Electron Energy Research Articles

Optimizing the content of Li2CO3, Na2SO4 and TEA in fly ash–cement system by response surface methodology

With an optimized dosage, hardening accelerators become a vital means of modifying fly ash-cement system (FAC). This study comprehensively investigated the mechanical properties of FAC modified by Li2CO3, Na2SO4, and triethanolamine (TEA) under different dosages, and optimized the dosage of accelerators through the response surface method (RSM). The synergistic effect of accelerators on the hydration of FAC was characterized by thermogravimetric differential scanning calorimetry (TG-DSC), X-ray diffraction (XRD), scanning electron microscopy (SEM) and energy dispersive X-ray spectroscopy (EDS). The results demonstrated that the factors and response value followed a quadratic polynomial model. The regression coefficients R2 of the model were all greater than 0.9, indicating good agreement with the experimental data. The content of Li2CO3 and Na2SO4 had an extremely significant effect on the compressive strength of 1d and 3d, followed by TEA. The optimal mix ratio predicted by RSM was 0.12% Li2CO3, 0.47% Na2SO4, and 0.40% TEA. Early hydration stages revealed that the combined action of these accelerators increased the formation of CH, CaCO3, and amorphous C-(A)-S-H gel. Microscopically, the surface of fly ash exhibited alkali-induced corrosion, thereby enhancing its pozzolanic reactivity.

Auroral 3D structure retrieval from the Juno/UVS data

Context. Jovian auroras, the most powerful in the Solar System, result from the interaction between the magnetosphere and atmosphere of Jupiter. While the horizontal morphology of these phenomena has been widely studied, their vertical structure, determined by the penetration depth of the magnetospheric electron into the auroral regions, remains relatively unexplored. Previous observations, including those from the Hubble Space Telescope (HST), have addressed this question to a limited extent. Aims. In this study we aim to map the vertical structure of Jovian auroral emissions. Methods. Using observations from Juno’s UltraViolet Spectrograph (UVS), we examined the vertical structure of the auroral emissions. Building on a recent study of auroral energy mapping based on UVS observations that mapped the average energy of precipitating electrons in the Jovian auroral regions, we find a relationship between this average energy and the volume emission rate (VER) of H2 for two types of electron energy distributions: monoenergetic and a kappa distribution with κ = 2.5. Results. Using brightness maps, we derived the 3D VER structure of Jovian auroras in both northern and southern regions, across multiple spacecraft perijoves (PJs). By considering the example of PJ11, we find that the average altitude of the VER peak in the polar emission region is approximately ~250 km for the monoenergetic distribution case and ~190 km for kappa distribution case. In the main emission region, we find that the average altitude of the VER peak is approximately ~260 km for the case of monoenergetic distribution and ~197 km for kappa distribution case. For the other PJs, we obtained results that are very similar to those of PJ11. Conclusions. Our findings are, on average, consistent with measurements from the Galileo probe and the HST observations. This study contributes to a better understanding of the complexity of Jovian auroras and highlights the importance of using Juno observations when probing their vertical structure. Considering the variability in the κ parameter in the auroral region, we also studied the impact of this variability on the vertical structure of the auroral emission. This sensitivity study reveals that the influence of the κ parameter on our results was very weak. However, the impact of the κ variability on the VER amplitude shows that there is an influence on the thermal structure and chemical composition of the atmosphere in the auroral regions.

Layer Resolved Cr Oxidation State Modulation in Epitaxial SrFe0.67Cr0.33O3-δ Thin Films.

