Materials, Volume 16, Issue 23 (December-1 2023) – 257 articles

With the development of mobile electronic devices, there are more and more requirements for high-energy storage equipment. Traditional lithium-ion batteries, like lithium–iron phosphate batteries, are limited by their theoretical specific capacities and might not meet the requirements for high energy density in the future. Lithium–sulfur batteries (LSBs) might be ideal next-generation energy storage devices because they have nearly 10 times the theoretical specific capacities of lithium-ion batteries. However, the severe capacity decay of LSBs limits their application, especially at high currents. In this study, an ionic liquid (IL) electrolyte additive, TDA⁺TFSI, was reported. When 5% of the TDA⁺TFSI additive was added to a traditional ether-based organic electrolyte, the cycling performance of the LSBs was significantly improved compared with that of the LSBs with the pure traditional organic electrolyte. At a rate of 0.5 C, the discharge specific capacity in the first cycle of the LSBs with the 5% TDA⁺TFSI electrolyte additive was 1167 mAh g⁻¹; the residual specific capacities after 100 cycles and 300 cycles were 579 mAh g⁻¹ and 523 mAh g⁻¹, respectively; and the average capacity decay rate per cycle was only 0.18% in 300 cycles. Moreover, the electrolyte with the TDA⁺TFSI additive had more obvious advantages than the pure organic ether-based electrolyte at high charge and discharge currents of 1.0 C. The residual discharge specific capacities were 428 mAh g⁻¹ after 100 cycles and 399 mAh g⁻¹ after 250 cycles, which were 13% higher than those of the LSBs without the TDA⁺TFSI additive. At the same time, the Coulombic efficiencies of the LSBs using the TDA⁺TFSI electrolyte additive were more stable than those of the LSBs using the traditional organic ether-based electrolyte. The results showed that the LSBs with the TDA⁺TFSI electrolyte additive formed a denser and more uniform solid electrolyte interface (SEI) film during cycling, which improved the stability of the electrochemical reaction. Full article

With the continuous expansion of the application range of gob–side entry retaining technology, the depth, height, and advancing speed of coal seams also increase, which brings great problems to the stability control of surrounding rock structures of gob–side entry retaining. As one of the main bearing structures of the surrounding rock, the stability of the roadway–side support body is a key factor for the success of gob–side entry retaining. In order to study the deformation characteristics and instability mechanism of roadway-side support body, based on the roadway–side support materials of gob-side entry retaining, the dynamic expansion test of back–filling concrete cracks under uniaxial compression was carried out. The YOLOv5 algorithm was applied to establish the fine identification and quantitative characterization method of macroscopic cracks of the samples, and the dynamic expansion rule of roadway-side support body cracks and its dimensional effect were revealed by combining the fractal theory. The results show that the F1 value and average precision mean of the intelligent dynamic crack identification model reached 75% and 71%, respectively, the GIoU loss value tends to fit around 0.038, and the model reached the overall optimal solution. During the uniaxial compression process, micro cracks on the surface of the back–filling concrete first initiated at the end, and after reaching the yield stress, the macroscopic cracks developed significantly. Moreover, several secondary cracks expanded, pooled, and connected from the middle of the specimen to the two ends, inducing the overall instability of the specimen. The surface crack expansion rate, density, and fractal dimension all show stage change characteristics with the increase in stress, and the main crack expansion rate has obvious precursor characteristics. With the increase in the size, the decrease in crack density after back–filling concrete failures gradually decreases from 93.19% to 4.08%, the surface crack network develops from complex to simple, and the failure mode transits from tensile failure to shear failure. The above research results provide a basic experimental basis for design optimization and instability prediction of a roadway–side support body for engineering-scale applications. Full article

The modern lifestyle has increased our utilization of pollutants such as heavy metals, aromatic compounds, and contaminants that are of rising concern, involving pharmaceutical and personal products and other materials that may have an important environmental impact. In particular, the ultimate results of the intense use of highly stable materials, such as heavy metals and chemical restudies, are that they turn into waste materials, which, when discharged, accumulate in environmental water bodies. In this context, the present review presents the application of metal–organic frameworks (MOFs) in electrochemiluminescent (ECL) sensing for water pollutant detection. MOF composites applied as innovative luminophore or luminophore carriers, materials for electrode modification, and the enhancement of co-reaction in ECL sensors have enabled the sensitive monitoring of some of the most common contaminants of emerging concern such as heavy metals, volatile organic compounds, pharmaceuticals, industrial chemicals, and cyanotoxins. Moreover, we provide future trends and prospects associated with ECL MOF composites for environmental sensing. Full article

