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The shielding properties of a Cu-doped Ni–Zn polycrystalline ferrite in the frequency range 1 MHz to 1 GHz were explored. Samples of composition (Cu0.12Ni0.23Zn0.65)Fe2O4 were prepared by the traditional ceramic route. The complex relative permittivity () and permeability () of the absorber ceramics were measured, and the minimum reflection-loss , matching frequency , matching thickness and bandwidth for were calculated using the theory of the absorbing wall. Effect of the main process parameters (pressing pressure P, sintering temperature T, and sintering time t) on the electromagnetic properties and microwave-absorbing characteristics was deeply investigated. The rise of the three selected process parameters was observed to improve the sintered microstructure of the final specimens (monitored by the relative density and the average grain size G), provided that abnormal grain growth does not occurred. The increase in sintered relative density and average grain growth modifies complex permeability and permittivity in the explored frequency range, enhancing the shielding properties of the material. Se han analizado las propiedades de blindaje de una ferrita policristalina de Ni–Zn dopada con Cu en el rango de frecuencia de 1 MHz-1 GHz. Las muestras de composición (Cu0.12Ni0.23Zn0.65)Fe2O4 se prepararon por la ruta tradicional cerámica, midiendo la permitividad () y la permeabilidad () relativas complejas de las cerámicas absorbentes y se calcularon, utilizando la teoría de la pared absorbente, la pérdida por reflexión mínima , la frecuencia a la que se produce esta mínima , el espesor óptimo de pieza y el ancho de banda para . Se ha llevado a cabo una investigación rigurosa del efecto de los principales parámetros del proceso (presión de prensado P, temperatura de sinterización T y tiempo de sinterización t) sobre las propiedades electromagnéticas y los parámetros característicos de estos absorbedores, observándose que el aumento de los tres parámetros de proceso seleccionados mejoran la microestructura final de las muestras sinterizadas (monitorizadas por la densidad relativa y el tamaño medio de grano G siempre que no se produzca un crecimiento anormal del grano. El aumento de la densidad relativa y el tamaño medio de grano de las piezas sinterizadas modifican la permeabilidad y la permitividad complejas en el rango de frecuencia explorado, mejorando las propiedades de blindaje del material. This study has been supported by Ministerio de Economía y Competitividad (Spain) through grant number (MAT2016-76320-R) and by Universitat Jaume I (Spain), grant numbers (UJIB2017-48 and UJIB2020-13). Complex relative permeability and permittivity determination were carried out at the central facilities (Servei Central d’Instrumentació Científica) of the Universitat Jaume I.

Zn0.97Mn0.03S and Zn0.95Mn0.03Cr0.02S nanostructures were synthesized using co-precipitation method. X-ray diffraction analysis confirmed the ZnS cubic phase with preferred orientation along (1 1 1) direction. The shrinkage in crystallite size from 36 A (Zn0.97Mn0.03S) to 26 A (Zn0.95Mn0.03Cr0.02S) and the influence of Cr as well as Mn substitution on the structure and optical nature were examined. The addition of Cr not only diminished the size and also generated more defect related luminescent centres. The elevation in band gap by Cr addition was explained by Burstein–Moss effect and reduced crystallite size. The tuning of transmittance, energy gap as well size of ZnS nanostructure by Mn/Cr doping promote these materials for modern-electronic applications.

In this paper, CuOx@Ag/CeO2 catalysts were synthesized by simple wet-chemical method and equal volume impregnation method. The obtained catalysts were subjected to soot temperature programmed oxidation (soot-TPO) activity tests and were further characterized by various techniques such as X-ray diffraction (XRD), transmission electron microscopy/high-resolution transmission electron microscopy (TEM/HR-TEM), N2 physisorption, X-ray photoelectron spectroscopy (XPS) and H2- temperature programmed reduction (H2-TPR). The results show that CuOx@Ag/CeO2 synthesized presents well controlled core-shell structures, with nano-cube like Cu2O as the core and Ag decorated polycrystalline CeO2 grafting layers as the shell. Such core-shell structured CuOx@Ag/CeO2 can successfully construct a secondary oxygen delivery channel (CuOx → CeO2 → Ag) to effectively transfer bulk oxygen of the catalyst to the soot, resulting in its excellent soot oxidation activity compared to CuOx@CeO2. The potential benefiting effect by Ag introduction over Cu@Ag/Ce can be concluded as: (i) pumping lattice oxygen and accelerating gaseous O2 dissociation to generate significantly increased active surface oxygen content; (ii) modulating a moderate surface oxygen vacancies concentration to maintain more highly active O2– species.