Understanding how doping influences physicochemical properties of ABO3 perovskite oxides is critical for tailoring their functionalities. In this study, SrFe0.67Cr0.33O3-δ epitaxial thin films were used to examine the effects of Fe and Cr competition on structure and B-site cation oxidation states. The films exhibit a perovskite-like structure near the film/substrate interface, while a brownmillerite-like structure with horizontal oxygen vacancy channels predominates near the surface. Electron energy loss spectroscopy shows Fe remains Fe3+, while Cr varies from ∼Cr3+ (tetrahedral layers) to ∼Cr4+ (octahedral layers) within brownmillerite phases and becomes ∼Cr4.5+ in perovskite-like phases. Theoretical simulations indicate that Cr-O bond arrangements and the way oxygen vacancies interact with Cr and Fe drive Cr charge disproportionation. High-valent Cr cations introduce additional densities of states near the Fermi level, reducing the optical bandgap from ∼2.0 eV (SrFeO2.5) to ∼1.7 eV (SrFe0.67Cr0.33O3-δ). These findings offer insights into B-site cation doping in the perovskite oxide framework.

Monte Carlo modeling of the origin of contaminant electrons on a 0.5T bi-planar Linac-MR.

In the last decade, hybrid linear accelerator magnetic resonance imaging (Linac-MR) devices have evolved into FDA-cleared clinical tools, facilitating magnetic resonance guided radiotherapy (MRgRT). The addition of a magnetic field to radiation therapy has previously demonstrated dosimetric and electron effects regardless of magnetic field orientation. This study uses Monte Carlo simulations to investigate the importance and efficacy of the magnetic field design in mitigating surface dose enhancement in the Aurora-RT, focusing specifically on contaminant electrons, their origin, and energy spectrum. The Aurora-RT 0.5 T Biplanar Linac-MR device was modeled using the BEAMnrc package using the updated EM macros, a magnetic field map generated from Opera 3D. Simulation generated phasespace data at the distal side of the first magnetic pole plate (89cm) and at machine isocenter (120cm) were analyzed with respect to electron energy spectra and electron creation origins, both with and without the static magnetic field. The presence of the main magnetic field was verified to affect the origin and distribution of contaminant electrons, removing them from the air column up to 60cm from the target, and focusing them along the CAX within the region below. Analysis of the remaining electron energy fluence reveals the net removal of electrons with energies>2 MeV and generation of electrons with energies<2 MeV in the presence of the static magnetic field as compared to no magnetic field. Moreover, in the presence of the magnetic field the integral energy contained in the contaminant electrons increases from 89cm to isocenter but is still 15% less overall than the integral energy contained in contaminant electrons without the magnetic field. This study provides an analysis of contaminant electrons in the Aurora-RT 0.5 T Linac-MR, emphasizing the role of magnetic field design in successfully minimizing electron contaminants.

Investigating the occurrence and predictability of pitch angle scattering events at ADITYA-Upgrade tokamak with the electron cyclotron emission radiometer

This paper describes the experimental analysis and preliminary investigation of the predictability of pitch angle scattering (PAS) events through the electron cyclotron emission (ECE) radiometer signals at the ADITYA-Upgrade (ADITYA-U) tokamak. For low-density discharges at ADITYA-U, a sudden abnormal rise is observed in the ECE signature while other plasma parameters are unchanged. Investigations are done to understand this abrupt rise that is expected to occur due to PAS. The rise time is as fast as 100 μs with a single step and/or multiple step rise in ECE radiometer measurements. This event is known to limit the on-axis energy of runaway electrons. Being a repetitive event, the conditions of its repetitive occurrence can be investigated, thereby exploring the possibility of it being triggered and surveyed as an alternate runaway electron mitigation plan. Functional parameterization of such events with other discharge parameters is obtained and the possibility to trigger these events is discussed. PREDICT code is used to investigate the possible interpretations for the PAS occurrence through modeling and supporting the ECE observations. The trigger values so obtained experimentally are set as input criteria for PAS occurrence. Preliminary modeling investigations provide reliable consistency with the findings.