Thin-walled and thick-walled microcellular moldings were obtained by MuCell^® technology with nitrogen as a supercritical fluid. 2 mm thick polyamide 6 (PA6) with 30% wt. glass fiber (GF) samples were cut from automotive industrial elements, while 4 mm, 6 mm, and 8.4 mm thick moldings of PA6.6 with 30% wt. GF were molded into a dumbbell shape. The internal structure was investigated by scanning electron microscopy (SEM) and X-ray computed microtomography (micro-CT) and compared by numerical simulations for microcellular moldings using Moldex3D^® 2022 software. Young’s modulus, and tensile and impact strength were investigated. Weak mechanical properties of 2 mm thick samples and excellent results for thick-walled moldings were explained. SEM pictures, micro-CT, and simulation graphs revealed the tendency to decrease the cell size diameter together with increasing sample thickness from 2 mm up to 8.4 mm. Full article

This paper presents an innovative method of producing a low-density, high-strength, thin cement sheet. A seaweed powder was mixed with Portland cement, a foaming agent, calcium sulfoaluminate (CSA), and a quantity of water to create an A4-sized thin sheet with a thickness of 7 mm, which can withstand 1.5 kg in weight. This sheet was then covered with ethylene vinyl acetate and a backsheet to create a sandwiched cement sheet. The advantages of this sandwiched cement sheet are two-fold. First, it can support up to 13 kg in a static mechanical loading test, without bending, for over eight hours. Second, it can be quickly recovered at the end of its life cycle. This was a preliminary experiment to produce a large cement sheet that could satisfy the loading requirements for a solar panel. The purpose of the large, thin cement sheet is to replace the glass in a conventional solar panel and create a lightweight solar panel of less than 10 kg, which would mean that the installation of solar panels would become a one-person operation rather than a two-person operation. It would also increase the efficiency of the solar panel installation process. Full article

The use of adhesive bonding in diverse industries such as the automotive and aerospace sectors has grown considerably. In structural construction, adhesive joints provide a unique combination of low structural weight, high strength and stiffness, combined with a relatively simple and easily automated manufacturing method, characteristics that are ideal for the development of modern and highly efficient vehicles. In these applications, ensuring that the failure mode of a bonded joint is cohesive rather than adhesive is important since this failure mode is more controlled and easier to model and to predict. This work presents a numerical technique that enables the precise prediction of the bonded joint’s behavior regarding not only its failure mode, but also the joint’s strength, when inorganic fillers are added to the adhesive. To that end, hollow glass particles were introduced into an epoxy adhesive in different amounts, and a numerical study was carried out to simulate their influence on single lap joint specimens. The numerical results were compared against experimental ones, not only in terms of joint strength, but also their failure pattern. The neat adhesive, which showed 9% and 20% variations in terms of failure load and displacement, respectively. However, looking at the doped configurations, these presented smaller variations of about 2% and 10% for each respective variable. In all cases, by adding glass beads, crack initiation tended to change from adhesive to cohesive but with lower strength and ductility, correctly modeling the general experimental behavior as intended. Full article

In this work, were synthesized (Pb_0.91La_0.09)(Zr_0.65Ti_0.35)_0.9775O₃ ceramic materials with different concentrations of praseodymium (0, 0.1, 0.3, 0.5, 1 wt.%) via gel-combustion route and sintered by the hot uniaxial pressing method. Measurements were conducted on the obtained ceramics using X-ray powder diffraction (XRD), scanning electron microscope (SEM), EDS analysis, and examination of dielectric and ferroelectric optical properties. Results give us a detailed account of the influences of the praseodymium ions on the structural, microstructural, and dielectric properties. 3D fluorescence maps and excitation and emission spectra measurements show how a small admixture changes the ferroelectric relaxor behavior to an optically active ferroelectric luminophore. Full article

The interactions between displacement cascades and three types of structures, dislocations, dislocation loops and grain boundaries, in BCC-Fe are investigated through molecular dynamics simulations. Wigner–Seitz analysis is used to calculate the number of point defects induced in order to illustrate the effects of three special structures on the displacement cascade. The displacement cascades in systems interacting with all three types of structure tend to generate more total defects compared to bulk Fe. The surviving number of point defects in the grain boundary case is the largest of the three types of structures. The changes in the atomic structures of dislocations, dislocation loops and grain boundaries after displacement cascades are analyzed to understand how irradiation damage affects them. These results could reveal irradiation damage at the microscale. Varied defect production numbers and efficiencies are investigated, which could be used as the input parameters for higher scale simulation. Full article

