Tungsten Atoms Research Articles

Radiation protection of W–Al composite films/coatings for aviation using genetic algorithms

This study evaluated electron shielding capabilities of various materials using Geant4 Monte Carlo software. By analyzing materials with different atomic numbers, we designed and tested composite films and coatings for radiation protection. Under 1.2 MeV electron irradiation, these materials reduced the dose deposited in electronic components by over 70 %. The fabricated composite films (W–Al) reduced the actual total dose by 100 % with a 30.67 % mass increase, closely matching the simulation result of 75.36 %. The composite coatings (W–Al) reduced the dose by 89.2 % with a 33 % mass increase, matching the simulation result of 70 %. Cascade collision simulations revealed that higher PKA energies lead to longer times to reach the thermal peak, more peak defects, and more stable defect pairs. This is due to the displacement threshold energy of the atoms in aluminum and tungsten. These results demonstrate the effectiveness of our composite films and coatings in enhancing electron shielding performance and validate our design methods.

Heterometallic Transition Metal Oxides Containing Lewis Acids as Molecular Catalysts for the Reduction of Carbon Dioxide to Carbon Monoxide with Bimodal Activity.

Electrocatalytic CO2 reduction (e-CO2RR) to CO is replete with challenges including the need to carry out e-CO2RR at low overpotentials. Previously, a tricopper-substituted polyoxometalate was shown to reduce CO2 to CO with a very high faradaic efficiency albeit at -2.5 V versus Fc/Fc+. It is now demonstrated that introducing a nonredox metal Lewis acid, preferably GaIII, as a binding site for CO2 in the first coordination sphere of the polyoxometalate, forming heterometallic polyoxometalates, e.g., [SiCuIIFeIIIGaIII(H2O)3W9O37]8-, leads to bimodal activity optimal both at -2.5 and -1.5 V versus Fc/Fc+; reactivity at -1.5 V being at an overpotential of ∼150 mV. These results were observed by cyclic voltammetry and quantitative controlled potential electrolysis where high faradaic efficiency and chemoselectivity were obtained at -2.5 and -1.5 V. A reaction with 13CO2 revealed that CO2 disproportionation did not occur at -1.5 V. EPR spectroscopy showed reduction, first of CuII to CuI and FeIII to FeII and then reduction of a tungsten atom (WVI to WV) in the polyoxometalate framework. IR spectroscopy showed that CO2 binds to [SiCuIIFeIIIGaIII(H2O)3W9O37]8- before reduction. In situ electrochemical attenuated total reflection surface-enhanced infrared absorption spectroscopy (ATR-SEIRAS) with pulsed potential modulated excitation revealed different observable intermediate species at -2.5 and -1.5 V. DFT calculations explained the CV, the formation of possible activated CO2 species at both -2.5 and -1.5 V through series of electron transfer, proton-coupled electron transfer, protonation and CO2 binding steps, the active site for reduction, and the role of protons in facilitating the reactions.

Solvent-free synthesis of hierarchical tungsten-doped MFI zeolite for cyclohexene epoxidation reaction

Solvent-free synthesis method in zeolite preparation can largely decrease the generation of wastewater and improve the zeolite yield by simply grinding and hydrothermal treatment for the solid raw materials, and accordingly is considered as one of the most promisingly green and sustainable synthesis strategy for the metal-doped zeolite materials. However, there are scarcely any reports on the solvent-free synthesis and catalytic application of tungsten-doped zeolite materials. In this work, tungsten-doped MFI zeolites were prepared with solvent-free synthesis method and used as heterogeneous catalyst for cyclohexene epoxidation reaction. The synthesized tungsten-doped MFI zeolites displayed a monoclinic (P21/n) space group attributed to the successful incorporation of tungsten atom into MFI framework and meanwhile possessed an enormous number of irregular mesopores ranging from 2 nm to 50 nm. The influence of TPAOH addition amount on the mesopore structure and properties of tungsten-doped MFI zeolite was further investigated. In addition, the crystallization process of tungsten-doped MFI zeolite sample was tracked and analyzed with SEM, XRD and BET characterizations, and accordingly possible formation process for hierarchical zeolite was proposed. Furthermore, the prepared hierarchical tungsten-doped MFI zeolite displayed eminent cyclohexene epoxidation performance and re-usability for more than five times. This work provides some guidance for the solvent-free synthesis of metallosilicate zeolites, decreasing the generation of wastewater and improving the zeolite yield.