Coronal Cementum and Reduced Enamel Epithelium on Occlusal Surface of Impacted Wisdom Tooth in a Human

Background: There is only limited research on the coronal cementum of a tooth, and the mechanisms of its forming process are not well-defined. This report presents a coronal cementum on the occlusal surfaces of enamel in an impacted wisdom tooth in a human, which is not nearly the cervical portion. Materials and Methods: The tooth (Tooth #1) was derived from a 46-year-old female. Histological analysis, including hematoxylin and eosin (HE) and toluidine blue (TB) staining, and Scanning Electron Microscopy and Energy Dispersive X-ray Spectrometer (SEM-EDS) analysis of the extracted tooth were conducted. Radiographic examination showed that Tooth #1 was horizontally impacted in the maxilla and had the apex of a single root placed between the buccal and palatal roots of Tooth #2. Results: Coronal cementum was distributed widely on the enamel, and reduced enamel epithelium was also found with enamel matrix proteins histologically. The formation of acellular cementum was observed to be more predominant than that of the cellular cementum in Tooth #1. SEM showed that the occlusal cementum connected directly with enamel. Calcium mapping revealed an almost similar occlusal cementum and enamel. In addition, the spectrum of elements in coronal cementum resembled the primary cementum according to SEM-EDS. Discussion: Thus, coronal cementogenesis in impacted human teeth might be related to the existence of reduced enamel epithelium.

Studies on Tribological Characteristics and Wear Mechanisms of (TiN + TiC) Hybrid Nanocomposite Claddings Deposited on TC4-Grade Titanium Alloy Substrate by the Tungsten Inert Gas Cladding Process

Abstract This investigation explored the viability of tribological properties enhancement with the deposition of TiC + TiN nanoparticulate-reinforced hybrid composite claddings in TC4-grade titanium alloy to meet the ever-increasing functional performance requirements employed under aggressive tribological environments. The composite claddings are processed by using the tungsten inert gas cladding process. The tribological performance of the hybrid composite cladding deposition was evaluated against the claddings with simplex reinforcement compositions such as TC4/TiC and TC4/TiN composite claddings and the substrate alloy. Initially, the formation and microstructural characteristics of the composite cladding depositions are studied based on the scanning electron microscope, X-ray diffraction, and energy dispersive spectroscopic analyses to confirm their successful formation. The average microhardness achieved with the deposition of composite claddings such as TiC/TC4, TiN/TC4, and (TiC + TiN)/TC4 is 936.25 HV0.2, 858.88 HV0.2, and 1116. 72 HV0.2, respectively, while the TC4 substrate alloy is about 332.38 HV0.2. The (TiC + TiN)/TC4 hybrid composite cladding composition has shown significantly increased surface hardness which is about 30% and 18%, respectively, compared with the TiC/TC4 and TiN/TC4 composite cladding compositions while about 235% enhancement compared with the TC4 substrate alloy. Compared with the TC4 substrate alloy, the wear resistance enhancement achieved with the deposition of TiC/TC4 and TiN/TC4 composite claddings is up to 22.62% and 38.92%, respectively, while with the (TiC + TiN)/TC4 hybrid composite claddings is up to 49.87%. Similarly, the average CoF of the TC4 substrate alloy, TiC/TC4, TiN/TC4, and (TiC + TiN)/TC4 composite claddings observed are 0.76, 0.49, 0.58, and 0.44, respectively, which indicates that 36%, 23%, and 43% are the enhancements achieved with the respective composite claddings. The SEM analysis of worn surfaces of the composite claddings reveals typical wear mechanisms such as adhesive, abrasive, oxidation, and delamination that are represented by various regions identified on the generated wear maps. The adhesive and delamination wear regions are relatively wider for the TiN/TC4 composite cladding than the TiC/TC4 composite cladding. The wear mechanism of the composite cladding with multiphase TiC and TiN reinforcement particulate has shown an increased prevalence of abrasive wear as a consequence the abrasive wear region is wider while decreasing the window for adhesive and delamination wear.

Phonon modes and electron-phonon coupling at the FeSe/SrTiO3 interface.

