{"title":"rGO/ZnO modified polyaniline hybrid ternary nanocomposite as highly sensitive electrode for Pb2+ detection in aqueous sources","authors":"Nisha , Goverdhan Singh , Anil Kumar , Parteek Prasher , Harish Mudila","doi":"10.1016/j.jics.2025.101718","DOIUrl":"10.1016/j.jics.2025.101718","url":null,"abstract":"<div><div>This research work demonstrates the effective determination of Pb<sup>2+</sup> ions from aqueous sources using systematically developed ternary nanocomposites (PrGZs). These nanocomposites were synthesized through a judicious combination of Polyaniline (PANI), reduced Graphene Oxide (rGO), and Zinc Oxide (ZnO). The physical properties of PrGZs were characterized using techniques such as Fourier Transform Infrared Spectroscopy (FTIR), X-ray Diffraction (XRD), Thermogravimetric Analysis (TGA), Differential Scanning Calorimetry (DSC), and Scanning Electron Microscopy (SEM). The electrochemical performance of PrGZs was evaluated using Electrochemical Impedance Spectroscopy (EIS) and Differential Pulse Anodic Stripping Voltammetry (DPASV) with a carbon paste electrode (CPE). Notably, PrGZ-2 exhibited significantly improved detection and sensitivity compared to the individual components and binary composite, attributed to its low resistance, pseudo-capacitive behaviour, and enhanced electron transfer properties. The calculated limits of detection (LOD) and quantification (LOQ) for PrGZ-2 were 0.3 μM and 1.16 μM, respectively, within a Pb<sup>2+</sup> ion concentration range of 1 μM–5.5 μM. This indicates good sensitivity for low concentration detection, with an R<sup>2</sup> value of 0.994. The relative standard deviation (RSD) for PrGZ-2 was 2.13 %, confirming acceptable repeatability and precision of the measurements on the working electrode at a scan rate of 0.01 V/s. Furthermore, the composite material displayed good results in the presence of interfering metals and demonstrated appreciable repeatability and stability. These findings suggest that the material holds significant potential and could be evaluated for detecting other toxic heavy metals, expanding its application for environmental monitoring without interference from lead.</div></div>","PeriodicalId":17276,"journal":{"name":"Journal of the Indian Chemical Society","volume":"102 6","pages":"Article 101718"},"PeriodicalIF":3.2,"publicationDate":"2025-04-15","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143844119","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Arup Kumar Das , Mainak Mallik , Pallabi Kalita , Hui Tag
{"title":"Optimization of biogenic calcium carbonate production using bamboo dust as a nutrient source by Bacillus subtilis and Bacillus cereus for enhanced self-healing concrete","authors":"Arup Kumar Das , Mainak Mallik , Pallabi Kalita , Hui Tag","doi":"10.1016/j.jics.2025.101715","DOIUrl":"10.1016/j.jics.2025.101715","url":null,"abstract":"<div><div>Bacteria-induced concrete is one of the choices for the production of bio-concrete owing to its potential to produce calcium carbonate (CaCO<sub>3</sub>) for self-healing. The technique of repairing concrete cracks using bacteria has been widely accepted because of its effectiveness in enhancing concrete characteristics, such as strength and durability. However, no research has yet been conducted on predicting the formation of calcium carbonate (CaCO<sub>3</sub>) using different bacteria with organic calcium-based nutrients, such as bamboo. This study investigated two bacteria, <em>Bacillus subtilis</em> (<em>B. subtilis</em>) and <em>Bacillus cereus</em> (<em>B. cereus</em>), cultured in Bamboo Dust Nutrient (BDN) media to evaluate their survivability and acceptance in this environment. Furthermore, the ability of these bacteria to form CaCO<sub>3</sub> is validated through microstructural analysis using XRD, SEM and EDX. To quantify CaCO<sub>3</sub> formation in the presence of BDN, the bacteria were cultured separately in