This study considers 12 pervious concrete mixes incorporating 100% recycled coarse aggregate from old concrete demolition waste and containing various amounts of natural fine aggregate and date palm leaves fibers. First, the properties of the recycled aggregate in terms of their particle size distribution, abrasion resistance, crushing values, specific gravity and water absorption are obtained. Next, the pervious concrete density, compressive strength, tensile strength, permeability and porosity are determined by experimental testing following the relevant standards. The results are analyzed and compared to determine the influence of using recycled coarse aggregate in the mixtures and the impact of the amount of natural sand and volume fraction of the fibers on the mechanical properties, permeability and porosity of the concrete. Findings of the study showed that the use of recycled coarse aggregate in pervious concrete without fine aggregate reduced the compressive strength by 36% and tensile strength by 57%. Replacing 11.7% of the recycled coarse aggregate with natural sand and adding date palm leaves fibers in an amount equivalent to 0.64% volumetric content to such concrete helped increase the compressive strength by 16.2% and tensile strength by 3.2% above the corresponding strengths of the control mix. There is a clear relationship between permeability and porosity due to their correlation with the density of pervious concrete, and the effect of porosity on tensile strength is more influential than it is on the compressive strength. An equation that can predict the tensile strength of pervious concrete from the compressive strength is proposed, as a function of the natural fine aggregate fraction of the coarse aggregate and volumetric content of natural fibers. Results of the research confirm the feasibility of using recycled aggregate in pervious concrete mixes and the positive impact of natural fibers on the mechanical properties. Full article

CuCr₂Se₄ nanoparticles were obtained by the high-energy ball milling of CuCr₂Se₄ single crystals, which had a size of approximately 32 nm after 5 h of milling. Structural, magnetic, and electrical studies have shown that a reduction in CuCr₂Se₄ single crystals to the nanosize leads to (1) a weakening of ferromagnetic interactions, both long and short range, (2) a lack of saturation of magnetization at 5 K and 70 kOe, (3) a change in the nature of electrical conductivity from metallic to semiconductor, and (4) a reduction in the thermoelectric power factor S²σ by an order of magnitude of 400 K. The above results were considered in terms of the parameters of the band model, derived from the high-temperature expansion of magnetic susceptibility and from the diffusive component of thermoelectric power. Theoretical calculations showed a significant weakening of both the superexchange and double exchange mechanisms, a reduction in the [Cr³⁺,Cr⁴⁺] band width from 0.76 to 0.19 eV, and comparable values of the Fermi energy and the activation energy (0.46 eV) in the intrinsic region of electrical conductivity. The main advantage of high-energy ball milling is the ability to modify the physicochemical properties of already existing compounds for desired applications. Full article

Ultrathin solid slabs often have properties different from those of the bulk phase. This effect can be observed both in traditional three-dimensional materials and in van der Waals (vdW) solids in the few monolayer limit. In the present work, the band gap variation of the CdTe slabs, induced by their thickness, was studied by the density functional theory (DFT) method for the sphalerite (zinc-blende) phase and for the recently proposed inverted phase. The sphalerite phase has the Te–Cd–Te–Cd atomic plane sequence, while in the inverted phase Cd atoms are sandwiched by Te planes forming vdW blocks with the sequence Te–Cd–Cd–Te. Based on these building blocks, a bulk vdW CdTe crystal was built, whose thermodynamical stability was verified by DFT calculations. Band structures and partial densities of states for sphalerite and inverted phases were calculated. It was demonstrated for both phases that using slabs with a thickness of one to several monolayers for sphalerite phase (vdW blocks for inverted phase), structures with band gaps varying in a wide range can be obtained. The presented results allow us to argue that ultrathin CdTe can be a promising electronic material. Full article

In the presented study, UV LEDs (365 nm) or a medium-pressure mercury lamp (UV-ABC) were verified as UV radiation sources initiating the photocrosslinking process of varnishes based on novel photopolymerizable phosphorus (meth)acrylate oligomers. Coating formulations were composed of (meth)acrylic/styrene telomers with terminal P-atoms (prepared via a UV phototelomerization process) and different photoinitiators (HAPs, APOs, or APO blends). The kinetics of the UV crosslinking process of the coating formulations depending on UV irradiation and the UV range was investigated by the photo-DSC method. Moreover, the hardness of the varnishes and the conversion of double bonds using the FTIR method were tested. The photopolymerization rate and the photoinitiation index, depending on the type of photoinitiator, were as follows: APOs < APO blends < HAPs. However, the highest coating hardness results were obtained using the least reactive photoinitiator from the APO group, i.e., Omnirad TPOL, or a mixture of three different types of acylphosphine (Omnirad BL 750). The greater effectiveness of the above-mentioned APOs over HAP was also demonstrated when using a UV LED lamp at 365 nm with a low UV dose and UV irradiance, thanks to the presence of phosphoric acid diester in the coating composition, acting as both a telogen and an antioxidant. Full article