The remarkable increase in superconducting transition temperature (Tc) observed at the interface of one-unit-cell FeSe films on SrTiO3 substrates (1 uc FeSe/STO)1 has attracted considerable research into the interface effects2-6. Although this high Tc is thought to be associated with electron-phonon coupling (EPC)2, the microscopic coupling mechanism and its role in the superconductivity remain elusive. Here we use momentum-selective high-resolution electron energy loss spectroscopy to atomically resolve the phonons at the FeSe/STO interface. We uncover new optical phonon modes, coupling strongly with electrons, in the energy range of 75-99 meV. These modes are characterized by out-of-plane vibrations of oxygen atoms in the interfacial double-TiOx layer and the apical oxygens in STO. Our results also demonstrate that the EPC strength and superconducting gap of 1 uc FeSe/STO are closely related to the interlayer spacing between FeSe and the TiOx terminated STO. These findings shed light on the microscopic origin of the interfacial EPC and provide insights into achieving large and consistent Tc enhancement in FeSe/STO and potentially other superconducting systems.

Anticathode effect on electron kinetics in electron beam generated E×B plasma

Abstract Electron beam (e-beam) generated plasmas with applied crossed electric and magnetic (E×B) fields are promising for low damage processing of materials with applications to microelectronics and quantum information systems. In cylindrical e-beam E×B plasmas, radial confinement of electrons and ions is achieved by an axial magnetic field and radial electric field, respectively. To control the axial confinement of electrons, such e-beam generated plasma sources may incorporate a conducting boundary known as an anticathode, which is placed on the axially opposite side of the plasma from the cathode. In this work, it is shown that varying the anticathode voltage bias can control the degree to which the anticathode collects or repels incident electrons, allowing control of warm electron (electron energies in 10-30 eV range) and beam electron population confinement. It is suggested that the effect of the anticathode bias on the formation of these distinct electron populations is also associated with the transition between weak turbulence and strong Langmuir turbulence.

Optimization of the Thermokinetic Method for the Control of Weld Decay in AISI 304L and AISI 316L Stainless Steel Weldment

This study investigates the control of weld decay in AISI 304L/316L alloy weldments for liquefied natural gas (LNG) and cryogenic environments using the Tungsten Inert Gas (TIG) welding technique. Weldment samples were thermokinetically treated at 1050, 1100, and 1150°C and cooled in five mediums: Water, Salt, Natural Air, Salt with annealing, and Water with annealing, to retain carbon and chromium in solid solution at approximately 30°C. Furthermore, evaluation methods based on metallography i.e. optical microscopy (OM), Scanning Electron Microscopy (SEM) and Energy Dispersive X-Ray Spectroscopy (EDX), Wear Test (i.e. wear rate and wear track) and electrochemical corrosion potential measurements were adopted. An experimental design table was developed using the design expert software 13.0. This helped develop a predictive mathematical model for ascertaining the optimum operating service conditions of the material. From the results, the optical microscopy analysis revealed that the control sample exhibited a more irregular pattern than others. Results showed that the control sample had a more irregular structure, while air-cooled samples exhibited smoother surfaces, indicating better bonding. SEM revealed a coarse surface with uneven particle distribution post-heat application. The predominant elements were Iron (Fe), Chromium (Cr), and Nickel (Ni). Corrosion potential varied between -0.5 to 0.15 V, demonstrating wave-like behaviour over time. Wear analysis indicated that lower coefficients of friction correlate with better wear resistance. Finally, response surface methodology (RSM) revealed that increasing temperature proportionally increased yield and corrosion rates. While the identified optimal values for Temperature are (1112.68°C), Material (316L), and Quenching Medium (SQ+SA), resulting in specific values such as Wear Rate (5.76896E-06), Coefficient of friction (0.224254), Corrosion Rate (0.395566), and Weight of Heat-Treated Sample (14.7797). The study enhances understanding of the mechanisms affecting welding and contributes to optimizing welding procedures for improved mechanical properties and corrosion resistance.