Molecular dynamics simulation of the influence of nanocutting parameters on microstructure of AISI M2

Molecular dynamics simulation has become the main analysis method of ultra precision machining of various materials. In this research, molecular dynamics method was used to explore the influence of nanocutting parameters on amorphous atoms, atomic coordination numbers, atomic strain and dislocations of AISI M2 workpiece. LAMMPS was used to construct the molecular dynamics model for CBN tool cutting AISI M2. The polycrystalline model of the workpiece contained 12 grains and iron, chromium and tungsten atoms. The polycrystalline model of the tool contained 3 grains and boron and nitrogen atoms. Tersoff, EAM, Morse and L-J potential energy functions were used to characterize the interaction between atoms. The following results were obtained through 8 groups of simulation experiments: (1) Both cutting speed and cutting depth promoted the amorphous transformation of workpiece atoms. (2) Under the extrusion of the tool, atoms with high coordination numbers were produced in the contact area between the tool and the workpiece. (3) The cutting depth was positively correlated with the average strain of workpiece atoms. Large strain atoms mainly occurred in the cutting area and gradually extended into the workpiece. (4) 1/2 < 111> dislocation was the most common dislocation form in nanocutting. This research plays a rich role in molecular dynamics simulation of nanocutting polycrystalline alloys.

Spectroscopic analysis of tungsten spectra in extreme-ultraviolet range of 10-480 Å observed from EAST tokamak with full tungsten divertor

Tungsten spectra in extreme ultraviolet (EUV) wavelength range of 10-480 Å have been observed from high-temperature plasmas in Experimental Advanced Superconducting Tokamak (EAST) with full tungsten divertor using four fast-time-response EUV spectrometers of EUV_Short (5-45 Å), EUV_Long_a (40–180 Å), EUV_Long_c (130–330 Å) and EUV_Long_b (270–480 Å) and two space-resolved EUV spectrometers of EUV_Short2_d (45–70 Å) and EUV_Long2_d (40–130 Å). The wavelength of measured spectra is accurately calibrated based on several well-known spectral lines emitted from low-Z (He, Li, C, N and O), medium-Z (Fe and Cu) and high-Z (Mo) impurity ions. Measurements of the tungsten spectra were taken from discharges accompanied with a transient tungsten burst event, which creates a pulsed influx of tungsten atoms into the EAST plasma. The tungsten spectra observed before and after the burst event are carefully analyzed with temporal behavior and radial profile distribution of the tungsten line intensity. As a result, 213 tungsten lines are successfully confirmed in the spectra observed after the tungsten burst, and the results are summarized in tables. These tungsten lines include line identifications of 78 lines of W XXIII - W XLVI (W22+ - W45+) at 10–140 Å and 88 lines of W V - W IX (W4+ - W8+) at 160–480 Å, while 47 tungsten lines at 50–380 Å could not be clarified the transition. In addition, quasi-continuum spectra called unresolved transition array (UTA) from tungsten ions in low- and high-ionization stages are also analyzed in three wavelength ranges of 18–38 Å, 45–70 Å and 150–280 Å at which W XXIII - W XXXVIII (W22+ - W37+), W XXVII - W XLVI (W26+ - W45+) and W VI—W IX (W5+ - W8+) are dominantly emitted, respectively. Through the analysis it is found that charge state distributions of tungsten UTA at 140–220 Å significantly vary with decrease in the electron temperature. Ionization stages of all observed tungsten lines including both isolated and quasi-continuum lines are experimentally reconfirmed by comparing the radial intensity profile with the electron temperature profile. Finally, spectral lines useful for tungsten diagnostic in fusion plasmas are selected and marked in the tables.