The microstructure evolution of 2196 Al-Li alloy during aging was investigated by microhardness test, transmission electron microscope (TEM) analysis and in situ resistivity measurement. The results showed that the resistivity of the 2196 Al-Li alloy during aging rapidly decreased during the first few hours, and then gradually increased after reaching the minimum value, which is temperature−dependent. The microstructure of the alloy was dominated by the δ′ phase after aging at 160 °C for 2 h while the T₁ phase could hardly be seen until it had been aged for 16 h. As the aging time went on, significant ripening appeared for the δ′ phase while typical growth could be observed for the T₁ phase. The increase in the resistivity of the 2196 Al-Li alloy during aging was attributed to the stronger electron scattering capacity of the T₁ precipitation and the coupling effect between the T₁ and δ′ phases. Full article

Laminate substrates in advanced IC packages serve as not only the principal heat dissipation pathway but also the critical component governing the thermomechanical performance of advanced packaging technologies. A solid and profound grasp of their thermomechanical properties is of crucial importance to better understand IC packages’ thermomechanical behavior. This study attempts to introduce a subregion homogenization modeling framework for effectively and efficiently modeling and characterizing the equivalent thermomechanical behavior of large-scale and high-density laminate substrates comprising the non-uniform distribution and non-unidirectional orientation of tiny metal traces. This framework incorporates subregion modeling, trace mapping and modeling, and finite element analysis (FEA)-based effective modeling. In addition, the laminates are macroscopically described as elastic orthotropic or elastic anisotropic material. This framework is first validated with simple uniaxial tensile and thermomechanical test simulations, and the calculation results associated with these two effective material models are compared with each other, as well as with those of two existing mixture models, and direct the detailed FEA. This framework is further tested on the prediction of the process-induced warpage of a flip chip chip-scale package, and the results are compared against the measurement data and the results of the whole-domain modeling-based effective approach and two existing mixture models. Full article

Background: Xenogenous bone has been proposed as an alternative to overcome the disadvantages of autogenous grafting. The aim of the present study was to study bone dynamics at inlay and onlay xenografts used for bone augmentation applying a ring technique. Methods: The bone at the lateral surface of the mandibular angle of 12 adult male New Zealand White rabbits was exposed bilaterally. The cortical layer received multiple perforations on one side of the mandible, and a xenograft block of collagenated cancellous equine bone, 7 mm in diameter and 3 mm in width, was fixed on the prepared surface using an implant (onlay group). On the opposite side, a defect 7 mm in diameter and 3 mm in depth was prepared, and the xenograft block was adapted to the defect and fixed with an implant (inlay group). Results: After ten weeks of healing, in the onlay grafts, new bone was mainly formed on the trabeculae surface, reaching in some specimens the most coronal regions of the block. In the inlay grafts, new bone was found arranged on the trabecular surfaces but also occupying the spaces among the trabeculae. The entrance of the defect was often found close to the top of the block by newly formed bone. A higher percentage of new bone was found in the inlay (19.0 ± 9.3%) compared to the onlay (10.4 ± 7.4%) groups (p = 0.031). The mean gain in osseointegration at the implant in relation to the base of the original 3 mm deep defect was 0.95 ± 1.05% in the onlay group and 0.78 ± 0.71% in the inlay group (p = 0.603). Conclusion: The inlay grafts exhibited a higher new bone percentage than the onlay block grafts possibly due to the defect conformation that presented more sources for bone growth. The trabecular conformation and the composition of the grafts made possible the expression of the osteoconductive properties of the material used. This resulted, in several specimens, in the growth of bone on the graft trabeculae toward the most superior regions in both groups and in the closure of the coronal entrance of the defects in the inlay group. The clinical relevance of this experiment is that the ring technique applied as an inlay method could be suitable for bone augmentation. Full article

In this work, a novel approach is suggested to grow bilayer fibers by combining electrospinning and atomic layer deposition (ALD). Polyvinyl alcohol (PVA) fibers are obtained by electrospinning and subsequently covered with thin Al₂O₃ deposited at a low temperature by ALD. To burn the PVA core, the fibrous structures are subjected to high-temperature annealing. Differential scanning calorimetry (DSC) analysis of the PVA mat is performed to establish the proper annealing regime for burning off the PVA core and obtaining hollow fibers. The hollow fibers thus formed are covered with a ZnO layer deposited by ALD at a higher temperature within the ALD window of ZnO. This procedure allows us to prepare ZnO films with better crystallinity and stoichiometry. Different characterization methods—SEM, ellipsometry, XRD, and XPS—are performed at each step to investigate the processes in detail. Full article