Systematic Analysis on The Development and Potential Use of Novel Semiconductors

Silicon-based transistors and integrated circuits, crucial for modern technology, are facing limitations due to scaling constraints. As transistors shrink, their performance is capped, affecting advanced technologies like AI, IoT, and 5G. Gallium nitride (GaN), with a melting point 200°C higher than silicon, presents a promising alternative due to its superior high-power and high-frequency performance. This essay reviews silicon’s semiconductor limitations and highlights the advancements in silicon carbide and Gan. The basic theories, such as electron mobility, energy level and covalent bond, are analyzed, and it is found that GaN is better than Sic and Si, but the three examples of semiconductors have different development fields in different fields. It compares the benefits of traditional silicon with these novel semiconductors, focusing on high-frequency and high-temperature performance. The essay also discusses current development, issues, and future predictions in semiconductor technology. Exploring new materials like GaN and silicon carbide addresses the technical challenges of silicon and enhances device performance, broadening technological possibilities.

A Thermogravimetric Analysis of Biomass Conversion to Biochar: Experimental and Kinetic Modeling

This study investigates the pyrolytic decomposition of apple and potato peel waste using thermogravimetric analysis (TGA). In addition, using Fourier transform infrared spectroscopy (FTIR), scanning electron microscopy (SEM) and energy dispersive X-ray spectroscopy (EDS), the influence of pyrolysis temperature on the physicochemical characteristics and structural properties of biochar was studied. The degradation of biomass samples was studied between 25 °C and 800 °C. Although apple and potato peel decomposition present similar thermogravimetric profiles, there are some differences that can be evidenced from DTG curves. Potato peel showed one degradation peak in the range 205–375 °C with 50% weight loss; meanwhile, the apple peel exhibited two stages: one with a maximum at around 220 °C and about 38% weight loss caused by degradation of simple carbohydrates and a second peak between 280 °C and 380 °C with a maximum at 330 °C, having a weight loss of approximately 24%, attributed to cellulose degradation. To gain more insight into the phenomena involved in biomass conversion, the kinetics of the reaction were analyzed using thermal data collected in non-isothermal conditions with a constant heating rate of 5, 10, 20, or 30 °C /min. The kinetic analysis for each decomposed biomass (apple and potato) was carried out based on single-step and multi-step type techniques by combining the Arrhenius form of the decomposition rate constant with the mass action law. The multi-step approaches provided further insight into the degradation mechanisms for the whole range of the decomposition temperatures. The effect of temperature on biomass waste structure showed that the surface morphologies and surface functional groups of both samples are influenced by the pyrolysis temperature. A higher pyrolysis temperature of 800 °C results in the disappearance of the bands characteristic of the hydroxyl, aliphatic, ether, and ester functional groups, characteristic of a porous surface with increased adsorption capacity. Therefore, this study concludes that biomass waste samples (apple and potato) can produce high yields of biochar and are a potential ecological basis for a sustainable approach. The preliminary adsorption tests show a reasonably good nitrate removal capacity for our biochar samples.

Effect of Na&lt;sub&gt;2&lt;/sub&gt;CO&lt;sub&gt;3&lt;/sub&gt; and CaCO&lt;sub&gt;3&lt;/sub&gt; on deep dephosphorization by the direct reduction of high-phosphorus oolitic hematite