Dependence of Sputtering Coefficient on Energy and Incidence Angle of Bombarding Particles. Energy Spectrum and Average Energy of Sputtered Particles by the Example of a Tungsten Target

An overview of the functional dependences (formulas) for describing the properties of atomic particles sputtered during ion bombardment of the surface of a solid body is presented. The dependence of sputtering coefficients on the energy and angle of incidence of the bombarding particle is considered. The energy spectra and average energies of sputtered particles are presented. Formulas for calculating the quantities under consideration are proposed by the example of a target made of tungsten and hydrogen isotopes as projectiles. These data are necessary to estimate the entry of sputtered tungsten atoms as an impurity into a hot plasma using transport codes. When the tungsten impurity concentration is higher than the critical one, it is impossible to carry out a controlled thermonuclear reaction with the planned energy output in the ITER tokamak reactor. Sputtering coefficients also play an important role in simulating the entry of impurities into plasma facilities as a result of the interaction between hydrogen fuel atoms and the materials of the divertor and the first wall.

Construction of a Boron Chain on a Single Metal by Dehydrocoupling of Borane Ligands.

Borane coordination, B-H borane bond activation, and borane catenation via metal-mediated dehydrocoupling to form electron-precise B-B bonds are reported. The reaction of trans-[M(IMes)2Cl4] (M = W, Mo) (IMes = 1,3-bis(2,4,6-trimethylphenyl)imidazolin-2-ylidene) with borates Li[BH3R] (R = Mes, Dur; Mes = 2,4,6-Me3C6H2 and Dur = 2,3,5,6-Me4C6H) afforded the complexes [M(IMes)(η2-H2BR)2(η1-H2BR)] (M = W: R = Mes 1, R = Dur 3; M = Mo: R = Mes 2, R = Dur 4). Three borane ligands are coordinated in 1-4 to the group 6 metal atom via five (σ-B-H) bonds. Reaction of 1 with the phosphines PMe3 and PEt3, respectively, led to the elimination of one of the borane ligands and afforded the hydrido (σ-B-H)-boryl bis(σ-B-H)-borane complexes trans-[W(IMes)(PR3)(η1-HBMes)(η2-H2BMes)(H)] (R = Me 5, R = Et 6), in which the metal atom inserted into one of the remaining σ-B-H bonds of the borane ligands. Reaction of 1 with an additional equivalent borane BH2Mes resulted in borane dehydrocoupling and formation of complex [W(IMes)(η4-BH2Mes-BMes-BMes-BH2Mes)] 7, featuring a unique B4 chain as a ligand. Reaction of trans-[W(IMes)2Cl4] with NaBH4 also led to B-B coupling, and the metallaborane cluster [{W(IMes)(BH4)}2(B5H9)] 9 was formed, in which two tungsten atoms bridge a B5 chain.

Thermal Relaxation in Janus Transition Metal Dichalcogenide Bilayers.

In this work, we employ molecular dynamics simulations with semi-empirical interatomic potentials to explore heat dissipation in Janus transition metal dichalcogenides (JTMDs). The middle atomic layer is composed of either molybdenum (Mo) or tungsten (W) atoms, and the top and bottom atomic layers consist of sulfur (S) and selenium (Se) atoms, respectively. Various nanomaterials have been investigated, including both pristine JTMDs and nanostructures incorporating inner triangular regions with a composition distinct from the outer bulk material. At the beginning of our simulations, a temperature gradient across the system is imposed by heating the central region to a high temperature while the surrounding area remains at room temperature. Once a steady state is reached, characterized by a constant energy flux, the temperature control in the central region is switched off. The heat attenuation is investigated by monitoring the characteristic relaxation time (τav) of the local temperature at the central region toward thermal equilibrium. We find that SMoSe JTMDs exhibit thermal attenuation similar to conventional TMDs (τav~10-15 ps). On the contrary, SWSe JTMDs feature relaxation times up to two times as high (τav~14-28 ps). Forming triangular lateral heterostructures in their surfaces leads to a significant slowdown in heat attenuation by up to about an order of magnitude (τav~100 ps).