In the present study, a Bi$_2$WO$_6$/ZnWO$_4$ photocatalyst was successfully constructed by a modified hydrothermal synthesis method with different molar concentrations of Bi$_2$WO$_6$ with respect to ZnWO$_4$. The variation in molar concentrations of Bi$_2$WO$_6$ changed the photocatalytic properties of the Bi$_2$WO$_6$/ZnWO$_4$ catalyst. The synthesized Bi$_2$WO$_6$/ZnWO$_4$ photocatalyst was characterized by various techniques to decipher its structural and spectral properties. The interaction of Bi$^{2+}$ ionic charge carriers and many-body effects cause the band gap to narrow in Bi$_2$WO$_6$/ZnWO$_4$, as shown by PL analysis. The decrease in band gap energies (E$_g$) from 4.7 eV (ZnWO$_4$) to 3.5 eV (30% Bi$_2$WO$_6$/ZnWO$_4$) is beneficial because less energy is required to excite the valence electrons. The maximum degradation of Plasmocorinth B dye was found with 30% Bi$_2$WO$_6$/ZnWO$_4$ under UV irradiation. This increased activity of 30% Bi$_2$WO$_6$/ZnWO$_4$ can be attributed to the (i) synergistic effect in the bicrystalline framework of Bi$_2$WO$_6$ and ZnWO$_4$, (ii) the high close contact between Bi$_2$WO$_6$ and ZnWO$_4$, and (iii) the small crystallite size. The photocatalytic activity of synthesized Bi$_2$WO$_6$/ZnWO$_4$ photocatalyst shows its significant potential in water/ wastewater treatment application.

The process parameters for dry reforming of methane (DRM) over Ni–W/Al2O3–MgO catalyst are optimized using response surface methodology (RSM). The Ni–W bimetallic catalyst is synthesized by co-precipitation method followed by impregnation. The catalysts are characterized by BET, XRD, FESEM, EDX and TEM; to study physicochemical properties, morphology, composition, crystallite size and deposited carbon. The effect of process parameters, i.e., reaction temperature (600oC–800 °C) and feed gas ratio (0.5–1.5) on the CH4, CO2 conversions and syngas ratio are studied. A temperature of 777.29 °C with CH4: CO2 of 1.11 at GHSV of 36,000 cm3gm.cat−1h−1, delivered the CH4 and CO2 conversions of 87.6% and 93.3%, respectively along with H2:CO of 1. The predicted process parameters were verified through actual experimental analysis at the optimized conditions, and results agreed with CCD of the RSM model with insignificant error. The MWCNT formed during DRM avoided catalyst deactivation and delivered stable performance over 12 h of reaction test at the optimized conditions.

In this study, β-blocker metoprolol was degraded by photocatalysis and photo-Fenton catalyzed by doped TiO2. The effect of two main variables was elucidated, content and type of doping cation (Fe or Cu). The catalysts were synthesized by Evaporation-Induced Self-Assembly (EISA) method and their performance was compared with typical Degussa P25. All synthesized materials were found to be mesoporous with a specific surface in the range of 121–242 m2/g, they all exhibited anatase phase, and crystallites in the range of 6–10 nm. The use of X-ray photoelectron spectroscopy (XPS) allowed to establish not only the presence of the expected Ti4+ but also Ti3+ species. Cu2+ and Fe3+ species were also identified in the doped catalysts. It was found that the addition of Cu and Fe diminished the energy band gap of synthesized TiO2, from 3.20 eV to 2.58 and 2.64, respectively. The content of Cu is directly correlated with this effect. In photocatalysis, the doping of TiO2 did not have an effect of metoprolol degradation rate. This was improved, however, approximately 60% by the synthesized TiO2 compared to Degussa P25. On the other hand, the photo-Fenton-like process catalyzed by Cu-TiO2 exhibited the highest degradation (total removal) and mineralization extent (90%), being faster than the photocatalytic process and the UV-H2O2 system. Another difference between both methods, was the amount and type of intermediates generated. These were identified by LC-MS. Photo-Fenton catalyzed by Cu/TiO2 can be considered as an effective process with high oxidative power in the metoprolol degradation.