The direct reduction–magnetic separation process based on coal is considered to be one of the most important methods that can effectively utilize high-phosphorus oolitic hematite. In this study, the mechanism of the effects of CaCO&lt;sub&gt;3&lt;/sub&gt; and Na&lt;sub&gt;2&lt;/sub&gt;CO&lt;sub&gt;3&lt;/sub&gt; on the dephosphorization of high-phosphorus oolitic hematite during the direct reduction process was investigated using X-ray diffraction (XRD), scanning electron microscope (SEM) and energy dispersive spectrometer (EDS). The results showed that Na2CO3 and CaCO3 reacted with Al&lt;sub&gt;2&lt;/sub&gt;O&lt;sub&gt;3&lt;/sub&gt; and SiO&lt;sub&gt;2&lt;/sub&gt; during the direct reduction process, inhibited the generation of hercunite (FeAl&lt;sub&gt;2&lt;/sub&gt;O&lt;sub&gt;4&lt;/sub&gt;) and fayalite (Fe&lt;sub&gt;2&lt;/sub&gt;SiO&lt;sub&gt;4&lt;/sub&gt;), and promoted the reduction of metallic iron (Fe). Furthermore, the reaction inhibited the reduction of apatite and prevented the generation of FeP&lt;sub&gt;2&lt;/sub&gt;. Na&lt;sub&gt;2&lt;/sub&gt;CO&lt;sub&gt;3&lt;/sub&gt; could change the form of phosphorus in the gangue from Ca&lt;sub&gt;3&lt;/sub&gt;(PO&lt;sub&gt;4&lt;/sub&gt;)&lt;sub&gt;2&lt;/sub&gt; to Na&lt;sub&gt;2&lt;/sub&gt;Ca&lt;sub&gt;4&lt;/sub&gt;(PO&lt;sub&gt;4&lt;/sub&gt;)&lt;sub&gt;2&lt;/sub&gt;SiO&lt;sub&gt;4&lt;/sub&gt;. Increasing the dosages of Na2CO3 and CaCO3 in the dephosphorization agent and increasing the content of Na&lt;sub&gt;2&lt;/sub&gt;CO&lt;sub&gt;3&lt;/sub&gt; in the dephosphorization agent were beneficial to the growth of metallic iron particles, and increasing the dosage of Na&lt;sub&gt;2&lt;/sub&gt;CO&lt;sub&gt;3&lt;/sub&gt;, CaCO&lt;sub&gt;3&lt;/sub&gt; in the dephosphorization agent had more significant effects on metallic iron particles than increasing the content of Na&lt;sub&gt;2&lt;/sub&gt;CO&lt;sub&gt;3&lt;/sub&gt; in the dephosphorization agent. The research conducted in this study is expected to provide a basis for the effective exploitation of complex and refractory iron ores.

Impedance Spectroscopy of Lanthanum-Doped (Pb0.75Ba0.25)(Zr0.70Ti0.30)O3 Ceramics

This study examines the effects of La3+ doping on (Pb0.75Ba0.25)(Zr0.70Ti0.30)O3(PBZT) ceramics, which were synthesized using the conventional solid-state reaction method. X-ray diffraction analysis confirmed that the PBZT structure, including PBZT doped with La3+ at concentrations x = 1 at.% and x = 2 at.%, exhibited a rhombohedral (R3c) space group, while higher doping levels of x = 3 at.% and x = 4 at.% led to a dominant cubic (Pm-3m) phase with approximately 30% of a remnant rhombohedral component. Scanning electron microscopy (SEM, JEOL JSM-7100F TTL LV, Jeol Ltd., Tokyo, Japan) and energy dispersive X-ray spectroscopy (EDS) were utilized to investigate the structure and morphology of these ceramics. The findings indicated that the chemical composition of the ceramic samples closely corresponded to the initial stoichiometry of the ceramic powder. An increase in the amount of lanthanum results in a decrease in the average grain size of the ceramics. The electrical properties were further evaluated using complex impedance spectroscopy (IS) over a range of temperatures and frequencies, as well as temperature dependence of DC conductivity. The similarity in the changes in activation energy for DC conductivity and grain boundary conductivity, caused by lanthanum ion modification, allows for the conclusion that grain boundaries are the primary microstructural element responsible for conductivity in these materials.

Revolutionizing acridine synthesis: novel core-shell magnetic nanoparticles and Co-Zn zeolitic imidazolate framework with 1-aza-18-crown-6-ether-Ni catalysts

