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1969 articles for “quantum mechanics/molecular mechanics (QM/MM)” (ranking capped at the first 2,000 matches — narrow the search to see the rest)
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Characterization and Fabrication of Particle Board from Banana Fiber and Sawdust as A Hybrid Composite
Abstract: The current global landscape emphasizes the search for eco-friendly and regenerative materials. Utilizing environmentally available fibers in conjunction with polymeric resins through efficient manufacturing processes offers a cost-effective solution with high-quality standards. Polymer matrix composites with fiber reinforcements possess several advantages, including low production costs, ease of fabrication, and improved material properties, making them applicable in a wide range of industrial contexts. This paper emphasizes the creation of Particle boards …
Published in Journal of Polymer & Composites · Vol. 13, Issue 3, 2025 · pp. 192–200 Read article
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Investigating the Effect of Rubber as Partial Coarse Aggregate Replacement on Concrete Performance
Abstract: The growing challenge of managing scrap tire waste presents an opportunity for recycling these durable materials into concrete production. This research investigates the mechanical properties of concrete with waste tire rubber chips incorporated as a partial replacement for coarse aggregates at 0%, 5%, 10%, and 15% by volume. The study evaluates workability, compressive strength, and tensile strength, alongside durability assessments in a 5% sulphuric acid solution. Initial findings indicate that …
Published in Journal of Industrial Safety Engineering · Vol. 11, Issue 3, 2024 · pp. 11–17 Read article
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Investigation of Electronic Transport in Li2O and ZnO Nanoparticles Containing Polypyrrole Systems
Abstract: Polypyrrole systems having nanocrystalline ZnO and Li2O with different compositions (PPy50 + Li2Ox + ZnO(50-x), where x = 0, 2, 4, 6, 8, and 10) have been produced by ball milling. compositions of the type The temperature-dependent DC conductivity of each sample was determined in the temperature range of 313 K to 363 K. The conductivity studies show that Polaron hopping was the conducting mechanism in the material composites. The …
Published in Journal of Polymer & Composites · Vol. 12, Issue 6, 2024 · pp. 88–95 Read article
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A comprehensive study on elemental analysis and sustainable integration of CETP (common effluent treatment plant) sludge as a substitute to sand in concrete
Abstract: This study examines the utilization of sludge from common effluent treatment plants (CETP) as a fractional substitute for sand in M20 concrete mixtures. Its aim is to address disposal challenges associated with CETP sludge while promoting sustainable use of natural resources. The research assesses the structural and microstructural attributes of concrete mixes containing varying percentages of CETP sludge (0%, 10%, 20%, 30%, 40%, and 50%). Tests conducted include compressive, flexural, …
Published in Journal of Polymer & Composites · Vol. 13, Issue 1, 2025 · pp. 49–59 Read article
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Evaluation of Bio-Based Polymer Composites Containing Guava Leaf Extract for Antimicrobial Functionality
Abstract: This study explores the formulation of an herbal soap using guava leaf extract as a primary ingredient. Guava leaves are a rich source of biopolymers like pectin and cellulose, which may contribute to the binding properties in the soap. The antimicrobial activity of the soap was evaluated against common skin pathogens (Staphylococcus aureus, Trichoderma spp., Aspergillus spp.). The formulated soap exhibited inhibitory effects against all tested pathogens. The weight, foaming …
Published in Journal of Polymer & Composites · Vol. 13, Issue 1, 2025 · pp. 875–880 Read article
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Use of Coconut Fibre as a Suitable pH and Rheology Enhancer
Abstract: This paper studied the use of coconut fibre as a substitute for caustic soda in drilling fluids for the improvement of pH in a water-based mud. The coconut coir was dried in the sun for 7 hours and ground into very fine particles, after which it was placed in an electronic oven at a temperature of 105°C for 1 hour to remove any remaining moisture. Sieving using a 200 mm …
Published in Journal of Petroleum Engineering & Technology · Vol. 14, Issue 3, 2024 · pp. 01–10 Read article
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Effect of Steel Fibre on the Flexural Strength of Self- Compacting Concrete
Abstract: With the increase in demand in the construction industry Self-Compacting Concrete is becoming more popular due to its versatile nature of improved efficiency. But the SCC possesses some properties which makes it brittle under tensile forces. The behavior of SCC as a structural material can be improved with the addition of Steel Fibres in adequate amount. In fact, the fibre reinforcement mechanism can convert the brittle behavior of concrete into …