In this communication, structural, dielectric, spectroscopic and electrical characteristics of cerium-modified strontium manganite perovskite of a composition SrMn0.9Ce0.1O3, (SMCO) prepared by a high-temperature solid-state reaction technique have been reported. The preliminary structural analysis of SrMnO3 exhibits hexagonal (P63/mmc) crystal structure, whereas SMCO, synthesized under identical conditions, shows a tetragonal (I4/mmm) structure. The average crystallite size and lattice strain of SMCO using X-ray data were found to be 74 nm and 0.107%, respectively. The surface morphology, study by the scanning electron microscopy (SEM), shows distinct grains of average size of 19.2 μm. The X-ray photoelectron spectroscopy (XPS) study confirms the oxidation state of Mn and Ce as Mn4+ and Ce4+ and composition of SMCO compound. The grains and the grain boundaries play an important role to explain the conduction mechanism. The bulk resistance (Rb) decreases from 1.020 × 105 Ω at 25 °C to 1.096 × 103 Ω at 500 °C. This behaviour of decrease in resistance with the increase in temperature shows semiconductor (negative temperature coefficient resistance) nature of the material at high temperatures. The variation of the activation energies with temperature suggests that the ac conductivity is thermally activated. The immobile charge carriers at low temperatures and defects and oxygen vacancies at high temperatures are responsible for the thermally activated conduction mechanism. Detailed studies of electrical parameters as a function of frequency at different temperatures using dielectric and impedance spectroscopy of SMCO have provided conduction mechanism and structural properties relationship.

Hydrocalumite derived catalysts prepared by co-precipitation with non-noble metal Nickel(Ni) as main active site were tested in ethanol steam reforming, and the influences of Ni (5,10,15 wt%) content were mainly tested in this research. Meanwhile, the physicochemical properties of the prepared catalysts were analyzed through different characterizations including BET, X-ray diffraction (XRD), H2-temperature programmed reduction (H2-TPR) and CO2-temperature programmed desorption (TPD). As the Ni increased, the specific surface area, crystallite size of Ni, reducibility and basicity of catalysts were changed, which further affected their activities. On this basis, the best performance in this catalytic system was presented when Ni in the catalysts was 15 wt%, the ethanol conversion and hydrogen yield could reach almost 100% and 85% at 650 °C respectively. Thus, this kind of catalyst is effective for ethanol steam reforming.

MnOx-Fe3O4 nanomaterials were fabricated by using the innovative scheme of pyrolyzing manganese-doped iron-based metal organic framework in inert atmosphere and exhibited extraordinary performance of NO reduction by CO (CO-SCR). Multi-technology characterizations were conducted to ascertain the properties of fabricated materials (e.g., TGA, XRD, SEM, FT-IR, XPS, BET, H2-TPR and O2-TPD). Moreover, the interaction between reactants and catalysts was ascertained by in situ FT-IR. Experimental results demonstrated that Mn was an ideal promoter for iron oxides, resulting in decrease of crystallite size, improve reducibility property, enhance the mobility and the amount of lattice O2– species, as well as strength the adsorption ability of active NO and CO to form multiple species (e.g., nitrate and carbonate). The unprecedented enhancement of CO-SCR activity over Mn-Fe nanomaterials follows the Eley-Rideal (E-R) and Langmuir-Hinshelwood (L-H) reaction pathway.

The strength of polycrystalline metals increases with decreasing grain size, following the classical Hall-Petch relationship. However, this relationship fails when softening occurs at very small grain sizes (typically less than 10 to 20 nm), which limits the development of ultrahigh-strength materials. In this work, using columnar-grained nanocrystalline Cu-Ag ‘samples’, molecular dynamics simulations were performed to investigate the softening mechanism and explore the strengthening strategies (e.g., formation of solid solution or grain boundary (GB) segregation) in extremely fine nanograined metals. Accordingly, the softening of pure metals is induced by atomic sliding in the GB layer, rather than dislocation activities in the grain interior, although both occur during deformation. The solid solution lowers the stacking fault energy and increases the GB energy, which leads to the softening of NC metals. GB segregation stabilizes GB structures, which causes a notable improvement in strength, and this improvement can be further enhanced by optimizing the solute concentration and GB excess. This work deepens the understanding of the softening mechanism due to atomic sliding in the GB layer and the strengthening mechanism arising from tailoring the GB stability of immiscible alloys and provides insights into the design of ultrahigh-strength materials.

