Search Results (558)

The impact of 230-MeV Xe¹³² ion irradiation on the structural, optical, and luminescent properties of YAG:Ce single crystals is investigated over a fluence range of 10¹¹–10¹⁴ ions/cm². Optical absorption; cathodo-, X-ray, and photoluminescence; and X-ray diffraction are employed to analyze radiation-induced changes. Irradiation leads to the formation of Frenkel (F, F⁺) and antisite defects and attenuates Ce³⁺ emission (via enhanced nonradiative processes and Ce³⁺ → Ce⁴⁺ recharging). A redistribution between the fast and slow components of the Ce³⁺-emission is considered. Excitation spectra show the suppression of exciton-related emission bands, as well as a shift of the excitation onset due to increased lattice disorder. XRD data confirm partial amorphization and a high level of local lattice disordering, both increasing with irradiation fluence. These findings provide insight into radiation-induced processes in YAG:Ce, which are relevant for its application in radiation–hard scintillation detectors. Full article

Vanillin photoinduced deprotonation was evaluated and analyzed. Vibronic states and transitions were computationally investigated. Optimizations and vertical electron transitions in the gas phase and with the continuum solvation model were computed using the time-dependent density functional theory. Static absorption and emission (photostatic optical) spectra were statistically averaged over the excited instantaneous molecular conformers fluctuating on quantum–classical molecular dynamic trajectories. Photostatic optical spectra were generated using the hybrid quantum–classical molecular dynamics for explicit solvent models. Conical intersection searching and nonadiabatic molecular dynamics simulations defined potential energy surface propagations, intersections, dissipations, and dissociations. The procedure included mixed-reference spin–flip excitations for both procedures and trajectory surface hopping for photodynamics. Insignificant structural deformations vs. hydroxyl bond cleavage followed by deprotonation were demonstrated starting from different initial structural conditions, which included optimized, transition state, and several other important fluctuating configurations in various environments. Vanillin electronic structure changes were illustrated and analyzed at the key points on conical intersection and nonadiabatic molecular dynamics trajectories by investigating molecular orbital symmetry and electron density difference. The hydroxyl group decomposed on transition to a σ-molecular orbital localized on the elongated O–H bond. Full article

With the increasing market demand for spinels of various colors, purple spinel—long regarded as a symbol of nobility—has attracted growing attention. In this study, pinkish-purple to purple spinels from the Mogok region of Myanmar were systematically examined using conventional gemological, spectroscopic, and chemical analytical techniques. Raman analysis reveals that these spinels commonly contain octahedral inclusions composed of calcite, dolomite, magnesite, and graphite. Chemically, the samples are primarily magnesia-alumina spinels. Color variation is influenced by trace elements: increasing Cr and V contents enhance the red hue, while higher Fe concentrations intensify the purple tone. UV–Vis spectra show that Cr³⁺ and V³⁺ jointly contribute to absorptions at 388 nm and 548 nm, with Fe²⁺ and Fe³⁺ responsible for the bands at 371 nm and 457 nm, respectively, together controlling the pink-to-purple color variation. Most samples display four Cr³⁺-related peaks near 700 nm; however, these are absent in deeply purple spinels. In contrast, light pink spinels show weaker absorption at 371 nm and 457 nm, attributed to Fe²⁺ and Fe³⁺. Fluorescence spectra confirm characteristic Cr³⁺ emission bands at 673 nm, 684 nm, 696 nm, 706 nm, and 716 nm, indicating a strong crystal field environment. Raman spectra have peaks mainly around 312 cm⁻¹, 406 cm⁻¹, 665 cm⁻¹, and 768 cm⁻¹. The peaks of the infrared spectrum mainly appear around 840 cm⁻¹, 729 cm⁻¹, 587 cm⁻¹, 545 cm⁻¹, and 473 cm⁻¹. Full article