Published in Journal of Polymer & Composites · Vol. 13, Issue 1, 2025 · pp. 230–239 Read article
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Investigating The Feasibility of Basalt Fiber as A Carbon Fiber Substitute in Composites for Automotive Applications
Abstract: The escalating carbon footprint, a consequence of dwindling natural resources and surging energy demand, necessitates immediate measures to mitigate environmental impact. This prompted the current study: to look at alternative manufacturing materials that could be utilized as a carbon-free substitute without compromising on mechanical properties. Basalt fiber was identified as a potential eco-friendly replacement to carbon fiber which has several advantages over carbon fiber and is entirely natural and biodegradable. …
Published in Journal of Polymer & Composites · Vol. 13, Issue 1, 2025 · pp. 275–285 Read article
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Impact of Shape, Size and Crystal Structure on Vacancy Related Properties of Gold Nanoparticles
Abstract: It is necessary to consider defects to explain the electron movement, thermal transport and mechanical properties of materials. In the present study, a simple quantitative model for cohesive energy of nanoparticles is extended to determine the size, shape and crystal structure effect on vacancy formation energy, vacancy entropy, and vibrational frequency in free surface Au nanoparticles. Vacancy entropy variation with size has been studied for spherical, regular octahedral, regular hexahedral …
Published in Journal of Polymer & Composites · Vol. 13, Issue 1, 2025 · pp. 223–229 Read article
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Effect of Polymer Fiber on Concrete Made with Artificial Fine Aggregate from Demolished Buildings
Abstract: This research describes an experimental investigation that assesses the impact of polymer fiber and artificial fine aggregate on concrete properties. Polymer fiber, on the other hand, has the potential to function as a superplasticizer additive, which might lead to concrete's superior elasticity, higher strength, and reduced rate of water absorption. Thus, an experimental inquiry was conducted to ascertain the ideal admixture dose and investigate the consequences of admixture overdosage. Also, …
Published in Journal of Polymer & Composites · Vol. 13, Issue 1, 2025 · pp. 286–296 Read article
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Utilization of Clay as Source Material in Geopolymer and Alkali Activated Concretes: A State of Art Review
Abstract: This innovative research looks at the use of clay as source material for geopolymer and alkali- activated concrete, with a focus on how they could promote green construction practices and perhaps replace Portland cement. Alkali-activated concretes and geopolymers offer low-carbon, eco-friendly alternatives by utilizing natural minerals and industrial wastes. Particularly clay is a plentiful and adaptable option for these cutting-edge products. This review looks at different kinds of clay, like …
Published in Journal of Polymer & Composites · Vol. 13, Issue 1, 2025 · pp. 635–654 Read article
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Harnessing Ethylene and Brassinosteroids for Enhanced Agricultural Productivity and Food Quality
Abstract: This study provides a comprehensive review of the roles of ethylene and brassinosteroids, two vital hormonal regulators in plants, focusing on their impact on fruit ripening, stress responses, and overall plant growth. Ethylene, a gaseous plant hormone, is recognized as a key regulator in various physiological processes, particularly in the maturation of fruits. Its involvement in the ripening process has profound implications for agricultural practices, as it directly influences the …
Published in International Journal of Trends in Horticulture · Vol. 1, Issue 2, 2024 · pp. 29–32 Read article
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Evaluation of Impact Strength and Hardness for Polymer Matrix Composites with Steel, Carbon and Glass Reinforcements for Automotive Applications
Abstract: Polymer matrix composites (PMCs) play a crucial role in a wide range of engineering submissions, owing to their impressive strength-to-weight ratio and customizable mechanical properties. This research focuses on examining how PMCs, enhanced with different materials, specifically carbon fibres, glass fibres, and steel fibres, behave when subjected to dynamic and static loading conditions. The study involves creating three distinct types of PMC specimens, each reinforced with one of the mentioned …
Published in Journal of Polymer & Composites · Vol. 13, Issue 1, 2025 · pp. 738–748 Read article
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Advancements In Hydrogenated Diamond-Like Carbon Thin Film Deposition & Surface Modification