Magnesium (Mg) based alloys are promising candidates for many applications, but their untreated surfaces usually have low strength and hardness. In this study, a single point diamond turning (SPDT) technique was applied to refine the grain size and improve the mechanical properties of the surface layers of Mg-Li alloys. By refining grains in the topmost layer to the nanometer scale (∼ 60 nm), the surface hardness was found to be enhanced by approximately 60%. The atomic plastic deformation process during the SPDT was then studied by the real-time atomistic molecular dynamics (MD) simulations. A series of MD simulations with different combinations of parameters, including rake angle, cutting speed and cutting depth, were conducted to understand their influences on the microstructural evolution and associated plastic deformation mechanisms on the surface layer of the workpieces. The MD simulation results suggest that using increased rake angle, cutting speed and cutting depth can help to achieve better grain refinement. These simulation results, which provide atomic-level details of the deformation mechanism, can assist the parameter design for the SPDT techniques to achieve the high-performance heterogeneous nanostructured materials.

Nanocrystalline copper ferrite shows distinct photocatalytic properties, but it suffers from a high recombination rate of photogenerated electrons (e−) and holes (h+) due to its narrow bandgap. Herein, Al3+ doping is shown to reduce the (e−/h+) recombination rate and improve the charge carriers’ availability in doped CuFe2−xAlxO4 (0 ≤ x ≤ 1) nanoparticles produced by a solid-state, mechanochemical process. CuFe2−xAlxO4 (0 ≤ x ≤ 1) nanoparticles exhibit the growth of a nanocrystalline cubic spinel lattice when annealed at 1000 °C. The lattice parameter is reduced by Al3+ doping due to the smaller ionic radius of Al3+ ions substituting bigger Fe3+ ions. However, a higher degree of sintering and greater crystallite size are observed for Al3+ doped samples. The surface morphology and topography also reveal an increase in the particle size, but significantly narrow size distribution and greater homogeneity. The effect of Al3+ doping on the optical properties of CuFe2−xAlxO4 (0 ≤ x ≤ 1) nanoparticles is demonstrated by a decrease in the photoluminescence signal that is attributed to the lower rate of (e−/h+) recombination. Thus, Al3+ doping increases transition time and improves the availability of charge carriers for potential photocatalytic applications.

The thermal conductivity of uranium oxide (UO2) containing pores and grain boundaries is investigated using continuum-level simulations based on the finite-difference method in two and three dimensions. Steady-state heat conduction is solved on microstructures generated from the phase-field model of the porous polycrystal to calculate the effective thermal conductivity of the domain. The effects of porosity, pore size, and grain size on the effective thermal conductivity of UO2 are quantified. Using simulation results, a new empirical model is developed to predict the effective thermal conductivity of porous polycrystalline UO2 fuel as a function of porosity and grain size.

With the rapid increase in the demand for lithium as an energy-critical element, the recovery of Li+ ions from seawater is a worldwide challenging issue. Herein, we propose a new facile and fast selective recovery approach of Li+ using an Al3+-crosslinked poly(N-isopropylacrylamide) (PNIPAAm)/alginate (Alg) (PNP/Alg(Al)) adsorbent. The in situ TEM images indicate that Alg–Al3+ coordination is reorganized via the rearrangement of PNIPAAm and Alg networks, as the temperature increases. The reorganization eventually leads to the formation of polycrystalline structure. The in situ FTIR results exhibit that PNP/Alg(Al) composite has peculiar phase transitions, which includes a retrogressive phase change from hydrophobic to hydrophilic. The synergetic effect of the strong repulsion force of Al3+ ions and the attractive force of negatively charged polymeric chains enables the efficient adsorption of Li+ ions with a low affinity from Li-spiked seawater. 7.3% of Li+ ions are recovered from Li-spiked seawater although the concentration of Li-spiked seawater is very high. In addition, Li+ ions can be extracted from PNP/Alg(Al) composite with the use of a small thermal energy. The proposed thermoresponsive IPN gel provides a strong potential in practical applications for Li+ recovery as an innovative energy-material strategy.