This study explores the optical properties of a close-packed monolayer composed of core/shell-alloyed CdSeS/ZnS quantum dots (QDs) of two different sizes and compositions. The monolayers were self-assembled in a stacked configuration at the water/air interface using Langmuir–Blodgett (LB) techniques. Under continuous 532 nm laser illumination on the red absorption edge of the blue-emitting smaller QDs (QD450), the red-emitting larger QDs (QD645) exhibited oscillatory temporal dynamics in their photoluminescence (PL), characterized by a pronounced blueshift in the emission peak wavelength and an abrupt decrease in peak intensity. Conversely, excitation by a 405 nm laser on the blue absorption edge induced a drastic redshift in the emission wavelength over time. These significant shifts in emission spectra are attributed to photon- and anisotropic-strain-assisted interlayer atom transfer. The findings provide new insights into strain-driven atomic rearrangements and their impact on the photophysical behavior of QD systems. Full article

The spectroscopic properties of Pr³⁺ ions in the aluminosilicate matrix were investigated for the first time. Synthesis of CaAl₂SiO₆ (CASO) polycrystals doped with Pr³⁺ ions was carried out using the sol–gel method. The crystalline structures have been confirmed with XRD measurement. The absorption, excitation, emission spectra, and time decay profiles of the praseodymium (III) ions were measured and analyzed. It was found that upon excitation with visible light, this material exhibits emission mainly in the UVC region, via an upconversion emission process. The Stokes emission in the visible range is observed mainly from the ³P₀ and ¹D₂ energy levels. The ¹D₂→³H₄ emission is very stable even at very high temperatures. The studied aluminosilicate phosphors possess characteristics that confirm their potential in upconversion emission applications. Full article

Two-dimensional (2D) hybrid organic–inorganic perovskites (HOIPs) have attracted considerable attention in optoelectronic applications, owing to their remarkable characteristics. Nevertheless, the application of 2D HOIPs encounters inherent challenges due to the presence of insulating organic spacers, which create barriers for efficient interlayer charge transport (CT). To tackle this issue, we propose a BA₂MAPb₂I₇/PEA₂MA₂Pb₃I₁₀ bilayer heterostructure, where efficient interlayer energy transfer (ET) facilitates compensation for the restricted charge transport across the organic spacer. Our findings reveal that under 532 nm light illumination, the BA₂MAPb₂I₇/PEA₂MA₂Pb₃I₁₀ heterostructure photodetector exhibits a significant photocurrent enhancement compared with that of the pure PEA₂MA₂Pb₃I₁₀ device, mainly due to the contribution of the ET process. In contrast, under 600 nm light illumination, where ET is absent, the enhancement is rather limited, emphasizing the critical role of ET in boosting device performance. The overlap of the PL emission peak of BA₂MAPb₂I₇ with the absorption spectra of PEA₂MA₂Pb₃I₁₀, alongside the PL quenching of BA₂MAPb₂I₇ and the enhanced emission of PEA₂MA₂Pb₃I₁₀ provide confirmation of the existence of ET in the BA₂MAPb₂I₇/PEA₂MA₂Pb₃I₁₀ heterostructure. Furthermore, the PL enhancement factor followed a 1/d² relationship with the thickness of the hBN layer, indicating that ET originates from 2D-to-2D dipole–dipole coupling. This study not only highlights the potential of leveraging ET mechanisms to overcome the limitations of interlayer CT, but also contributes to the fundamental understanding required for engineering advanced 2D HOIP optoelectronic systems. Full article