The compatibility of the wrought Al-Ca alloy with the element Fe was investigated in the present study. In this work, both the Al-Ca alloy and Al-Ca-Fe alloy were synthesized through melting, casting, heat treatment, and rolling. A new ternary Al-Ca-Fe eutectic phase, identified as Al₁₀CaFe₂ with an orthorhombic structure, demonstrated enhanced performance, as revealed by nanoindentation tests. Combining the results of the nanoindentation and EBSD, it can be inferred that during the rolling and heat treatment process, the divorced eutectic phases were broken and spheroidized, and the structure of the Fe-rich alloy became finer, which promotes the formation of fine grains during the process of dynamic recrystallization and effectively hindered the grain growth during thermal treatment. Consequently, the strength of the as-rolled Al-Ca alloy was improved with the addition of 1 wt.% Fe while the ductility of the alloy was maintained. Therefore, adding Ca into the high-Fe content recycled aluminum altered the form of the Fe-containing phases in the alloy, effectively expanding the application scope of recycled aluminum alloy manufacturing. This approach also offered a method for strengthening the Al-Ca aluminum alloys. Compared to the traditional approach of reducing Fe content in alloys through metallurgical means, this study opened a new avenue for designing novel, renewable aluminum alloys highly compatible with impurity iron in scrap. Full article

Concrete, as an engineering material with extremely wide applications, is widely used in various infrastructure projects such as bridges, highways, and large buildings. However, structures such as highways and bridges often need to be situated in variable and harsh service environments for long periods. They not only face cyclic reciprocating vehicle loads but also have to contend with the effects of temperature cycling. Therefore, studying the impact and mechanism of temperature differential cycling on the compressive strength and fatigue life of cement concrete has certain theoretical significance and practical value. This study employed a comprehensive experimental design to investigate cement concrete specimens subjected to typical temperature variations (20–60 °C) and different numbers of temperature differential cycling (0, 60, 120, 180, 240, 300). Axial compressive strength tests, ultrasonic tests, and compressive fatigue tests were conducted. The axial compressive strength test measured the compressive strength of the cement concrete. It was found that with an increase in the number of temperature differential cycling, the compressive strength exhibited a trend of an initial increase followed by a decrease: at 60 cycles, the strength increased by 10.8%, gradually declined; returned to near-initial strength at 120 cycles, and continued decreasing, reaching a decline of 19.4% at 300 cycles. The ultrasonic test measured the ultrasound velocity of the concrete specimens after different temperature differential cycling. It revealed a decreasing trend in ultrasound velocity with an increase in times of temperature differential cycling, showing a strong linear relationship between the ultrasound velocity loss and strength loss, confirming the correlation between the degree of concrete strength degradation and internal damage. The compressive fatigue test analyzed the fatigue life variation in cement concrete under different times of temperature differential cycling and stress levels, showing good adherence to the Weibull distribution pattern. Based on the approximation assumptions of log-normal distribution and the Weibull distribution, the Weibull distribution parameters for the compressive fatigue life of cement concrete under temperature differential cycling were obtained. Full article

The objective of this study was to formulate dip coatings, incorporating casein, NaOH, and nanocrystalline hydroxyapatite (nanoHAp), with self-healing properties for application on ZnMg3.2 wt.% alloy in the field of biomedical applications. This study hypothesizes that the self-healing mechanism within the layer will impede substrate degradation by progressively filling defects where chlorides from simulated body fluids intervene. Furthermore, it aims to mitigate potential damage effects during the implantation process by the layer’s self-healing capabilities. The research focused on the dip-coating process parameters and chemical composition of baths for producing casein coatings on Zn alloy surfaces. This study investigated the impact of casein and NaOH concentration, along with the immersion time of ZnMg3.2 wt.% samples in the coating bath, on the self-healing capability of the coating under simulated human body fluid conditions (Ringer’s solution, temperature: 37 °C). Effective technology was developed by selecting specific chemical compositions and immersion times in the coating bath, enhancing the self-healing progress against coating damage in Ringer’s solution at 37 °C. The most significant self-healing effect was observed when the ZnMg3.2 wt.% substrate underwent a 1 h immersion in a coating bath containing 2 g of casein, 4 g of NaOH, and 0.1 g of nanoHAp powder. Electrochemical tests were instrumental in determining the optimal casein concentration and immersion time of the Zn alloy in the coating bath. Full article

