higher. With respect to protein purification and concentration, ammonium sulphate precipitation coupled with solid phase extraction was most effective in the purification and concentration of the diffusible substances. The findings provide a basis for utilising bacteriocin-producing strains as a preservation method, offering an alternative to traditional chemical and physical control approaches especially for the food industry.

Study of the effect of forced precipitation of working fluid on a vineyard sprayer for weed control

BACKGROUND: A distinctive feature of the sprayer presented is the possibility of more efficient penetration of the working solution into the middle and lower tiers of weeds, as well as on the lower (abaxial) side of the leaf. This is ensured by the use of an air-liquid jet, which significantly increases the effectiveness of the applied chemical method of weed control. AIM: Analysis of the effect of air jets on the deposition of chemicals on the surface of leaves of weeds. The penetration of the drug into the middle and lower tiers of plants, as well as deposition on the adaxial and abaxial sides of the leaves, is taken into account. METHODS: To combat unwanted vegetation, a special device was applied, which was used in field research both with and without air support. With the help of the developed method, spraying was carried out on indicator cards fixed on the upper, middle and lower tiers of the plant RESULTS: For the first time, an innovative technology based on the use of a flexible air distribution sleeve as part of a herbicide sprayer was proposed to combat weeds in vineyards. This sleeve ensures the precise supply of airflow from the fan to the working fluid spraying area. The result of such an air-liquid flow is improved efficiency and monodispersity of herbicide droplets, which, in turn, ensures uniform coverage of the lower tiers and the abaxial surface of the leaves of weeds. This innovative solution opens up new prospects in the fight against unwanted vegetation in the vineyards. CONCLUSION: The practical value of the proposed weed control technology lies is increasing the quality of the technological operation due to the forced precipitation of the working solution.

Site-Specific Histidine Aza-Michael Addition in Proteins Enabled by a Ferritin-Based Metalloenzyme.

Histidine modifications of proteins are broadly based on chemical methods triggering N-substitution reactions such as aza-Michael addition at histidine's moderately nucleophilic imidazole side chain. While recent studies have demonstrated chemoselective, histidine-specific modifications by further exploiting imidazole's electrophilic reactivity to overcome interference from the more nucleophilic lysine and cysteine, achieving site-specific histidine modifications remains a major challenge due to the absence of spatial control over chemical processes. Herein, through X-ray crystallography and cryo-electron microscopy structural studies, we describe the rational design of a nature-inspired, noncanonical amino-acid-incorporated, human ferritin-based metalloenzyme that is capable of introducing site-specific post-translational modifications (PTMs) to histidine in peptides and proteins. Specifically, chemoenzymatic aza-Michael additions on single histidine residues were carried out on eight protein substrates ranging from 10 to 607 amino acids including the insulin peptide hormone. By introducing an insulin-targeting peptide into our metalloenzyme, we further directed modifications to be carried out site-specifically on insulin's B-chain histidine 5. The success of this biocatalysis platform outlines a novel approach in introducing residue- and, moreover, site-specific post-translational modifications to peptides and proteins, which may further enable reactions to be carried out in vivo.

The effect of synthesis techniques on the gas sensing properties of TiO2/SiC/CoFe2O4 nanocomposites as gas sensor

This study investigates the impact of two distinct methodologies on the structural, morphological, and gas sensing properties of TiO2/SiC/CoFe2O4 (TSC) nanocomposites determined using x-ray diffraction (XRD), scanning electron microscopy (SEM), LCR meter, and gas sensing unit respectively. The TiO2/SiC/CoFe2O4 nanocomposites were synthesized using chemical co-precipitation method (C-TSC) and the solid state method (G-TSC). The Scherrer formula was used to calculate the average grain size of C-TSC and G-TSC, which was estimated to be 8 ± 2 nm and 10 ± 2 nm, respectively. The formation of TSC nanocomposites was confirmed by XRD, SEM, and EDX analysis. The response (%) toward ethanol and NH3 gas was tested as a function of flow rate (ppm) and temperature from room temperature (28 °C) to 300 °C. The response (%) was observed to be increasing with increasing temperature and three intermediate temperatures were found. The response and recovery time were also measured with varying gas concentrations. The long-term stability of devices was tested up to 30 days and less variation in result was found, which confirms stability of sensor. The material synthesized using chemical co-precipitation method (C-TSC) shows better properties than G-TSC.

Mycotoxin Biodegradation by Bacillus Bacteria—A Review

Mycotoxins are toxic secondary metabolites produced by various types of fungi that are known to contaminate various food products; their presence in the food chain poses significant risks to human and animal health and leads to enormous economic losses in the food and feed industry worldwide. Ensuring food safety and quality by detoxifying mycotoxin is therefore of paramount importance. Several procedures to control fungal toxins have been extensively investigated, such as preventive measures, physical and chemical methods, and biological strategies. In recent years, microbial degradation of mycotoxins has attracted much attention due to its reliability, efficiency, and cost-effectiveness. Notably, bacterial species from the Bacillus genus have emerged as promising candidates for mycotoxin decontamination owing to their diverse metabolic capabilities and resilience in harsh environmental conditions. This review manuscript aims to provide a summary of recent studies on the biodegradation of fungal toxins by Bacillus bacteria, thereby illustrating their potential applications in the development of mycotoxin-degrading products.

Controllable synthesis of CoMoO4-modified NiMoO4: a stepwise chemical etching method of materials for hybrid supercapacitors

Controllable synthesis of CoMoO4-modified NiMoO4: a stepwise chemical etching method of materials for hybrid supercapacitors

Innovative perspectives on bacteriocins: advances in classification, synthesis, mode of action, and food industry applications.

Bacteriocins, natural antimicrobial peptides produced by bacteria, present eco-friendly, non-toxic, and cost-effective alternatives to traditional chemical antimicrobial agents in the food industry. This review provides a comprehensive update on the classification of bacteriocins in food preservation. It highlights the significant industrial potential of pediocin-like and two-peptide bacteriocins, emphasizing chemical synthesis methods like Fmoc-SPPS to meet the demand for bioactive bacteriocins. The review details the mode of action, focusing on mechanisms such as transmembrane potential disruption and pH-dependent effects. Furthermore, it addresses the limitations of bacteriocins in food preservation and explores the potential of nanotechnology-based encapsulation to enhance their antimicrobial efficacy. The benefits of nanoencapsulation, including improved stability, extended antimicrobial spectrum, and enhanced functionality, are underscored. This understanding is crucial for advancing the application of bacteriocins to ensure food safety and quality.