The mineral composition of table salt can be indicative of its origin. This work evaluated the possibility of identifying the origin of salt from four countries: Brazil, Spain, France, and Portugal. Eight metals were quantified through flame atomic absorption/emission spectroscopy (FAAS). The possibility of using portable near-infrared spectroscopy (NIR) as a faster and lower-cost alternative for identifying salt provenance was also evaluated. The content of Ca, Mg, Fe, Mn, and Cu was identified as possible markers to differentiate the salt origin. One-class classifiers using FAAS data and DD-SIMCA could discriminate the salt origin with few misclassifications. For NIR spectroscopy, it was possible to highlight the importance of controlling the humidity and granulometry before the spectra acquisition. After drying and milling the samples, it was possible to discriminate between samples based on the interaction between the water of hydration and the presence of the cations in the sample. The Mg, Mn, and Cu are important in identifying the origin of salt using NIR spectra. The DD-SIMCA model using NIR spectra could classify the origin with the same performance as observed in FAAS. However, it is important to emphasize that NIR spectroscopy requires less sample preparation, is faster, and has low-cost instrumentation. Full article

This study reports the synthesis, structural characterization, adsorption studies, nanoscale interaction, and photocatalytic application of pure and Fe-doped ZnS quantum dots for the degradation of the antibiotic cefalexin in aqueous solution. Nanoparticles were synthesized via the microwave-assisted method, and Fe doping was introduced at a 1% molar ratio. HRTEM images confirmed quasi-spherical morphology and high crystallinity, with particle sizes averaging 2.4 nm (pure) and 3.5 nm (doped). XRD analysis showed a consistent cubic ZnS structure. UV-vis spectra showed strong absorption at 316 nm for both samples, and PL measurements revealed emission quenching upon Fe doping. Photocatalytic tests under UV light demonstrated significantly higher degradation rates of 10 ppm cefalexin with Fe-doped ZnS, reaching near-complete removal within 90 min. Adsorption experiments revealed higher affinity and adsorption capacity of Fe-doped ZnS toward cefalexin compared to pure ZnS, as demonstrated by the Freundlich isotherm analyses, contributing significantly to enhanced photocatalytic degradation performance. High-resolution QTOF LC-MS analysis confirmed the breakdown of the β-lactam and thiazolidine rings of cefalexin and the formation of low-mass degradation products, including fragments at m/z 122.0371, 116.0937, and 318.2241. These findings provide strong evidence for the structural destruction of the antibiotic and validate the enhanced photocatalytic performance of Fe-doped ZnS. Full article

Lithium (Li)-rich continental brines found in the Lithium Triangle region in South America are a natural resource of paramount importance. In the present research, the analytical performance of laser-induced breakdown spectroscopy (LIBS) technology was assessed for the quantitative analysis of Li in natural brines aimed at enhancing the efficient exploration of salt flats (called salars). Brine samples were collected from different salars located in the Puna plateau (Northwest Argentina) and analyzed by LIBS in the form of solid pressed pellets. Broadband emission spectra (180–900 nm) were recorded and spectrally analyzed by specially designed computational algorithms. The laser-induced plasmas were characterized by calculating the electron density and the temperature. The Li elemental concentrations in the brines were determined through univariate calibration with the Li I emission line at 670.77 nm by using a suitable set of standards with Li concentrations up to 1300 $\mathsf{\mu }$g/g. The calculated limit of detection was LoD = 0.2 ± 0.1 $\mathsf{\mu }$g/g. The Li content in the brines determined with LIBS showed a good agreement (normalized standard deviation: σ_N = 25%) with the concentrations measured with atomic absorption spectroscopy. The results demonstrated the feasibility of the LIBS technique for the quantitative analysis of Li in natural brines, thus contributing to advancing the exploration of Li-rich resources. Full article

The SPICAV IR spectrometer aboard the Venus Express orbiter measured spectra of the 1.1 and 1.18 μm atmospheric transparency windows at the Venus night side in 2006–2014. The long-term measurements encompassed the major part of the Venus globe, including polar latitudes. For the first time, the H₂O volume mixing ratio in the deep Venus atmosphere at about 10–16 km has been retrieved for the entire SPICAV IR dataset using a radiative transfer model with multiple scattering. The retrieved H₂O volume mixing ratio is found to be sensitive to different approximations of the H₂O and CO₂ absorption lines’ far wings and assumed surface emissivity. The global average of the H₂O abundance retrieved for different parameters ranges from 23.6 ± 1.0 ppmv to 27.7 ± 1.2 ppmv. The obtained values are consistent with recent studies of water vapor below the cloud layer, showing the H₂O mixing ratio below 30 ppmv. Within the considered dataset, the zonal mean of the H₂O mixing ratio does not vary significantly from 60° S to 75° N, except for a 2 ppmv decrease noted at high latitudes. The H₂O local time distribution is also uniform. The 8-year observation period revealed no significant long-term trends or periodicities. Full article