First-Principles computation-driven mechanism study of tungsten growth on alumina surfaces with TiN nano-islands

Strong comprehension of the tungsten film deposition process on Al2O3 substrate with TiN adhesion layer is essential to achieve high quality metal gate, but the fundamental mechanism of this process is yet to be fully understood. This study employs first-principles density functional theory (DFT) calculations to explore the mechanisms of tungsten film growth on alumina surfaces while focusing on amorphous/α-Al2O3 and interfaces with TiN nano-islands. Tungsten atoms are strongly bonded on the Al2O3/TiN interface compared to their bonding on the Al2O3 or TiN surface, regardless of the crystallinity of Al2O3. Moreover, amorphous Al2O3 surfaces exhibit stronger adsorption energies and present higher diffusion barriers for tungsten atoms compared to their crystalline counterparts, α-Al2O3, and TiN surfaces, which were also confirmed by electronic structure analysis. This enhanced adhesion on amorphous substrates suggests a potential pathway through which improve the step coverage and uniformity of tungsten thin films while addressing common issues such as void formation and non-uniform layering in high-aspect-ratio structures. Post-deposition annealing can help create crystalline tungsten films with superior conductivity. The insights gained from this work offer a computational perspective on the atomic-level interactions governing tungsten deposition, and they are expected to help producing high-quality thin films in semiconductor technologies.

Dual-Intermetallic Heterostructure on Hierarchical Nanoporous Metal for Highly Efficient Alkaline Hydrogen Electrocatalysis.

Constructing well-defined active multisites is an effective strategy to break linear scaling relationships to develop high-efficiency catalysts toward multiple-intermediate reactions. Here, dual-intermetallic heterostructure composed of tungsten-bridged Co3W and WNi4 intermetallic compounds seamlessly integrated on hierarchical nanoporous nickel skeleton is reported as a high-performance nonprecious electrocatalyst for alkaline hydrogen evolution and oxidation reactions. By virtue of interfacial tungsten atoms configuring contiguous multisites with proper adsorptions of hydrogen and hydroxyl intermediates to accelerate water dissociation/combination and column-nanostructured nickel skeleton facilitating electron and ion/molecule transportations, nanoporous nickel-supported Co3W-WNi4 heterostructure exhibits exceptional hydrogen electrocatalysis in alkaline media, with outstanding durability and impressive catalytic activities for hydrogen oxidation reaction (geometric exchange current density of ≈6.62 mA cm-2) and hydrogen evolution reaction (current density of ≈1.45 A cm-2 at overpotential of 200 mV). Such atom-ordered intermetallic heterostructure alternative to platinum group metals shows genuine potential for hydrogen production and utilization in hydroxide-exchange-membrane water electrolyzers and fuel cells.

Tungsten, copper and cobalt-single metal atom oxides embedded CeO2-MnO2-rGO nanorods as electrocatalysts for efficient oxygen evolution reaction

BackgroundAn important aspect of energy conversion and storage technology is primarily based on the electrocatalytic oxygen evolution process (OER). MethodHere, we present the newly designed synthesis of an improved variety of WCuCo-CeO2-MnO2-R-3 nanocomposites, to enhance OER by incorporating the reduced graphene oxide (rGO), and SMAO of W, Cu, and Co with the nanorods of CeO2-MnO2 materials. Interestingly, the higher density of SMAO (W, Cu, and Co), atomic utilization and electron transfer layer of rGO influenced the CeO2-MnO2 nanorods with remarkably superior electrocatalytic OER activity. Significant findingsThis makes WCuCo-CeO2-MnO2-R-3 achieve 10 mA cm-2 with an overpotential of 275 mV and a lower Tafel slop of 64.46 mV dec‑1. The higher number of SMAO (W, Cu, and Co) species close to the catalyst surface served as potential active sites assembly to enhance the OER activity by improving the chemical and electrochemical steps during the OER process. The chronoamperometry test revealed that the WCuCo-CeO2-MnO2-R-3 nanocomposite is not degrade in a 1 M KOH solution for 24 h, and it is stable up to 2000 CV cycles. In order to create very effective catalysts for OER, the DFT theoretical results shed light on the connection between the catalytic characteristics of metal oxide structures and their inherent electronic configuration.