Simple strategy to stably preserve the smaller Ni nanoparticles (NPs) having homogeneous crystallite size of ∼5 nm was proposed using ordered mesoporous supports under dry reforming of methane with CO2 (DRM). The NPs-impregnated ordered mesoporous SBA-15 was effective to preserve the smaller Ni nanoparticles with their lower thermal aggregations and less coke depositions by their spatial confinement effects inside of the ordered mesopore structures compared to the irregular conventional SiO2 support. Although the highly ordered mesoporous NPs-impregnated Al2O3 was also found to be effective, the acidic natures of the Al2O3 surfaces accelerated coke depositions by preferentially forming inactive phases.

This work examines the properties of polyvinyl alcohol (PVA)/starch film containing glycerol as a plasticizer under exposure to different nitrogen ion fluence. The prepared PVA/starch blend was irradiated with ion fluence from 3 × 1017 to 12 × 1017 ions.cm−2. From FTIR, the ion beam irradiation attack and weakens the C–H bond in PVA/starch blend. From XRD findings, the crystallite size of the blend decreased at 3 × 1017 ions/cm2 while it increased at higher fluence up to 9 × 1017 ion/cm2. This indicates the degradation of the blend at low ion fluence compared to crosslinking at high ion fluence. Also, the optical bandgap of the blend was decreased with an increase in ion fluence. Furthermore, the effect of N+ ions on some optical dispersion parameters is studied. The thermal stability of the PVA/starch blend shows a decrease in thermal stability upon irradiation with 3 × 1017 ions/cm2 compared to higher thermal stability at higher doses up to 9 × 1017 ions/cm2.

Recent studies have shown that many challenges encountered in conventional single crystal growth methods, including high production costs, can be overcome by using the solid-state single-crystal growth (SSCG) approach, which has been recognized as a simple and cost-effective alternative for obtaining single crystals. In this work, Y3Al5O12 (YAG) and Nd3+-doped YAG (Nd:YAG) single crystals were grown via the SSCG method using spark plasma sintering (SPS). The growth of single crystals was initiated at the surface of (110) YAG single-crystal seeds embedded inside YAG and Nd:YAG powder beds, and this growth continued as the surrounding polycrystalline matrix was converted into a single crystal. The application of external pressure during the SPS process has been found beneficial for reducing the porosity of the grown single crystals. Moreover, high Nd3+ doping levels had a positive effect on the conversion kinetics, with a growth rate of almost 50 µm/h, which increased the driving force for single-crystal growth through the solute drag effect. EDS elemental mapping and line scans confirmed the compositional uniformity of the grown single crystals, while EBSD images verified their crystallization in the (110) direction. The obtained results confirm the strong potential of the SSCG technique coupled with SPS for the growth of undoped and highly doped YAG single crystals with excellent quality.

In recent work, pure α-Fe2O3 (F-1) and series of 5% Cu doped Fe2O3 (CF-5) , 10% Cu doped Fe2O3 (CF-10) and 15% Cu doped Fe2O3 (CF-15) nanoparticles by facile chemical coprecipitation method were synthesized to study the effect of concentration of doping for photocatalytic activity. As prepared F-1, CF-5, CF-10, CF-15 nanoparticles were subjected to X-ray diffraction (XRD) and Fourier transform infra-red (FTIR) techniques to analyse the structural and functional groups features. These characterization techniques confirmed the successful doping of Cu 2+ ions in α-Fe2O3. The crystallite size of synthesized samples was calculated by Scherrer formula. Gradually decline in crystallite size from 18 to 15 nm was observed for undoped to doped samples. Scanning electron microscopic (SEM) analysis expressed that doping of Cu reduced the aggregation of particles and enhanced the surface area of nanoparticles. UV–Visible spectroscopic analysis of synthesized samples was used to calculate the bandgap energy of F-1, CF-5, CF-10, CF-15 nanoparticles i.e., 2.0, 1.7, 1.5, 1.4eV respectively. Narrowing bandgap energy of doped hematite supported to perform excellent photocatalytic activity. Maximum degradation of methylene blue was recorded via CF-10 within 140 min. Higher degradation rate of methylene blue by optimal concentration of CF-10 is due to effective electron trapping ability of photocatalyst.