We report new medium-resolution spectroscopy covering the wavelength range from 0.6 to 2.4 $\mathsf{\mu }$m, as well as multi-epoch, multi-wavelength photometry, of the Class I high-mass embedded young stellar object Mol 12 (IRAS 05373+2349). It is embedded ($A_V\simeq 12$) in the centre of a dense core at a distance of 1.59 kpc from the Sun and has a total luminosity of $1.74\times {10}^3{L}_{\odot }$. The spectra show a large number of permitted atomic emission lines, mostly for Fe, H, C, N, and Ca, that originate in the inner zones of a very active protoplanetary disc and no photospheric absorption lines. Conspicuously, the He I line at 1.0830 $\mathsf{\mu }$m displays a complex P-Cygni profile. Also, the first overtone CO emission band-heads at 2.3 $\mathsf{\mu }$m are seen in emission. From the strengths of the principal emission lines, we determined the accretion rate and luminosity to be $\dot{M}\sim {10}^{-5}{M}_{\odot }$ y⁻¹ and $L_{\mathrm{acc}}\sim {10}^3{L}_{\odot }$, respectively. Decade-long light curves show a series of irregular brightness dips of more than four magnitudes in r, becoming shallower as the wavelength increases and disappearing at $\lambda >3\mathsf{\mu }$m. The colour–magnitude diagrams suggest the occurrence of a series of eclipses caused by the passage of small dust cloudlets in front of the star, producing more than 10 magnitudes of extra extinction. Full article

The main objective of this study is to improve heat transfer in hydrocarbon- and geothermal-energy coproduction systems using carbon quantum dots (CQDs). Two types of 0D nanoparticles (synthesized and commercial CQDs) were used for the formulation of nanofluids to increase the heat transfer from depleted wells for the coproduction of oil and electrical energy. The synthesized and commercial CQDs were characterized in terms of their morphology, zeta potential, density, size, and heat capacity. The nanofluids were prepared using brine from an oil well of interest and two types of CQDs. The effect of the CQDs on the thermophysical properties of the nanofluids was evaluated based on their thermal conductivity. In addition, a mathematical model based on heat transfer principles to predict the effect of nanofluids on the efficiency of the organic Rankine cycle (ORC) was implemented. The synthesized and commercial CQDs had particle sizes of 25 and 16 nm, respectively. Similarly, zeta potential values of 36 and 48 mV were obtained. Both CQDs have similar functional groups and UV absorption, and the fluorescence spectra show that the study CQDs have a maximum excitation–emission signal around 360–460 nm. The characterization of the nanofluids showed that the addition of 100, 300, and 500 mg/L of CQDs increased the thermal conductivity by 40, 50, and 60 %, respectively. However, the 1000 mg/L incorporated decreased the thermal conductivities of the nanofluids. The observed behavior can be attributed to the aggregate size of the nanoparticles. Furthermore, a new thermal conductivity model for CQD-based nanofluids was developed considering brine salinity, particle size distribution, and agglomeration effects. The model showed a remarkable fit with the experimental data and predicted the effect of the nanofluid concentration on the thermal conductivity and cycle efficiency. Coupled with an ORC cycle model, CQD concentrations of approximately 550 mg/L increased the cycle efficiency by approximately 13.8% and 18.6% for commercial and synthesized CQDs, respectively. Full article