Luria (L) broth and Luria Bertani (LB) broth. Additionally, the concentration of the BDN solution, boiling temperature, and boiling duration were considered as input parameters for establishing the optimal nutrient dose for CaCO<sub>3</sub> formation through optimization techniques. The optimization of CaCO<sub>3</sub> formation by these bacteria was performed using Response Surface Methodology (RSM). The models were developed based on the Central Composite Design (CCD) approach in Design Expert software and analyzed using the ANOVA tool to simplify the design model. Based on model analysis, the highest CaCO<sub>3</sub> formation was observed with B. subtilis in LB broth (29.115 mg), followed by B. cereus in LB broth (27.788 mg). The desirability values (>0.90) indicate effective optimization of the nutrient dose, boiling duration, and temperature conditions. These findings confirmed the feasibility of using bacterial-induced mineralization as a self-healing agent in construction materials. Finally, the self-healing capability of <em>B. subtilis</em> in the presence of BDN was demonstrated by injecting a bacteria-embedded BDN solution into cement mortar.</div></div>","PeriodicalId":17276,"journal":{"name":"Journal of the Indian Chemical Society","volume":"102 6","pages":"Article 101715"},"PeriodicalIF":3.2,"publicationDate":"2025-04-15","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143844216","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Amos Nhlapo , Sanele Dlamini , Lebogang Kotsedi , Doctor Paul Maboe , Mohmad Hashim , Khalid Mujasam Batoo , Ahmad Ahmad Ibrahim , Rebecca Mhlongo , Justice Msomi , Thomas Moyo
{"title":"Investigations on structural, magnetic and Mössbauer studies of various rare-earths doped in Ni0.5Mg0.5RE0.03Fe1.97O4 spinel ferrite","authors":"Amos Nhlapo , Sanele Dlamini , Lebogang Kotsedi , Doctor Paul Maboe , Mohmad Hashim , Khalid Mujasam Batoo , Ahmad Ahmad Ibrahim , Rebecca Mhlongo , Justice Msomi , Thomas Moyo","doi":"10.1016/j.jics.2025.101720","DOIUrl":"10.1016/j.jics.2025.101720","url":null,"abstract":"<div><div>Ni<sub>0.5</sub>Mg<sub>0.5</sub>RE<sub>0.03</sub>Fe<sub>1.97</sub>O<sub>4</sub> (RE = Ce<sup>3+</sup>, Dy3<sup>+</sup>, Gd<sup>3+</sup>, Pr<sup>3+</sup>, and Sm<sup>3+</sup>) nanoferrites were synthesized using the hydrothermal method. The X-ray diffraction (XRD) and The Fourier transform infrared spectroscopy (FTIR) confirmed the formation spinel structure. The obtained crystallite sizes ranged between 9.33 and 22.89 nm, while lattice parameters increased from 8.285 to 8.462 Å depending on the ionic radii of dopants. X-ray densities ranged between 4.761 and 5.021 g/cm<sup>3</sup>. The specific surface area (<em>SSA</em>) ranged between 52.3 and 125.9 m<sup>2</sup>/g. Hopping lengths on A- and B-sites ranged between 3.588 and 3.664 and 2.929 and 2.991 Å, respectively. The scanning electron microscopy (SEM) revealed physically shaped and agglomerated nanoparticles. The evolution of coercive fields upon reducing the measuring temperature from room temperature (300K) to 4K indicates the thermal instability of the blocked magnetic moments. Relatively high coercive fields make the materials suitable for application in transformers and high-frequency devices. Field cooling (FC) and zero field cooling (ZFC) revealed the blocking temperatures to be 29K for the undoped sample (Ni<sub>0.5</sub>Mg<sub>0.5</sub>Fe<sub>2</sub>O<sub>4</sub>), 33K for Ce-doped (Ni<sub>0.5</sub>Mg<sub>0.5</sub>Ce<sub>0.03</sub>Fe<sub>1.97</sub>O<sub>4</sub>), and 13K for Sm-doped (Ni<sub>0.5</sub>Mg<sub>0.5</sub>Sm<sub>0.03</sub>Fe<sub>1.97</sub>O<sub>4</sub>) nanoferrites.</div></div>","PeriodicalId":17276,"journal":{"name":"Journal of the Indian Chemical Society","volume":"102 6","pages":"Article 101720"},"PeriodicalIF":3.2,"publicationDate":"2025-04-15","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143847705","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