Preparation of W-N-C single atom catalyst and Cu3(HHTP)2 metal-organic framework dual-decorated graphene nanoplatelet flexible electrode arrays for the rapid detection of carbendazim in vegetables

It is highly desirable to develop a low-cost and rapid detection method for trace levels of carbendazim fungicide residues, which would be beneficial for improving human health and mitigating environmental issues. Herein, isolated single tungsten atoms were implanted onto well-organized metal–organic framework (MOF)-derived N-doped carbons to form W-N-C single-site heterojunctions with ultrahigh electrocatalytic activity. The coupling of W-N-C with Cu3(HHTP)2, an electronically conductive MOF with a large surface area and porous structure, exhibited enhanced electrocatalytic performance for the oxidation of carbendazim (CBZ) when they were used for decorating graphene nanoplatelet flexible electrode arrays fabricated via template-assisted scalable filtration. A wide linear range (3.0 nM–50 μM) with an ultra-low detection limit of 0.97 nM and fast response was achieved for CBZ analysis. Moreover, the sensing platform has been utilised to monitor CBZ levels in vegetable samples with satisfactory recovery rates of 97.2–102% and a low relative standard deviation of 1.9%.

Tungsten Doping of Two‐Dimensional VO2 Nanoribbons for Rapid Zinc Ion Storage Channels

AbstractVanadium‐based oxides are promising candidates for use in aqueous zinc‐ion batteries owing to their open framework structure that facilitates rapid Zn2+ deintercalation. To improve the kinetics, a two‐dimensional nanoribbon‐shaped W‐VO2 cathode material was developed by pre‐embedding tungsten atoms into VO2(B) using a one‐step hydrothermal method. The large interlayer spacing in the W‐VO2 nanosheets aided in the deintercalation of hydrated Zn2+ ions. The 1 % W‐doped electrode exhibited stable cycling, reaching a high capacity of 365.8 mAh g−1 at 0.3 A g−1, with a 92.6 % capacity retention (338.8 mAh g−1) after 200 cycles. Impressively, 84.3 % of the capacity is retained after 1200 cycles at 1 A g−1. The zinc storage mechanism of W‐VO2 was elucidated through in situ X‐ray diffraction and X‐ray photoelectron spectroscopy, highlighting the benefits of tungsten doping on tunnel structure stability and Zn2+ deintercalation reversibility in VO2 electrodes.

The Effect of Selenium-Based Ligands on Tungsten Acetylene Complexes.

Bioinspired tungsten acetylene complexes containing pyridine-2-selenolato (PySe) or 6-methyl-pyridine-2-selenolato (6-MePySe) ligands were synthesized. 77Se NMR spectroscopy allowed for an assessment of the resonance structures in the pyridine-2-selenolato ligands and the rationalization of chemoselectivity observed in regard to 1,2 migratory insertion of HC≡CH. [W(CO)(C2H2)(CHCH-PySe)(PySe)] is formed exclusively via insertion of HC≡CH into the W-N bond, while the use of bulkier 6-MePySe allows for the isolation of [W(CO)(C2H2)(6-MePySe)2], which only partially reacts with excess HC≡CH to give [W(CO)(C2H2)(CHCH-6-MePySe)(6-MePySe)]. Oxidation of [W(CO)(C2H2)(6-MePySe)2] with pyridine-N-oxide gave the tungsten(IV) complex [WO(C2H2)(6-MePySe)2]. Complexes [W(CO)(C2H2)(6-MePySe)2] and [WO(C2H2)(6-MePySe)2] react with trimethyl phosphine to carbyne complex [W(CO)(CCH2PMe3)(PMe3)2(6-MePySe)]Cl and alkylidene complex [WO(CHCHPMe3)(PMe3)2(6-MePySe)]Cl, respectively. The addition of substituted alkynes to [W(CO)3(PySe)2] via thermal decarbonylation gave complexes [W(CO)(MeC≡CMe)(PySe)2] and [W(CO)(HC≡Ct-Bu)(PySe)2], respectively. The here presented complexes are relevant for the modeling of the active site of acetylene hydratase from Pelobacter acetylenicus, in which a tungsten atom is enclosed in a sulfur-rich coordination sphere. A recently published theoretical study concluded that the exchange of sulfur for selenium would increase the activity of the enzyme. Our findings contrast this claim as comparative analysis concludes negligible structural and electronic differences between the selenium-based and previously published sulfur-based complexes.