This study aims to investigate the combined effect of niobium (Nb) microalloying and austenite grain refinement, using a specific heat treatment cycle, on the microstructure and tribological properties of Armox 500T steel. In this work, Nb addition and thermal cycling were utilized for grain refinement and enhancement of the mechanical properties of Armox 500T alloy, to provide improved protection via lightweight armor steel components with a high strength-to-weight ratio. The kinetics of transformation of the developed Armox alloys were studied using JMATPro version 13.2. The samples were subjected to two austenitizing temperatures, 1000 °C and 1100 °C, followed by 4 min of holding time and three consecutive thermal and rapid-quenching processes from 900 °C to room temperature. Scanning electron microscopy with energy dispersive X-ray analysis (SEM-EDX) was employed to analyze the microstructure, which primarily consists of four types of martensite: short and long lath martensite, blocky martensite, and equiaxed martensite. Additionally, a small percentage (not exceeding 3%) of carbide precipitates was observed. The wear characteristics of the investigated alloys were evaluated using a pin-on-disc tribometer. The results demonstrate that alloying with Nb and grain refinement using a thermal cycle significantly reduce the wear rate. Full article

Thorium monocarbide (ThC) is interesting as an alternative fertile material to be used in nuclear breeder systems and thorium molten salt reactors because of its high thermal conductivity, good irradiation performance, and wide homogeneous composition range. Here, the influence of carbon vacancy site and concentration on lattice distortions in non-stoichiometric ThC_1−x (x = 0, 0.03125, 0.0625, 0.125, 0.1875, 0.25, or 0.3125) is systematically investigated using first-principle calculations by the projector augmented wave (PAW) method. The energy, mechanical parameters, and thermodynamic properties of the ThC_1-x system are calculated. The results show that vacancy disordering has little influence on the total energy of the system at a constant carbon vacancy concentration using the random substitution method. As the concentration of carbon vacancies increases, significant lattice distortion occurs, leading to poor structural stability in ThC_1−x systems. The changes in lattice constant and volume indicate that ThC_0.75 and ThC_0.96875 represent the boundaries between two-phase and single-phase regions, which is consistent with our experiments. Furthermore, the structural phase of ThC_1−x (x = 0.25–0.3125) transforms from a cubic to a tetragonal structure due to its ‘over-deficient’ composition. In addition, the elastic moduli, Poisson’s ratio, Zener anisotropic factor, and Debye temperature of ThC_1-x approximately exhibit a linear downward trend as x increases. The thermal expansion coefficient of ThC_1−x (x = 0–0.3125) exhibits an obvious ‘size effect’ and follows the same trend at high temperatures, except for x = 0.03125. Heat capacity and Helmholtz free energy were also calculated using the Debye model; the results showed the C vacancy defect has the greatest influence on non-stoichiometric ThC_1−x. Our results can serve as a theoretical basis for studying the radiation damage behavior of ThC and other thorium-based nuclear fuels in reactors. Full article

The pre-sintered preform (PSP) is an advanced technology for repairing the Ni-based superalloy blade in a turbine. In general, boron is added to the Ni-based superalloys in small quantities (<0.1 wt.%) to increase boundary strength and cohesivity. Despite this, the effect of high B content (>1.0 wt.%) on the microstructure evolution and mechanical properties in Ni-based superalloys for the PSP application is rarely studied. The variety, composition and evolution of the precipitates during solution heat treatment in the alloy with high B content were determined by EBSD, EPMA and SEM. The results indicate that Cr, W and Mo-rich M₅B₃ type borides precipitate from the matrix and its area fraction reaches up to about 8%. The area fraction of boride decreases with the prolonging of solution time and the increase of temperature higher than 1120 °C. The borides nearly disappear after solution treatment at 1160 °C for 2 h. The redissolution of boride and eutectic results in the formation of B-rich area with low incipient melting (about 1189 °C). It can bond metallurgically with the blade under the melting point of the blade, which decreases the precipitation of harmful phases of the blade after PSP repairing. The microhardness within the grain in the PSP work-blank first decreases (lower than 1160 °C) and then increases (higher than 1185 °C) with the increase of solution heat treatment temperature due to the dissolving and precipitation of borides. The tensile strength of the combination of PSP work-blank and Mar-M247 matrix at room temperature after solution treatment is related to the area fraction of boride, incipient melting and the cohesion between PSP work-blank and Mar-M247 matrix. Full article

The development of energy storage systems (ESS) has become an important area of research due to the need to replace the use of fossil fuels with clean energy. Redox flow batteries (RFBs) provide interesting features, such as the ability to separate the power and battery capacity. This is because the electrolyte tank is located outside the electrochemical cell. Consequently, it is possible to design each battery according to different needs. In this context, zinc–bromine flow batteries (ZBFBs) have shown suitable properties such as raw material availability and low battery cost. To avoid the corrosion and toxicity caused by the free bromine (Br₂) generated during the charging process, it is necessary to use bromine complexing agents (BCAs) capable of creating complexes. As an overview, the different BCAs used have been listed to compare their behavior when used in electrolytes in ZBFBs. In addition, the coulombic and energy efficiencies obtained have been compared. Full article