{"title":"A shorter and alternative route to duvelisib: application in scale-up synthesis","authors":"Srinivasa Rao Buddepu , Rapolu Venkateswarlu , Garbapu Suresh , Kishna Murthy V.R. Moturu , Vidavalur Siddaiah , Manojit Pal","doi":"10.1016/j.jics.2025.101713","DOIUrl":"10.1016/j.jics.2025.101713","url":null,"abstract":"<div><div>A short, convenient and alternative synthesis of the oncological drug duvelisib is reported along with the development of chemical and chiral (wherever applicable) HPLC methods for product obtained in each step. The key features of the newly developed process include: (i) direct conversion of the intermediate possessing a Boc protected amino group to a new intermediate where the Boc group was replaced by the 7<em>H</em>-purin-6-yl moiety (<em>via</em> a two-step method involving the amine deprotection followed by reaction with 6-chloropurine), (ii) direct use of 6-chloropurine without employing any <em>N</em>-protection / deprotection strategy, and (iii) the construction of the isoquinolinone ring using a densely substituted intermediate at the end stage. The optimization of the two newly adopted steps was carried out in the 10g scale and the feasibility of the optimized conditions (involving the use of ZnCl<sub>2</sub> in both cases) in the scale-up preparation was verified by conducting the reaction in 100g scale. The current alternative synthesis that involve nearly 3 fewer steps than the previous method afforded the desired product duvelisib in 38% overall yield (better than ∼19% overall yield of the reported method) that was purified further <em>via</em> the formation of a salt of <em>(1R</em>)-(-)-10-camphorsulfonic acid followed by converting back to the free base. 2009 Elsevier Ltd. All rights reserved.</div></div>","PeriodicalId":17276,"journal":{"name":"Journal of the Indian Chemical Society","volume":"102 6","pages":"Article 101713"},"PeriodicalIF":3.2,"publicationDate":"2025-04-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143839378","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
{"title":"Improved efficiency of silver incorporation in the lattice of zirconium oxide via hydrothermal process for photovoltaic application","authors":"Nawal Alghamdi , Imosobomeh L. Ikhioya","doi":"10.1016/j.jics.2025.101719","DOIUrl":"10.1016/j.jics.2025.101719","url":null,"abstract":"<div><div>Silver-zirconium oxide (AgZr<sub>2</sub>O<sub>4</sub>) is a promising photovoltaic material because of its 2.8 eV bandgap, high electron mobility, and light stability. Previous research on metal oxide-doped Zr<sub>2</sub>O<sub>4</sub> thin films and nanoparticles is extensive, but its nanostructured form on conductive surfaces has received little attention. The hydrothermal method has been used to synthesize the material. The material reveals a deceased in the VOC from 0.53 V to 0.41 V upon silver substitution within the Zr<sub>2</sub>O<sub>4</sub> lattice. The Jsc values obtain increase from 10.93 to 18.72 mAcm<sup>−2</sup>. Adding silver (Ag) to the Zr<sub>2</sub>O<sub>4</sub> lattice reduces its bandgap energy, enabling it to absorb a wider range of light, especially more visible light. FF values obtain increases from 68.8 to 72.6 %. A rise in FF shows improved conversion of input energy to useable power. PCE values obtain increased from 5.2 to 7.5 % with silver on Zr<sub>2</sub>O<sub>4</sub>. The high conductivity of silver enhances charge transport within the device, resulting in improved efficiency. Bandgap energy drops from around 2.8 eV (Zr<sub>2</sub>O<sub>4</sub>) to 2.6–2.2 eV (AgZr<sub>2</sub>O<sub>4</sub>) with silver substitution. Reducing the band gap increases light absorption; however, this also increases charge carrier recombination, decreasing the open-circuit voltage.</div></div>","PeriodicalId":17276,"journal":{"name":"Journal of the Indian Chemical Society","volume":"102 6","pages":"Article 101719"},"PeriodicalIF":3.2,"publicationDate":"2025-04-12","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143825326","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Faezeh Pourebrahim , Mohammad Mahdi Doroodmand , Nahid Naghshgar