Synthesis and structural characterization of a hydrated sodium–caesium tetracosatungstate(VI), Na5Cs19[W24O84]·21H2O

Crystal formation of pentasodium nonadecacesium tetracosatungstate(VI) heneikosahydrate, Na5Cs19[W24O84]·21H2O, was successfully achieved by the conversion of [H2W12O42]10− through the addition of excess Cs+. The crystal structure comprising the toroidal isopolyoxidometalate is presented, as well as its Raman spectrum. Na5Cs19(H2O)21W24O84 crystallizes in the rhombohedral space group R\overline{3} with an obverse centering. The title compound represents the addition of a new member to the isopolytungstate family with mixed alkali counter-ions and contains rarely observed five-coordinate tungsten(VI) atoms in the [W24O84]24− anion (site symmetry C 3i ) arising from the conversion mediated by Cs+ counter-ions.

Boosting Efficient Alkaline Hydrogen Evolution Reaction of CoFe-Layered Double Hydroxides Nanosheets via Co-Coordination Mechanism of W-Doping and Oxygen Defect Engineering.

While surface defects and heteroatom doping exhibit promising potential in augmenting the electrocatalytic hydrogen evolution reaction (HER), their performance remains unable to rival that of the costly Pt-based catalysts. Yet, the concurrent modification of catalysts by integrating both approaches stands as a promising strategy to effectively address the aforementioned limitation. In this work, tungsten dopants are introduced into self-supported CoFe-layered double hydroxides (LDH) on nickel foam using a hydrothermal method, and oxygen vacancies (Ov) are further introduced through calcination. The analysis results demonstrated that tungsten doping reduces the Ov formation energy of CoFeW-LDH. The Ov acted as oxophilic sites, facilitating water adsorption and dissociation, and reducing the barrier for cleaving HO─H bonds from 0.64 to 0.14eV. Additionally, Ov regulated the electronic structure of CoFeW-LDH to endow optimized hydrogen binding ability on tungsten atoms, thereby accelerating alkaline Volmer and Heyrovsky reaction kinetics. Specifically, the abundance of Ov induced a transition of tungsten from a six-coordinated to highly active four-coordinated structure, which becomes the active site for HER. Consequently, an ultra-low overpotential of 41mV at 10 mAcm-2, and a low Tafel slope of 35mVdec-1 are achieved. These findings offer crucial insights for the design of efficient HER electrocatalysts.

Photothermal catalytic C–C coupling to ethylene from CO2 with high efficiency by synergistic cooperation of oxygen vacancy and half-metallic WTe2

