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15 articles for “Bonding and non-bonding electrons”
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A Mini-Review on Spectral (UV Visible, FT-IR, 1H NMR, GC-MS) Analysis of Various Shaded Dried Leaves Extracts
Abstract: To collect the different types of leaves in various places, wash collected leaves with distilled water and dried these leaves in various processes like under shade dry for 15 days, place oven (45 oC) for 1 hour. Grind well using the above-dried leaves, so these leaves are changed to powder form. Utilize these shaded dried leaves powder, to prepare extract with solvents like methanol, ethanol, hexane, carbon tetrachloride, petroleum ether, …
Published in Journal of Modern Chemistry & Chemical Technology · Vol. 13, Issue 1, 2022 · pp. 1–8 Read article
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Virtual Screening of Novel 2-substituted -5-hydroxy-1- (2-methyl-3-morpholinopropyl)-1H-indole-3- carboxamide Derivatives for Estrogen Receptor alpha in AF-2 domain for effective Anticancer Treatment
Abstract: Present manuscript describes designing of novel 2-substituted -5-hydroxy-1-(2-methyl-3- morpholinopropyl)-1H-indole-3-carboxamide derivatives as specific ERα modulators, discuss the selection criteria for 1ERR, several interactions between the ligand and the amino acid residues that would probably elicit fruitful modulation of the receptor. Accordingly, a ligand was observed to yield Gscore of -10.016 which was found comparable with the standard ligand Raloxifene (-11.869). The present work has been designed to discover some novel 2-substituted …
Published in Research and Reviews: A Journal of Pharmaceutical Science · Vol. 12, Issue 2, 2025 · pp. 31–55 Read article
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Conductive Organic Polymer Based Inorganic-Organic Hybrid Composite: Synthesis and Characterization
Abstract: Inorganic organic (IO) hybrids where inserted conducting organic polymer (COP) imprints their polymeric nature onto the hybrid material are one of the most promising candidates for solving many technological problems of modern technocratic society. The Inorganic-organic hybrid material of para toluidine (organic) & mercuric chloride (inorganic) was synthesized by using “instant-heating and slow-cooling” technique. Some light orange coloured plate-like crystals were obtained. XRD pattern of the grown crystal were analysed …
Published in Journal of Polymer & Composites · Vol. 8, Issue 1, 2020 · pp. 1–5 Read article
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Comparison of 11-Atom Armchair Graphene Nanoribbons and Zig-Zag Carbon Nanotubes in Polymer Composites Under Various Bias Voltages: A Study of Electronic and Transmission Properties
Abstract: In this research, 11-atom zig-zag carbon nanotubes (ZCNTs) and 11-atom armchair graphene nanoribbons (AGNRs) were studied under applied bias voltages at 50, 150, and 300 millivolt levels. The focus was on understanding their behaviour concerning transmission qualities, current-voltage (I-V) characteristics, and energy-momentum (E-K) diagrams. The Non-Equilibrium Green's Function (NEGF) approach was employed to analyse various electronic properties for ZCNTs and AGNRs, including transmission, E-K relationships, and I-V characteristics. The results …
Published in Journal of Polymer & Composites · Vol. 13, Issue 2, 2025 · pp. 126–134 Read article
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Synthesis, Spectral Characterization and Computational Studies of Hydrazine Derivative
Abstract: (E)-1-(2,3-dimethoxy benzylidene)hydrazine (2,3-DMBH) is synthesized by condensation reaction. FT-IR, ¹H NMR, ¹³C NMR spectra were recorded for this compound. The synthesized compounds were evaluated as potential drug candidates through ADME analysis and Lipinski’s rule verification. Molecular docking studies against six proteins using AUTO DOCK software showed promising results. Among them, 2,3-DMBH exhibited strong binding affinities, particularly with 3ERT (-5.44 kcal/mol), followed by 5F90, 7E9B, and 3EWD. These findings suggest that …
Published in Emerging Trends in Chemical Engineering · Vol. 12, Issue 2, 2025 · pp. 1–17 Read article
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Configuration and Properties of Group III Elements in the Periodic Table
Abstract: Group III elements comprise those found in the third column of the periodic table, including boron, aluminum, gallium, indium, and thallium. These elements possess three valence electrons in their outermost shell, characterized by the electron configuration ns2np1, which influences their location and characteristics within the periodic table. The distribution of electron pairs, formal charges, oxidation states, and molecular morphologies of Group III elements and their compounds are illustrated in this …
Published in Journal of Materials & Metallurgical Engineering · Vol. 15, Issue 2, 2025 · pp. 23–30 Read article
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Properties of ZnO Thin Film deposited on Flexible Substrate using RF Sputtering
Abstract: Semiconductor materials demand is increased in recent years, due to new emerging technologies. There is need to find the alternate for silicon in electronics industry, as silicon is brittle in nature and has low efficiency, which makes it unsuitable for transparent and flexible device. Zinc oxide (ZnO) is emerging as popular choice of researchers due to its wide range of properties, abundancy and non-toxicity. This work explores the properties of …
Published in Journal of Polymer & Composites · Vol. 12, Issue 4, 2024 · pp. 50–56 Read article
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Demonstrative Research of Group VII Elements of the Periodic Table: Characteristics and Properties of Chemical Behavior