{"title":"Sensitive and highly selective nanozymatic cysteine determination over glutathione utilizing tri-nucleus Cr0.3Mn0.7Fe2O4 ferrite nanoparticles as high throughput peroxidase mimetic nanomaterials","authors":"Faezeh Pourebrahim , Mohammad Mahdi Doroodmand , Nahid Naghshgar","doi":"10.1016/j.jics.2025.101707","DOIUrl":"10.1016/j.jics.2025.101707","url":null,"abstract":"<div><div>A novel highly sensitive nanozyme-based colorimetric sensor was developed for selective cysteine quantification in biological samples using tri-nucleus Cr<sub>0.3</sub>Mn<sub>0.7</sub>Fe<sub>2</sub>O<sub>4</sub> ferrite nanoparticles. The as-synthesized Cr<sub>0.3</sub>Mn<sub>0.7</sub>Fe<sub>2</sub>O<sub>4</sub> nanoparticles revealed a high peroxidase-like activity toward oxidation of OPD resulting in a significant absorbance at 448.0 nm, however, the absorbance was selectively inhibited by introducing cysteine molecules in reaction media, which was used as a basis for constructing a highly sensitive nanosensor toward cysteine detection. At optimal conditions, a linear working range of 6.0 μg/L-20.0 mg/L and a limit of detection as low as 4.0 μg/L were provided for cysteine detection. The repeatability studies revealed a %RSD of about 7 %, showing very good repeatability of the developed method. The selectivity studies showed that even glutathione cannot affect the analytical response of the presented sensor even with 15.0-fold higher concentrations than cysteine, revealing ultra-selective detection of cysteine using the developed process as a characteristic advantage of the presented method compared of the reported ones. Finally, the developed sensor was successfully utilized for the analysis of cysteine content of human blood serum. Based on the results of this work, the developed nanosensor can be utilized for accurate, sensitive, and selective cysteine quantification in bio-samples.</div></div>","PeriodicalId":17276,"journal":{"name":"Journal of the Indian Chemical Society","volume":"102 6","pages":"Article 101707"},"PeriodicalIF":3.2,"publicationDate":"2025-04-12","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143844215","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
S. Glory Sobha , Prammitha Rajaram , S. Ilangovan , G. Nedunchezhian
{"title":"Synergistic effect of Sr-doping on ZnO nanoparticles for enhanced photocatalytic activity and antimicrobial activity","authors":"S. Glory Sobha , Prammitha Rajaram , S. Ilangovan , G. Nedunchezhian","doi":"10.1016/j.jics.2025.101711","DOIUrl":"10.1016/j.jics.2025.101711","url":null,"abstract":"<div><div>In this study, we present a highly efficient heterostructure photocatalyst achieved by doping Sr into ZnO nanoparticles, leveraging the synergistic effect of Sr on the properties of ZnO. The single-phase nature and purity of the produced Sr/ZnO nanoparticles are confirmed by FTIR and X-ray diffraction spectra. According to the Scherrer equation, the crystallite size decreases from 24 nm to 15 nm when Sr is doped. With the addition of Sr, the optical band gap, as measured by Tauc plots, marginally moves from 3.13 eV to 2.96 eV. Field emission scanning electron microscopy mapping and energy dispersive X-ray spectroscopy show that Sr is uniformly distributed throughout the ZnO matrix. The morphological characteristics of the synthesized nanoparticles were examined using FESEM, with grain size measurements confirming their nanostructure. The ZnO/Sr nanoparticles had stronger antimicrobial properties toward gram-positive (<em>Enterococcus</em>), gram-negative (<em>Salmonella typhi</em>) as well as fungal (<em>Candida parapsilosis) pathogens.