In the present study, the properties of Cu(Ag) alloy films were studied to evaluate their potential use as an alternate material for interconnection in hybrid bonding. Thin alloy films of Cu(Ag) were deposited by pulsed electrochemical deposition (PED) using a sulfuric acid-based bath, rotating disk electrode, and hot entry. Secondary ion mass spectrometry (SIMS) was used to measure the silver content of the films, with us finding that it decreases with increasing duty cycle. Thereafter, bright field scanning transmission electron microscope (STEM) imaging in combination with energy-dispersive x-ray spectroscopy (EDS) was used to visualize the thin film microstructure and to confirm the uniform distribution of silver throughout the film, with no bands being seen despite the pulsed nature of the deposition. Film resistance was measured by a four-point probe to quantify the impact of Ag content on resistivity, with us finding the expected linear relationship with the Ag content in the film. Furthermore, the coefficient of thermal expansion (CTE) of the films was measured using X-ray diffraction, and modulus and hardness were measured via nanoindentation, revealing linear dependences on the Ag content as well. Notably, the addition of 1.25 atom% Ag resulted in a significant increase in the CTE from 17.9 to 19.3 ppm/K, Young’s modulus from 111 to 161 GPa, and film hardness from 1.70 to 3.99 GPa. These simple relationships offer a range of properties tunable via the duty cycle of the pulsed plating, making Cu(Ag) a promising candidate for engineering wafer-to-wafer metal interconnections. Full article

Surface enrichment in Al, Si, and Cr can greatly improve high temperature oxidation resistance of many alloys. Al, Si, and Cr coatings are commonly applied via simple slurries or more complex pack cementation processes. Due to the high melting point of Cr, the deposition of Cr-based diffusion coatings by the slurry technique has proved challenging, and to date, Cr has mostly been applied by pack cementation. Here, a novel Cr-Si coating process via the slurry technique is described which has been developed and then demonstrated on two Ni-based superalloys, Rene 80 and Inconel 740H. The addition of Si to the slurry lowers the melting point via a Cr-Si eutectic and enables the formation of a liquid phase during heat treatment. Through this Cr-Si slurry coating process diffusion layers enriched by Cr and Si of about 150 µm were achieved. Oxidation behavior was studied through isothermal exposures at 900 °C for 1000 h in lab air. Uncoated Rene 80 and IN740H both showed formation of a Ti-containing Cr₂O₃ scale below a thin TiO₂ top layer. Underneath the external scale a zone of internally oxidized Al grew over the exposure time and reduced the load-bearing cross-section progressively. In comparison, the Cr/Si-coated samples did not show internal Al oxidation, but a slow-growing Si-rich oxide film underneath the external Cr₂O₃ scale. This subscale represents an additional oxygen diffusion barrier. Thus, the weight gain during exposure for the coated samples was significantly lower than for the uncoated materials. Full article

The adsorption of actinide ions (Am(III) and U(VI)) from aqueous solutions using pristine and oxidized carbon fabrics was investigated by means of batch experiments at different pH values (pH 4, 7 and 9) and temperatures (25, 35 and 45 °C) under ambient atmospheric conditions. The experimental results indicated that both the pH and the fabric texture affected the adsorption rate and the relative removal efficiency, which was 70% and 100% for Am(III) and U(VI), respectively. The K_d (L/kg) values for U(VI) were generally found to be higher (2 < log₁₀(K_d)< 3) than the corresponding values for Am(III) adsorption (1.5 < log₁₀(K_d) < 2). The data obtained from the experiments regarding the temperature effect implied that the relative adsorption for both actinides increases with temperature and that adsorption is an endothermic and entropy-driven reaction. The application of the fabrics to remove the two actinides from contaminated seawater samples showed that both the relative removal efficiency and the K_d values decreased significantly due to the presence of competitive cations (e.g., Ca²⁺ and Fe³⁺) and complexing anions (CO₃²⁻) in the respective waters. Nevertheless, the removal efficiency was still remarkable (50% and 90% for Am(III) and U(VI), respectively), demonstrating that these materials could be attractive candidates for the treatment of radionuclide/actinide-contaminated waters. Full article