Abstract: The elements in Group VII, commonly referred to as halogens, are non-metals that exhibit similar chemical characteristics and a high level of reactivity, which can be attributed to their electron configuration. This paper seeks to provide an overview of the relationship between the electron structure and chemical behavior of the Group VII elements found in the periodic table. The primary goals include elucidating how the electron configuration influences the physical …
Published in Emerging Trends in Chemical Engineering · Vol. 12, Issue 2, 2025 · pp. 18–26 Read article
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Integrated Computational and Bio-catalytic Transformations: DFT-Guided Mechanistic Insights, Machine Learning, and Nano-biocatalyst Engineering for Sustainable Catalysis
Abstract: Computational catalysis has emerged as a transformative scientific discipline that integrates quantum chemistry, molecular modeling, machine learning, and density functional theory (DFT) to understand catalytic mechanisms and design highly efficient catalytic systems for sustainable industrial applications. The increasing global demand for environmentally responsible chemical manufacturing has accelerated research on advanced catalytic materials including transition metal catalysts, metal–organic frameworks (MOFs), homogeneous catalysts, heterogeneous systems, and bimetallic catalysts involving nickel and iron. …
Published in Journal of Catalyst & Catalysis · Vol. 13, Issue 2, 2026 · pp. 36–44 Read article
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Polymer Based Optoelectronics in Clinical Application Treated with Sodium Fluoride and Aqueous Dimethyl Sulfoxide Solutions
Abstract: In polymer science, dimethyl sulfoxide (DMSO) and sodium fluoride (NaF) are frequently combined to dissolve, modify, or treat particular polymers, most notably in the processing of cellulose and the creation of polyvinylidene fluoride (PVDF) membranes. The viscosities, ultrasonic velocities, and sodium fluoride densities of aqueous solutions of dimethyl sulfoxide (DMSO) have been measured at T=303.15, 308.15, 313.15, and 318.15 K. Fluorides (such as NaF or TBAF) help break inter-chain hydrogen …
Published in Journal of Polymer & Composites · Vol. 14, Issue 3, 2026 · pp. 20–29 Read article
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Synthesis of Nanocrystalline Bismuth Ferrite by Solution Combustion Synthesis Method
Abstract: Normal 0 false false false EN-US X-NONE X-NONE The present paper describes a simple method of nanosized BiFeO3 by the solution combustion synthesis using bismuth and iron nitrates as oxidizers and the combination fuel of citric acid and ammonium nitrate, with fuel to oxidizer ratio (Ψ = 1) one. The average crystallite size of BiFeO3 nanoparticles was estimated from the full width half maximum of the X-ray diffraction peaks of …
Published in Journal of Nanoscience, NanoEngineering & Applications · Vol. 1, Issue 2, 2011 · pp. 52–58 Read article
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Acetoxylation of o, m Cresol by Electrochemical Process at Graphite Electrode
Abstract: Electrochemical processes remain unique because of the nature of specific products formed and their mode of formation in which current is a reactive input in place of redox reagents. The high yields of the products can be obtained by designing and optimizing the electrolysis. The ordinary chemical procedures are multi-staged and may result poor yields. Therefore the best way for minimizing the pollution is transformation of conventional chemical processes to …
Published in Journal of Thin Films, Coating Science Technology & Application · Vol. 8, Issue 3, 2021 · pp. 13–21 Read article
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Machine Learning Based Optimization of Polymer Structure Property Relationships in Composite Material Systems
Abstract: In modern engineering applications, polymer-based composite materials have garnered a lot of attention because of their lightweight nature, high strength-to-weight ratio, and changing physical features. In order to maximize the relationships between polymer structure and properties in composite materials, this study suggests a strategy based on reinforcement learning (RL). The research utilized the Polymer Composite Properties Dataset, which contains 12,700 records associated with polymer matrices, reinforcement fillers, interfacial bonding characteristics, …
Published in Journal of Polymer & Composites · Vol. 14, Issue 3, 2026 · pp. 242–255 Read article
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Exploration of Diverse Epoxy-Based Surface Coating Methods for Enhancing Anticorrosion Characteristics
Abstract: Epoxy-based polymers, commonly referred to as polyepoxides, constitute one of the most versatile and widely adopted categories of polymeric materials due to their exceptional structural, mechanical, and chemical characteristics. Their unique macromolecular framework enables strong interfacial bonding, high mechanical stability, and superior resistance to environmental and chemical degradation, positioning them as advanced alternatives to many traditional organic corrosion inhibitors that often fail under prolonged exposure to aggressive conditions When polyepoxides …
Published in Journal of Polymer & Composites · Vol. 14, Issue 2, 2026 · pp. 167–177 Read article
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Efficient Green Synthesis of TiO2 Nanoparticles Using Murraya koenigii Leaf Extract
Abstract: Green synthesis of nanoparticles by plant extract is at present under exploitation due to eco-friendly, non-toxic and inexpensive process. Titanium dioxide (TiO2) nanoparticles were synthesized by ultrasound assisted sol-gel precipitation method using titanium tetra-isopropoxide as a precursor and Murraya koenigii leaf extract as a reducing and stabilizing agent. The leaf extract was prepared under various solvent media such as ethanol and distilled water under controlled ultrasonication. Due to effective ultrasound, …
Published in Journal of Nanoscience, NanoEngineering & Applications · Vol. 6, Issue 1, 2016 · pp. 29–38 Read article