</em> The Sr/ZnO heterostructure demonstrates an excellent photocatalytic performance, achieving 85 % decomposition of methylene blue under sun light exposure for 120 min. Kinetic analysis of the photocatalytic process indicates that the rate constant for the heterostructure is 2.4 times higher than that of pure ZnO. Additionally, the heterostructure shows minimal loss in photocatalytic efficiency (only a 6 % decrease) after 3 cycles, confirming its reusability. These results highlight the Sr/ZnO heterostructure's potential as a sustained photocatalyst and being suitable for biological applications.</div></div>","PeriodicalId":17276,"journal":{"name":"Journal of the Indian Chemical Society","volume":"102 6","pages":"Article 101711"},"PeriodicalIF":3.2,"publicationDate":"2025-04-11","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143825327","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Jamelah S. Al-Otaibi , Y. Sheena Mary , Fazli Sattar , M.S. Roxy
{"title":"Interaction of bioactive drugs, Glimepiride and Sitagliptin with copper clusters: DFT, SERS, docking and MD analyses","authors":"Jamelah S. Al-Otaibi , Y. Sheena Mary , Fazli Sattar , M.S. Roxy","doi":"10.1016/j.jics.2025.101712","DOIUrl":"10.1016/j.jics.2025.101712","url":null,"abstract":"<div><div>Glimepiride (GPE) and Sitagliptin (SPN) are medications used for diabetes. This study examines the theoretical outcomes of GPE and SPN. The electronic properties of copper nanocages containing GPE and SPN have exhibited a notable enhancement. Electronic properties such as molecular electrostatic potential (MEP), Frontier molecular orbitals (FMOs) analysis of GPE, SPN, GPE-Cu<sub>4</sub> and SPN-Cu<sub>4</sub> were investigated at two most reactive sites for each molecule. The chosen inhibitors of human glucose transporter and human aldose reductase seem to respond well to GPE and SPN, based on their binding affinities and the production of a substantial number of H-bonds. The molecular dynamics (MD) simulations were performed for the proteins 7VSI for GPE and 2R24 for SPN giving maximum affinity. Also MD simulation studies of the GPE and SPN ligands in water were reported.</div></div>","PeriodicalId":17276,"journal":{"name":"Journal of the Indian Chemical Society","volume":"102 6","pages":"Article 101712"},"PeriodicalIF":3.2,"publicationDate":"2025-04-11","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143825328","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Rabail Fatima , R.M. Arif Khalil , Muhammad Iqbal Hussain , Fayyaz Hussain
{"title":"Insight into the physical characteristics of novel inorganic chalcogenides MAg3Se4 (M=V, Nb, Ta) with exceptional stability using WIEN2K for its applications in photovoltaics","authors":"Rabail Fatima , R.M. Arif Khalil , Muhammad Iqbal Hussain , Fayyaz Hussain","doi":"10.1016/j.jics.2025.101705","DOIUrl":"10.1016/j.jics.2025.101705","url":null,"abstract":"<div><div>We develop environment friendly, renewable and effective energy sources to address the energy difficulties owing to the depletion of fossil fuels. So, inorganic chalcogenides are most intriguing compounds in the most advanced future solar cells for effective production of sustainable energy using solar radiations. This study represents the first theoretical exploration of MAg<sub>3</sub>Se<sub>4</sub> (M = Nb, V and Ta). We describe their structural, magnetic, optical, mechanical and vibrational properties via Wien2k code for photovoltaic devices. GGA + U is utilized due to the fact that U is a suitable solution to incorporate on-site self-interactions of the electrons. The lattice constants <span><math><mrow><mo>(</mo><mi>Å</mi><mo>)</mo></mrow></math></span> are given as <span><math><mrow><msub><mrow><mspace></mspace><mi>a</mi></mrow><mi>o</mi></msub><mo>=</mo><mn>5.9719</mn></mrow></math></span> for VAg<sub>3</sub>Se<sub>4</sub>, <span><math><mrow><msub><mi>a</mi><mi>o</mi></msub><mo>=</mo><mn>6.0972</mn></mrow></math></span> for NbAg<sub>3</sub>Se<sub>4</sub> and <span><math><mrow><msub><mi>a</mi><mi>o</mi></msub><mo>=</mo><mn>6.1020</mn></mrow></math></span> for TaAg<sub>3</sub>Se<sub>4</sub>, respectively. These materials are semiconductors due to indirect electronic band gap of 0.92 eV (↑↓) in VAg<sub>3</sub>Se<sub>4</sub>, 1.75 eV (↑↓) in NbAg<sub>3</sub>Se<sub>4</sub> and 2.15 eV (↑↓) in TaAg<sub>3</sub>Se<sub>4</sub>, respectively. Relatively, large cohesive energy (−3.96 eV/atom) <span><math><mrow><msub><mtext>VAg</mtext><mn>3</mn></msub><msub><mtext>Se</mtext><mn>4</mn></msub></mrow></math></span> is an indication of its structurally more stable. PDOS reveals Ag-4<em>d</em> and Se-4<em>p</em> orbitals are partaking in deep area of the valence band. Ta-<em>d</em> states are partaking in the conduction band beyond the Fermi level. Additionally, optical investigation reveals that these compounds barely reflect incident radiations as it strikes their surfaces. Mechanical properties demonstrate that examined chalcogenides display mechanical stability, ductile character and anisotropic behavior since its magnitude is not equal to 1. Phonons study indicates some imaginary frequency in NbAg<sub>3</sub>Se<sub>4</sub> and TaAg<sub>3</sub>Se<sub>4</sub> which may be caused by a specific direction of the cubic crystal structure, while no imaginary frequency is found for VAg<sub>3</sub>Se<sub>4</sub>. All these materials show thermodynamic stability because free energy graph enlarges to the negative energy range. Our results unveil that these chalcogenides can be beneficial for photovoltaics applications.</div></div>","PeriodicalId":17276,"journal":{"name":"Journal of the Indian Chemical Society","volume":"102 6","pages":"Article 101705"},"PeriodicalIF":3.2,"publicationDate":"2025-04-11","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143828293","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
J. kalpana , R. Anithadevi , S. Satheeskumar , P. Sangeetha
{"title":"A novel phytosynthesized Zr doped SnO2 nanocomposite for textile effluent purification and in-vitro biological activities","authors":"J. kalpana , R. Anithadevi , S. Satheeskumar , P. Sangeetha","doi":"10.1016/j.jics.2025.101710","DOIUrl":"10.1016/j.jics.2025.101710","url":null,"abstract":"<div><div>Ecosystems and public health are seriously threatened by environmental pollution brought on by synthetic colours and harmful microbes. The current study aims to create a multipurpose nanomaterial with improved antioxidant, antibacterial, and photocatalytic qualities for possible environmental remediation to address this problem. Herein, a novel Zr-SnO<sub>2</sub> nanocomposite was effectively produced via a green approach. This effort aims to assess the synthesized composite's structural, optical, and functional characteristics and investigate how well it degrades organic dyes and suppresses microbiological growth. XRD analysis confirmed its crystalline nature, which showed an average crystalline size of 26.91 nm. Agglomerated spherical particles with the proper elemental composition were seen in FE-SEM images. The optical characteristics were ascertained using PL and UV-Vis spectroscopy, including a bandgap of 2.73 eV. Both cationic (Crystal Violet) and anionic (Brilliant Blue) dyes were used to measure photocatalytic activity; after 90 min in the sun, the degradation efficiencies were 85 % and 98 %, respectively. The composite also demonstrated 94 % antioxidant and intense antibacterial activity against <em>S. aureus</em> and <em>E. coli</em>. These results demonstrate the green-synthesized Zr-SnO<sub>2</sub> nanocomposite's potential as a valuable substance for environmental applications.</div></div>","PeriodicalId":17276,"journal":{"name":"Journal of the Indian Chemical Society","volume":"102 6","pages":"Article 101710"},"PeriodicalIF":3.2,"publicationDate":"2025-04-09","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143820449","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}