Background: Symmetric sigmoidal models with four parameters based on an idealized S/Z-shaped curve are commonly used to analyze the optical parameters of thermochromic materials. However, our experimental findings show that this approach leads to systematic errors involving the incorrect estimation of the transition temperature or the possibility of a virtual indication of the hysteresis nature of a reversible thermochromic change. For this reason, we sought to find a five-parameter model that would appropriately avoid this problem. Methods: Two commercial thermochromic pigments were used for the test and applied to a textile substrate at different concentrations. The optical properties were measured using reflectance spectrophotometry and then converted to Kubelka–Munk function values and colorimetric coordinates. The following statistics were used to assess the quality of the selected sigmoidal models: coefficient of determination, R²; adjusted coefficient of determination, AR²; root mean square error, RMSE; and Akaike Information Criterion, AIC. Results: The four-parameter models were compared with each other and with the five-parameter models using nested F-tests based on residual variance to obtain a statistical measure of superior performance. For all thermochromic color change data examined, the five-parameter models resulted in significantly better fitting. It could be shown that the five-parameter model showed significantly higher accuracy and precision in determining the transition temperature, like non-sigmoidal quantification methods. Conclusions: We concluded that the asymmetric five-parameter model is a valuable extension of the symmetric model in the investigation of thermochromic color changes, providing better parameter estimates and a new approach to investigating the mechanisms contributing to the asymmetry of the thermochromic curve. Full article

During a fire, ordinary Portland cement (OPC) systems lose their mechanical properties. For this reason, it is important to find a way to protect it. This study suggested alternative uses of slag and phosphogypsum to produce coatings for fire-resistant applications. Five compositions of 10 mm thick alkali-activated slag coatings were investigated. In these compositions, different amounts of phosphogypsum (1%, 3%, 5%, 7%, and 10%) were used. In the first stage of this study, the residual compressive strength of samples with the coatings based on alkali-activated slag was compared to the results of OPC concrete samples without coatings. The experimental results showed that a higher residual compressive strength of 33.2–47.3 MPa OPC concrete was achieved for the samples with coatings. Meanwhile, the residual compressive strength of the uncoated samples was 32.37 MPa. In the second stage, OPC concrete samples were reinforced with fiberglass polymer (FRP) rods, and they had a similar positive effect on alkali-activated coatings. After exposure to higher temperatures, the pullout tests of the glass FRP bars showed that the adhesion strength was (9.44 MPa) 43.9% higher for the samples with coatings compared to the samples without coatings (6.56 MPa). Therefore, a higher bond strength can be maintained between concrete and FRP bars. Alkali-activated slag with 3% phosphogypsum can be used for the production of fire-resistant coating. These coatings could protect OPC concrete and reinforced concrete with glass FRP bars from fire. Full article

A series of fibrous meshes based on liquid crystalline polyurethane/POSS composites were prepared. Two types of polyhedral oligomeric silsesquioxanes (POSSs) of different structures were chosen to show their influence on electrospun fibers: aromatic-substituted Trisilanolphenyl POSS (TSP-POSS) and isobutyl-substituted Trisilanolisobutyl POSS (TSI-POSS) in amounts of 2 and 6 wt%. The process parameters were selected so that the obtained materials showed the highest possible fiber integrity. Moreover, 20 wt% solutions of LCPU/POSS composites in hexafluoroisopropanol (HFIP) were found to give the best processability. The morphology of the obtained meshes showed significant dependencies between the type and amount of silsesquioxane nanoparticles and fiber morphology, as well as thermal and mechanical properties. In total, 2 wt%. POSS was found to enhance the mechanical properties of produced mesh without disrupting the fiber morphology. Higher concentrations of silsesquioxanes significantly increased the fibers’ diameters and their inhomogeneity, resulting in a lower mechanical response. A calorimetric study confirmed the existence of liquid crystalline phase formation. Full article

We present an in-depth investigation into the Radiation-Induced Segregation (RIS) phenomenon in Ni-Cr alloys. All the pivotal factors affecting RIS such as surface’s absorption efficiency, grain size, production bias, dose rate, temperature, and sink density were systematically studied. Through comprehensive simulations, the individual and collective impacts of these factors were analyzed, enabling a refined understanding of RIS. A notable finding was the significant influence of production bias on point defects’ interactions with grain boundaries/surfaces, thereby playing a crucial role in RIS processes. Production bias alters the neutrality of these interactions, leading to a preferential absorption of one type of point defect by the boundary and consequent establishment of distinct surface-mediated patterns of point defects. These spatial patterns further result in non-monotonic spatial profiles of solute atoms near surfaces/grain boundaries, corroborated by experimental observations. In particular, a positive production bias, signifying a higher production rate of vacancies over interstitials, drives more Cr depletion at the grain boundary. Moreover, a temperature-dependent production bias must be considered to recover the experimentally reported dependence of RIS on temperature. The severity of radiation damage and RIS becomes more pronounced with increased production bias, dose rate, and grain size, while high temperatures or sink density suppress the RIS severity. Model predictions were validated against experimental data, showcasing robust qualitative and quantitative agreements. The findings pave the way for further exploration of these spatial dependencies in subsequent studies, aiming to augment the comprehension and predictability of RIS processes in alloys. Full article