Partial substitution of ZnO for CaO in the wollastonite formula was performed via wet precipitation. The effects of ZnO/CaO replacement on the structure, porosity, morphology, optical, and mechanical properties of the CaO–SiO2 ceramic were examined. Structural results and Fourier transform infrared (FTIR) spectra indicated the existence of mixed phases of wollastonite with hardystonite and willemite with hadystonite composites, depending on the ZnO content. The calculated crystallite size confirmed that the formed composites were in the nanoscale range. The FTIR results verified the mixed phases of the prepared samples. The optical band gap energy (Eg) values of 3.3 and 4.56 eV referred to the willemite phase in samples with high ZnO content. Addition of ZnO increased the bulk density and decreased the porosity of the wollastonite. The reduced porosity controlled the mechanical behavior of the prepared composites. The maximum stress (σu) increased from ∼4.10 to ∼26.68 N/mm2 as the porosity decreased from 52.20% to 40.17% for a ZnO content increased from 0% to 50%. The fracture load increased with the ZnO content. The degradability of samples revealed that the higher the ratio of ZnO to the nominal wollastonite, the more influential it was on the degree of weight loss % and the variation in the pH value. The bioactivity test estimated that all samples surface exposed development of a newly formed apatite layer, consequently evidencing the bioactivity of the prepared ceramic composites. Therefore, such substitution can be used in vital applications.

We report on the influence of Al doping on the structural, morphological and vibrational properties of hematite crystallite synthesized by using the hydrothermal method. The structural property of the pristine and Al doped hematite samples are extensively characterized by the Rietveld profile refinement of X-ray diffraction data. The structural refinement suggests that both the pristine and the doped compounds are stabilized in the hexagonal R 3 c symmetry. Doping with Al induces a compressive strain in the hematite lattice, which is further reflected in the spectroscopic Raman studies. It is also observed that the Al atom has a significant influence on the growth mechanism of hematite crystallites. Temperature dependent Raman study performed in the Al doped hematite sample brings out anomalous behaviour of phonon modes and line widths around the temperature region of 150 K. These anomalies observed around the temperature region of 150 K are suggestive of the presence of spin-phonon coupling associated with the Morin transition in the Al doped hematite. Our detailed structural and Raman spectroscopic analyses suggest that the Al doped hematite can be a potential magnetodielectric candidate.

Thin film of WO3 has been deposited on conductive fluorine tin oxide substrate using the hydrothermal technique. The film's microstructural, morphological and optical properties have been identified using X-ray diffraction, atomic force microscope, and spectrophotometer. The obtained results have confirmed the nanocrystalline structure of the as-received WO3 thin film with crystallite size ≈63.4 nm. Analysis of the absorption coefficient using Tauc's model shows the possibility of direct and/or indirect allowed transition with energy gaps 3.95 and/or 3.45 eV, respectively. The refractive index has been determined by different methods showing the average value (2.2 and 2.3 corresponding to the direct and indirect transitions, respectively). The nonlinear refractive index and third-order nonlinear optical susceptibility have been determined, showing the high polarizability of WO3/FTO with radiation to be promising for different optical devices and applications.

The synthesis of silver doped cobalt oxide nanoparticles by microwave-assisted method and their structural, optical, antibacterial activities are presented in this study. The doping concentrations were chosen as 5, 10, 15, and 20 wt percentages. The sample was undergone powder X-ray diffraction studies and the result shows the good crystalline nature of the sample. Also, the average crystallite size increases from 13.95 nm, 21.26 nm, 26.13 nm, and 28.35 nm with different doping concentrations. The transmission electron microscopy image shows cubic and spherical morphology. The optical properties were tested by UV–vis–NIR absorption spectrum. It indicates the decrease of band gap value. From the antibacterial activity studies, the 20 wt % Ag doped nanoparticles exhibit better activity.