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2841
HYDROGEN DEFECTS ON THE SURFACE OF LEAD-FREE FERROELECTRIC Na\(_{0.5}\)Bi\(_{0.5}\)TiO\(_3\) MATERIALS
Published 2024-08-01“…Hydrogen atomic chemisorption and adsorption at all possible vacancy sites on the surface of perovskite Na0.5Bi0.5TiO3 (110) were explored using calculations from density functional theory. Our calculations reveal that a pristine Na0.5Bi0.5TiO3 (110) surface can exhibit direct and indirect transitions characterized by optical bandgaps of 2.68 eV and 2.75 eV, respectively. …”
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2842
Enhancing Predictive Accuracy Under Data Scarcity: Modeling Molecular Interactions to Describe Sealing Material Compatibility with Bio-Hybrid Fuels
Published 2025-04-01“…Since experimental investigations are time-consuming and costly, this work explores faster physics-motivated data generation approaches by modeling molecular interactions between fuel and sealing materials. Two modeling scales are employed. One calculates the intermolecular distance using density functional theory. …”
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2843
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2844
“Breaches” in the VKP(b) Okrug Organization in the Summer of 1929 – Summer of 1930 (Based on the Materials of Vyatka Okrug of Nizhny Novgorod Krai)
Published 2025-06-01“…The article examines the formation and functioning of the Vyatka Okrug VKP(b) organization in 1929–30, when radical transformations began in the country, primarily in the socio-economic sphere. …”
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2845
Lightweight self-cleaning trans-polyisoprene/multiwalled carbon nanotubes open-cell composite material: Its electromagnetic shielding performance
Published 2021-09-01“…On this basis, the preparation process has been improved, and an open cell superhydrophobic composite material with good electromagnetic interference shielding effectiveness (EMI SE) and self-cleaning functions has been prepared. …”
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2846
A STREET WITH A VIEW OVER THE CENTURIES. THE CERAMIC MATERIAL FROM THE STREET A IN FRONT OF THE CRYPT BASILICA AT HISTRIA (I)
Published 2021-12-01“…Each category is analyzed based on morphological and functional criteria, and the discussion extends to the issue of production centers. …”
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2847
Adsorption of hexavalent chromium by activated carbon obtained from a waste lignocellulosic material ( cores): Kinetic, equilibrium, and thermodynamic study
Published 2018-05-01“…Fourier transform infrared analysis of the adsorbent demonstrated the presence of key functional groups associated with the adsorption phenomenon such as those of hydroxyl and aromatic groups. …”
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2848
Machine-Learning-Guided Design of Nanostructured Metal Oxide Photoanodes for Photoelectrochemical Water Splitting: From Material Discovery to Performance Optimization
Published 2025-06-01“…The rational design of photoanode materials is pivotal for advancing photoelectrochemical (PEC) water splitting toward sustainable hydrogen production. …”
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2849
Sodium Alginate/Cuprous Oxide Composite Materials with Antibacterial Properties: A Preliminary Study Revealing the Counteracting Effects of Oligosaccharides in the Matrix
Published 2025-05-01“…The integration of biopolymers with antimicrobial inorganic materials has emerged as a promising strategy for developing eco-friendly and biocompatible functional materials for food packaging and biomedical applications. …”
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2850
Performance and mechanism of modified backfill grouting materials prepared from EPB shield fine-grained waste soil for resource utilization
Published 2025-07-01“…To surmount these deficiencies, polymers have been developed with the specific purpose of modifying the grouting material. This study investigates the feasibility of preparing modified backfill grouting materials through the resource utilization of fine-grained waste soil. …”
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2851
Fabrication of Hybrid Materials Based on Waste Polyethylene/Porous Activated Metakaolinite Nanocomposite as an Efficient Membrane for Heavy Metal Desalination Processes
Published 2021-01-01“…Hybrid nanostructure materials derived from activated metakaolinite are of growing importance due to their intriguing structural/functional properties and promising biomedical/environmental applications, especially designing desalination membranes. …”
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2852
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2853
Modern Directions of Creating New Protective Materials and Tissues for Means of Individual and Collective Protection against Toxic Chemicals and Pathogenic Microorganisms
Published 2023-07-01“…The analysis of data obtained in the field of creation of filtering and sorbing «self-cleaning» (self-degassing) materials for personal protective equipment showed that these materials can acquire such properties due to their functionalization while using nanosized metalcontaining particles with antibacterial properties, as well as enzymes that catalyze hydrolysis of certain highly toxic compounds and their degradation products.…”
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2854
Extraction and Characterization of Silicon Dioxide from Coal Fly Ash as Counter Electrode Material in Dye-Sensitized Solar Cells (DSSCs)
Published 2024-09-01“…The counter electrode in DSSCs must be made of a material with various advantageous chemical and physical characteristics to guarantee the cell’s efficient functioning and cost efficiency. …”
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2855
Shape memory recovery in polylactic acid and thermoplastic polyurethane bi-material metamaterials fabricated by additive manufacturing under fatigue testing
Published 2025-06-01“…This study advances the field of additive manufacturing by enhancing the design and functionality of shape memory polymers, enabling smarter, more adaptable materials for applications in aerospace. …”
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2856
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2857
Exploring an n-type conducting polymer (BBL) as a potential gas sensing material for NH3 and H2S detection
Published 2025-03-01“…Abstract Conducting polymers (CPs) have garnered significant interest in being used as an active material in gas sensors mainly because of their structural flexibility, ease of synthesis, and enhanced performance at room temperature. …”
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2858
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2859
Sewage sludge-derived biochar modified with MgCl2: Used as adsorbent material for phosphorus removal from aqueous medium
Published 2025-01-01“…Magnesium-functionalized biochar produced from SS has a high capacity for P removal from an aqueous medium, which represents a promising alternative for applying this material as a P fertilizer.…”
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2860
COMPARATIVE EVALUATION OF THE LABORATORY STUDY RESULTS OF THE ADHESION STRENGTH OF A-SILICONE LINING MATERIAL IN THE PRODUCTION OF TWO-LAYER REMOVABLE PROSTHESES
Published 2018-12-01“…The risk of negative influence of unsuccessful selection of dental materials reveals the urgent need to use modern approaches in professional activity in order to provide the necessary quality of structures and their clinical and functional properties. …”
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