Nanoparticles have emerged as a critical catalyst substrate due to their exceptional features, such as catalytic efficiency, high stability, and easy recovery. In our research, we have developed an innovative and environmentally friendly magnetic mesoporous nanocatalyst. Using the co-precipitation method, we produced magnetic nanoparticles (Fe3O4) and coated them with Zeolitic imidazolate frameworks (ZIFs) to enhance their surface area and chemical stability. The resulting substrate was functionalized with 1-aza-18-crown-6-ether and nickel metal. Our prepared catalyst has been rigorously evaluated using advanced techniques, including X-ray diffraction (XRD), Fourier transform infrared spectroscopy (FT-IR), Brunauer-Emmet-Teller (BET), vibrating sample magnetometry (VSM), scanning electron microscopy and energy dispersive X-ray (SEM-EDS), inductively coupled plasma (ICP), elemental mapping analysis (EMA), thermogravimetric analysis (TGA), and transmission electron microscopy (TEM). By synthesizing acridine derivatives, we have demonstrated the exceptional efficiency of our catalyst in organic compound synthesis. Through optimization, we have established the ideal parameters for catalytic processes, including catalyst amount, temperature, time, and ultrasonic use. Our catalyst has been proven to exhibit remarkable physical and chemical properties, such as porosity, temperature resistance, and recyclability. Notably, our heterogeneous nanocatalyst has shown outstanding performance and can be recycled six times without any loss in efficiency, affirming its potential in acridine.

Facile Approach for the Fabrication of Vapor Sensitive Spin Transition Composite Nanofibers

In this work polymer nanofibers were functionalized by incorporation of the spin transition (ST) compound [Fe(H2btm)2(H2O)2]Cl2 (FeH2btm) (H2btm = di(1H‐tetrazol‐5‐yl)methane). FeH2btm is an interesting compound due to its ability to reversibly and sensitively switch between high spin (HS) and low spin (LS) state when exposed to common volatile compounds (VOC) like ammonia and methanol. By using polyvinylidene fluoride (PVDF) as the main compound, inhibiting interactions between the complex and polymer were minimized. By using UV‐Vis spectroscopy, the visible and reversible switching between HS and LS state when exposed to an ammonia or hydrochloric acid atmosphere was confirmed. Powder X‐Ray diffraction (PXRD), scanning electron microscopy (SEM) and energy dispersive X‐Ray spectroscopy (EDX) show a homogenous distribution of FeH2btm with no major crystalline accumulations and a mean fiber diameter of 106 ± 20 nm. The composite fiber has a similarly high thermal stability as the pure FeH2btm, as shown by thermogravimetric analysis (TGA). Mössbauer spectroscopy indicates an incomplete spin transition after exposition to ammonia. This could be due to low permeability of the VOC into the composite fiber.

Ag2O/ZnO/CuO and Ag2O/ZnO/NiO immobilised on reduced graphene oxide: synthesis, characteristics and its adsorption, catalytic behaviour and antibacterial activities

ABSTRACT Ag2O/ZnO/CuO (A/Z/C) and Ag2O/ZnO/NiO (A/Z/N) nanometal oxides were synthesised in different rations by co-precipitation method and were immobilised on reduced graphene oxide (rGO). The prepared nanocomposites were characterised by Fourier transform infrared spectroscopy (FTIR), Raman spectroscopy, X-ray diffraction (XRD), scanning electron microscopy (SEM) and energy dispersive spectroscopy (EDS). Their application in the adsorption of MB, RhB and MO dyes, olefin oxidation and antibacterial properties were investigated. The results showed that A/Z/N/rGO adsorbent has 99% (10 min), 93% (20 min) and 97% (12 min) adsorption of MB, RhB and MO, respectively. From the investigation of Freundlich and Langmuir models, it was found that the adsorbent follows Langmuir. Moreover, the reaction thermodynamics was also studied, the reaction was endothermic and spontaneous. The kinetics of dye adsorption MB, RhB and MO on the surface follow a pseudo-second order model. At optimum condition, the conversion and selectivity of α-methylstyrene to acetophenone was >99% by A/Z/N and A/Z/C catalysts. A/Z/C/rGO nanocomposite has good antibacterial properties against two bacteria E. coli and S. aureus.

