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Materials

Materials is an international peer-reviewed, open access journal on materials science and engineering published semimonthly online by MDPI.
The Spanish Materials Society (SOCIEMAT), Manufacturing Engineering Society (MES) and Chinese Society of Micro-Nano Technology (CSMNT) are affiliated with Materials and their members receive discounts on the article processing charges.
Indexed in PubMed | Quartile Ranking JCR - Q2 (Metallurgy and Metallurgical Engineering | Physics, Applied | Physics, Condensed Matter)

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All Articles (55,113)

This study systematically investigates the influence of temperature on the defect formation mechanisms in uranium nitride (UN) crystals using first-principles calculations. The formation energies and lattice distortion characteristics of various defects at 0 K and 1780 K were calculated by constructing models of perfect crystals as well as vacancy, interstitial, antisite, and divacancy defects. The results demonstrate that elevated temperatures significantly reduce defect formation energies, with interstitial and divacancy defects exhibiting negative formation energies at 1780 K, indicating a tendency for spontaneous formation. The U interstitial defect induces the most pronounced lattice expansion of 5.1% at 0 K. Furthermore, interstitial defects cause the most significant lattice distortions, while Schottky defects exhibit the lowest formation energy. The current study provides theoretical insights into the defect behavior of UN fuel under high-temperature service conditions and offers valuable guidance for optimizing sintering process parameters.

16 March 2026

DFT model set up and validation. (a) the atomic model of the UN; (b) defect formation energy of UN as compared to the Kotomin’s data; (c) Convergence test of plane-wave cutoff energy (ENCUT); (d) Convergence test of K-point mesh density. Note: K/n*n*n represents the K point density used for the structural optimization and calculation.

Antimicrobial Nanomaterials in the Food Industry: Applications in Meat Packaging

  • Catalina-Elena Constantin,
  • Alina Maria Holban and
  • Carmen Curutiu
  • + 1 author

A thorough understanding of the microbial ecology of meat products, dominated by critical pathogens such as Salmonella spp., Campylobacter jejuni, Escherichia coli, and Listeria monocytogenes, and marked by risks of resistant biofilm formation and vulnerabilities specific to informal commercial sectors, underscores the need to transition from conventional inert barriers to active nanostructured packaging systems. This review critically analyses the current state of antimicrobial nanomaterials, dissecting their molecular mechanisms of action and dynamic interactions designed to preserve sensory and nutritional food quality. Beyond technical effectiveness, the paper highlights the inherent tension between technological innovation and toxicological uncertainties, addressing major challenges related to migration kinetics in complex lipid matrices and the uneven global regulatory landscape. Main limitations of frequently investigated materials, along with regulatory discrepancies among international authorities and safety variables, are discussed to contextualise the current barriers to industrial implementation. We conclude that although nanotechnology represents a transformative force for extending shelf life, safety validation through rigorous assessment of migration remains imperative to harmonise scientific progress with public health protection. This integrative perspective highlights the imperative of calibrating nanostructural architecture to the bioactive profile, providing strategic design directions essential for the sustainable translation of experimental innovation to industrial scale.

16 March 2026

Conceptual workflow illustrating the deployment of nanoparticles in active food packaging systems, from nanomaterial production to functional incorporation within polymeric matrices. (A) Two principal synthesis pathways are depicted: conventional top-down/chemical routes, which may entail elevated energy demand and the use of hazardous solvents or reagents, and bottom-up “green” synthesis, in which plant extracts supply reducing and capping constituents that govern nucleation, growth kinetics, and colloidal stability, yielding nanoparticles with a comparatively improved environmental profile. (B) Nanoparticle integration (e.g., AgNPs and ZnO NPs) into a polymer matrix (e.g., chitosan) is schematised via representative processing strategies—solution casting and extrusion—through which nanofiller dispersion and interfacial interactions are tuned, thereby determining the resulting material architecture and performance. The downstream outputs include nanocomposite films for active packaging (enhanced barrier functionality and antimicrobial/antioxidant activity mediated by material-dependent contact effects and/or controlled release) and smart packaging formats, wherein nanomaterials serve as sensing or indicating elements (e.g., colourimetric or electrochemical responses) to support in situ monitoring of product quality throughout refrigerated storage and distribution (created in BioRender.com, accessed on 5 February 2026).

The aim of this work was to develop a model using Artificial Neural Networks (ANN) to predict stem cutting parameters for giant miscanthus. Experimental studies were conducted to determine biometric traits: maximum stem diameter (Dmax), minimum stem diameter (Dmin), stem wall thickness (THwall), and strength parameters (cutting force, cutting work) for two giant miscanthus genotypes, depending on the internode number (NrNod) and water content (MC). A total of 600 measurement results were obtained, which were randomly divided into training (60%), test (20%), and validation (20%) subsets. Two semantic models were adopted: one for predicting stem cutting force (ann1) and one for predicting cutting work (ann2). The independent variables (ANN inputs) were: Gen, MC, NrNod, Dmax, Dmin, and THwall. The ANN creation process was performed using Statistica Neural Networks. For each of the two semantic models (ANN1 and ANN2), 100 neural networks were developed, with the top 10 ANNs retained for further analysis. The criterion for selecting the best neural network was the root mean square error (RMSE) for the test subset. For ANN1, the RMSE values varied from 6.89 N to 8.70 N. For ANN2, the RMSE values varied from 0.086 J to 0.102 J. For the most accurate ANN1-03 (MLP 7-10-1), used to predict grass cutting force, the RMSE values were 6.46 N–6.89 N–4.70 N for the training, test, and validation subsets. For the most accurate ANN2-02 (MLP 7-10-1), used to predict grass cutting work, the RMSE values were 0.0646 J–0.0857 J–0.0596 J for the training, test, and validation subsets.

16 March 2026

Schematic diagram of the experimental methodology: (A) Representation of the miscanthus stem and internodes used for sample preparation; (B) measurement setup for determining the characteristic dimensions of samples: Dmin—minimum stalk diameter, Dmax—maximum stalk diameter and THwall—stalk wall thickness; (C) a scheme of a static cutting test; (D) development of artificial neural networks [40].

Dual-phase layered microstructures containing alternating regions of soft and hard phases can produce alloys with a unique combination of strength and ductility. In this study, the molecular dynamics (MD) method was utilized to simulate nanoindentation of a Ni/NiTi/Ni nanostructured film (NSF). This film features a unique alternating FCC/B2/FCC microstructure, in which the B2-phase NiTi acts as a superelastic shape memory alloy (SMA). The results indicate that Ni/NiTi/Ni NSF significantly reduces its hardness due to the superelasticity of the B2 phase. The presence of the NiTi interlayer effectively blocks the propagation path of dislocations and stacking faults by transforming the local dislocations transferred from the upper layer into a large-scale coordinated phase transition, significantly reducing local deformation misalignment. As the thickness of the surface film λ increases, the dislocation slip plane propagating horizontally appears in the upper pure Ni layer. The thicker the surface film, the more horizontal slip planes are formed. This study provides new insights into the contact mechanical behavior of nanostructured films based on NiTi shape memory alloys from the perspective of atomic scale.

16 March 2026

Models of four different Ni/NiTi/Ni nanostructured films: (a–c) λ = 18.3164 Å, 36.6329 Å, and λ = 61.0548 Å, respectively; (d) pure Ni film.

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Materials - ISSN 1996-1944