Abstract: Materials synthesis and processing are pivotal in advancing technologies across domains such as electronics and biomedical applications. This review provides a detailed exploration of recent advancements in thin film deposition techniques, focusing on hydrogenated diamond-like carbon (HDLC) films and various surface modification methodologies. Beginning with an overview of HDLC films, the paper highlights their unique properties and wide-ranging applications, emphasizing their importance in modern materials science. Key sections of the …
Published in Journal of Polymer & Composites · Vol. 13, Issue 1, 2025 · pp. 761–777 Read article
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Synthesis of Lawsonia Inermis (Henna) Carbon Supported AgO Nanocomposite, Characterizations and Photocatalytic Activity Studies
Abstract: Synthesis of Carbon supported AgO nanocomposite is reported for first time. Henna carbon was successfully synthesized from henna leaf. Bare AgO and C-AgO nanocomposites are effectively made using precipitation method. The synthesised composites structural, morphological, and optical properties are assessed using FT-IR, XRD, FE-SEM, UV-DRS, and PL techniques. FT-IR analysis proved that specific functional groups of synthesized materials. The uniform distribution of the composites is revealed in the FE-SEM. XRD …
Published in Journal of Polymer & Composites · Vol. 13, Issue 1, 2025 · pp. 749–760 Read article
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Energy Harvesting Circuits with Piezoelectric Material: Design, Integration, and Optimization
Abstract: Piezoelectric energy harvesters (PHE) have drawn significant interest as a method of harvesting environment energy to power because of its compatibility and high energy density. Integrating piezoelectric energy harvesters into wireless sensor networks, Internet of Things (IoT)) devices, and wearable electronics enhances their functionality and also increases sustainability. This integration can be lead to the development of self-powered devices that can operate continuously without the need for external power sources. …
Published in Journal of Polymer & Composites · Vol. 13, Issue 1, 2025 · pp. 1028–1039 Read article
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Drilling Parameters Optimization in LM6/B4C/Fly ash Hybrid Composites by Taguchi Technique
Abstract: Aluminium matrix composites (AMCs) are challenging to machine due to its abrasive characteristics. Because of the broad adoption of MMCs, it is vital to create sufficient equipment to facilitate efficient manufacturing. The current study utilizes signal-to-noise ratio (S/N) analysis to determine the ideal machining parameters for drilling AMC’s. The goal with this study is to investigate the effect of feed rate (FR), drill type (D), speed (SS), reinforcing material R …
Published in Journal of Polymer & Composites · Vol. 13, Issue 1, 2025 · pp. 890–897 Read article
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Investigation of Chopped Basalt Strands for Concrete Beams Structures
Abstract: The current work unveils a sort of strategy for hacked basalt strands supported for cement footers. The material used to develop the bars are hacked basalt fiber, waterway sand, coarse total and fine total. In this the mechanical and flexure conduct of basalt fiber with differing rate to be utilized to test the crystal and advanced esteem is use to project the pillar. Absolutely six bars is projected out of …
Published in Journal of Polymer & Composites · Vol. 12, Issue 6, 2024 · pp. 233–240 Read article
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Design Optimization of Linseed Thresher for Higher Efficiency
Abstract: Linseed, a valuable Rabi crop grown for both grain and fiber, has seen rising demand across industries, boosting interest in optimizing its production processes. Recognizing this, SVCAET and RS at IGKV Raipur conducted a study focused on improving the design and efficiency of linseed threshing technology. The research aimed to develop an optimized head cut type linseed thresher, addressing both design and performance factors. Three distinct prototypes were designed, varying …
Published in International Journal of Manufacturing and Production Engineering · Vol. 2, Issue 2, 2024 · pp. 24–32 Read article
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Integrative Machine Learning Approaches for Predicting the Rheological Behaviour of Soft Magnetorheological Elastomers
Abstract: Magnetorheological Elastomers (MREs) are advanced composite materials known for their ability to alter mechanical properties under external magnetic fields, making them highly valuable in adaptive damping systems, vibration control, and smart devices. The accurate prediction of rheological behavior in soft MREs remains a significant challenge due to the complex interplay between material composition and magnetic fields. To address this challenge, this study employs a multi-pronged approach that integrates traditional material …
Published in Journal of Polymer & Composites · Vol. 13, Issue 1, 2025 · pp. 1083–1096 Read article