Characterization of brass mesh bolus for electron beam therapy

Purpose. Bolus is often required for targets close to or on skin surface, however, standard bolus on complex surfaces can result in air gaps that compromise dosimetry. Brass mesh boluses (RPD, Inc., Albertville, MN) are designed to conform to the patient's surface and reduce air gaps. While they have been well characterized for their use with photons, minimal characterization exists in literature for their use with electrons.Methods and materials.Dosimetric characteristics of brass mesh bolus was investigated for use with 6, 9 and 12 MeV electrons using a 10×10 cm2applicator on standard multi-energy LINAC. Measurements for bolus equivalence and percentage depth doses (PDDs) under brass mesh, as well as surface dose measurements were performed on solid water and a 3D printed resin breast phantom (Anycubic Photon MonoX, Shenzhen, China) using Markus®parallel-plate ionization chamber (Model 34045, PTW Freiburg, Germany), thermoluminescent detectors (TLD) and EBRT film. After obtaining surface dose measurements, these were compared to dose calculated on the Pinnacle3 treatment planning system (TPS, 16.2, Koninklijke Philips N.V.).Results. Measurements of surface dose under brass mesh showed consistently higher dose than without bolus, confirming that brass mesh can increase the PDD at surface up to ∼ 94% of dose at dmax, depending on incident electron energy. This increase is equivalent to using ∼ 7.2 mm water equivalent bolus for 6 MeV, ∼ 3.6 mm for 9 MeV and ∼ 2.2 mm bolus for 12 MeV electrons. TPS results showed close agreement within-vivomeasurements, confirming the potential for brass mesh as bolus for electron irradiation, provided blousing effect is correctly modelled.Conclusions. To increase electron surface dose, a brass mesh can be used with equivalent effect of water-density bolus varying with electron energy. Proper implementation could allow for ease of treatment, as well as increase bolus conformality in electron-only plans.

Chemical space-informed machine learning models for rapid predictions of x-ray photoelectron spectra of organic molecules

Abstract We present machine learning models based on kernel-ridge regression for predicting X-ray photoelectron spec- tra of organic molecules originating from the ionization energies of 1s electrons in carbon (C), nitrogen (N), oxygen (O), and fluorine (F) atoms. We constructed training dataset through high-throughput calculations of core-electron binding energies (CEBEs) for 12,880 small organic molecules in the bigQM7ω dataset, employing the ∆-SCF formalism coupled with meta-GGA-DFT and a variationally converged basis set. The models are cost-effective, as they require the atomic coordinates of a molecule generated using universal force fields while estimating the target-level CEBEs corresponding to DFT-level equilibrium geometry. We explore transfer learning by utilizing the atomic environment feature vectors learned using a graph neural network framework in kernel-ridge regression. Additionally, we enhance accuracy using the ∆-machine learning framework by leveraging inexpensive baseline spectra derived from Kohn–Sham eigenvalues. Upon application to 208 com- binatorially substituted uracil molecules, larger than those in the training set, our analyses reveal that while the models may not yield quantitatively accurate predictions of CEBEs on a molecule-by-molecule basis, they do exhibit a strong linear correlation, which proves valuable for virtual high-throughput screening purposes. We present the dataset and models as the Python module, cebeconf, to facilitate further explorations.

Bremsstrahlung radiation power in fusion plasmas revisited: towards accurate analytical fitting

Abstract In fusion plasmas, where electron temperatures $T_e$ range from keV to hundreds of keV, Bremsstrahlung radiation constitutes a significant energy loss mechanism. While various thermal average fitting formulas exist in the literature, their accuracy is limited, particularly for $T_e \leq 20$ keV with error $&gt;10\%$. Additionally, non-relativistic fitting formulas become invalid for $T_e \geq 50$ keV. The accurate calculation of Bremsstrahlung radiation is important for fusion gain study, especially of advanced fuels fusion. In this work, we develop new but still simple fitting formulas that are valid for electron temperatures ranging from small ($\lesssim0.1$ keV) to extreme relativistic range, with errors of less than 1\% even for high atomic number ions (e.g., $Z=30$), which could be sufficient for fusion plasma applications. Both electron-ion (e-i) and electron-electron (e-e) Bremsstrahlung radiations are considered. Both polynomial fitting with truncated ($t=k_BT_e/m_ec^2\leq10$) and one-fit-all formulas are provided. Additionally, we offer fitting formulas for e-i and e-e specifically for electron energies, which could prove useful in non-Maxwellian Bremsstrahlung radiation studies.