In this study, we report the synthesis and characterization of Fe₃O₄ nanoparticles coated with dextran. The structural and optical properties of the Dx:Fe₃O₄ synthesized composites were investigated by Fourier Transform infrared (FTIR) spectroscopy, X-ray diffraction (XRD) and UV–Vis absorption spectroscopy. For the first time in this paper, the photophysics of Dx:Fe₃O₄ composites in water is studied using fluorescence and phosphorescence molecular spectrometry. An analysis of the absorption spectra of the Dx:Fe₃O₄ composite reveals the broad absorption bands with maxima at wavelengths of 227 nm, 264 nm, and 340 nm. Dx:Fe₃O₄ composite nanoparticles in water exhibit strong fluorescence with a quantum yield of 0.24% in contrast to 0.07% for dextran. Phosphorescence spectra confirm the formation of new emission bands within the Dx:Fe₃O₄ solution evidenced by the maxima shift for both dextran and Dx:Fe₃O₄ composites. Full article

In this paper, we report on the growth and characterization of high doping concentration (2.1 at%) ytterbium (Yb) doped lithium niobate (Yb:LiNbO₃) crystal. By using a slightly modified Czochralski method, we have successfully grown a usable size (2 mm × 2 mm × 30 mm) Yb:LiNbO₃ single crystal. We also conducted the energy-dispersive X-ray spectroscopy (EDS) and the X-ray diffraction (XRD) analyses, which experimentally confirm that the grown crystal is a Yb:LiNbO₃ single crystal. We also measured the absorption and emission spectra of the grown crystal. It was found out that there is a near-flat broad emission within a spectral range of 1004–1030 nm when excited at 980 nm for this high doping concentration Yb:LiNbO₃ crystal. Such a near-flat broad emission can be very useful for realizing high slope efficiency ultrafast (femtosecond) lasing in the Yb:LiNbO₃ crystal due to the low quantum defect of the Yb:LiNbO₃ crystal. We also investigated the electro-optic effect of the Yb:LiNbO₃. The experimental result confirms that the electro-optic (EO) effect of a highly doped (2.1 at%) lithium niobate crystal is close to the EO value of the pure lithium niobate. Thus, the highly doped Yb:LiNbO₃ crystal can still be an effective electrically tunable lasing medium. It can enable electrically tunable, high slope efficiency femtosecond lasing due to the combined features, including (1) a near flat broad emission spectrum at the spectral range of 1004–1030 nm, (2) a non-compromised electro-optic effect at high doping concentration Yb:LiNbO₃ crystal, and (3) a low quantum defect. Full article

Both tungsten trioxide (WO₃) nanosheet arrays and tungsten trioxide/zinc oxide (WO₃/ZnO) nanocomposites were grown on fluorine-doped tin oxide (FTO) coated glass slides using a hydrothermal method to develop a visible-light-driven photocatalyst with easy reusability. Field emission scanning electron microscopy (FE-SEM) observations confirmed the formation of irregular oxide nanosheet arrays on the FTO surfaces. X-ray diffraction (XRD) analysis revealed the presence of hexagonal WO₃ and wurtzite ZnO crystal phases. UV-Vis diffuse reflectance spectroscopy showed that integrating ZnO nanostructures with WO₃ nanosheets resulted in a blue shift of the absorption edge and a reduced absorption capacity in the visible-light region. Photoluminescence (PL) spectra indicated that the WO 0.5/ZnO 2.0 sample exhibited the lowest electron-hole recombination rate among the WO₃/ZnO nanocomposite sample. Photocatalytic degradation tests demonstrated that all WO₃/ZnO nanocomposite samples had higher photodegradation rates for a 10 ppm methylene blue (MB) aqueous solution under visible-light irradiation compared to pristine WO₃ nanosheet arrays. Among them, the WO 0.5/ZnO 2.0 sample showed the highest photocatalytic efficiency. Furthermore, it exhibited excellent recyclability and high photodegradation stability over three cycles. Full article