Photothermal catalytic CO2 conversion provides an effective solution targeting carbon neutrality by synergistic utilization of photon and heat. However, the C–C coupling initiated by photothermal catalysis is still a big challenge. Herein, a three-dimensional (3D) hierarchical W18O49/WTe2 hollow nanosphere is constructed through in-situ embodying of oxygen vacancy and tellurium on the scaffold of WO3. The light absorption towards near-infrared spectral region and CO2 adsorption are enhanced by the formation of half-metal WTe2 and the unique hierarchical hollow architecture. Combining with the generation of oxygen vacancy with strengthened CO2 capture, the photothermal effect on the samples can be sufficiently exploited for activating the CO2 molecules. In particular, the close contact between W18O49 and WTe2 largely promotes the photoinduced charge separation and mass transfer, and thus the *CHO intermediate formation and fixedness are facilitated. As a result, the C–C coupling can be evoked between tungsten and tellurium atoms on WTe2. The ethylene production by optimized W18O49/WTe2 reaches 147.6 μmol g−1 with the selectivity of 80%. The in-situ diffuse reflectance infrared Fourier transform spectroscopy (DRIFTS) and density functional theory (DFT) calculations are performed to unveil the presence and significance of aldehyde intermediate groups in C–C coupling. The half-metallic WTe2 cocatalyst proposes a new approach for efficient CO2 conversion with solar energy, and may especially create a new platform for the generation of multi-carbon products.

Reduction of Magnetic Interaction Due to Clustering in Doped Transition-Metal Dichalcogenides: A Case Study of Mn-, V-, and Fe-Doped WSe2.

Using Hubbard-U-corrected density functional theory calculations, lattice Monte Carlo simulations, and spin Monte Carlo simulations, we investigate the impact of dopant clustering on the magnetic properties of WSe2 doped with period four transition metals. We use manganese (Mn) and iron (Fe) as candidate n-type dopants and vanadium (V) as the candidate p-type dopant, substituting the tungsten (W) atom in WSe2. Specifically, we determine the strength of the exchange interaction in Fe-, Mn-, and V-doped WSe2 in the presence of clustering. We show that the clusters of dopants are energetically more stable than discretely doped systems. Further, we show that in the presence of dopant clustering, the magnetic exchange interaction significantly reduces because the magnetic order in clustered WSe2 becomes more itinerant. Finally, we show that the clustering of the dopant atoms has a detrimental effect on the magnetic interaction, and to obtain an optimal Curie temperature, it is important to control the distribution of the dopant atoms.

Theoretical investigation of electron-impact ionization of W&lt;sup&gt;6+&lt;/sup&gt; ion

&lt;sec&gt;Due to its unique characteristics, metal tungsten has been selected as the wall material for the tokamak magnetic confinement fusion device. The wall material directly interacts with the plasma for a long time, thus causing tungsten atoms and ions to be sputtered and ionized into different charge states, which then enter the tokamak device as plasma impurities. To ensure stable plasma combustion conditions, highly complex model is currently being used to evaluate the behavior of tungsten impurities and their influence on the tokamak plasma. This requires various high-precision atomic data for tungsten atoms and different ionized states of tungsten ions. Electron collision ionization, as a fundamental atomic physical process, is widely encountered in laboratory and astrophysical plasma environments. The parameters such as electron collision ionization cross-sections and rate coefficients are crucial for plasma radiation transport simulations and state diagnostics.&lt;/sec&gt;&lt;sec&gt;Electron-impact single-ionization (EISI) cross sections of the ground state and metastable state for W&lt;sup&gt;6+&lt;/sup&gt; ions are calculated by using the level-to-level distorted-wave (LLDW) method. The contributions of direct ionization (DI) cross section and excited autoionization (EA) cross section to the total EISI cross section are primarily considered.&lt;/sec&gt;&lt;sec&gt;Comparison of our calculation results with the experimental data from Stenke et al. (Stenke M, Aichele K, Harthiramani D, Hofmann G, Steidl M, Volpel R, Salzborn E &lt;ext-link ext-link-type="uri" xmlns:xlink="http://www.w3.org/1999/xlink" xlink:href="https://iopscience.iop.org/article/10.1088/0953-4075/28/13/021"&gt;1995 &lt;i&gt;J. Phys. B: At. Mol. Opt. Phys.&lt;/i&gt; &lt;b&gt;28&lt;/b&gt; 2711&lt;/ext-link&gt;) reveals that the EISI cross section considering only the ground state is significantly smaller than the experimental result. Therefore, it is imperative to take into account the contribution from the metastable state. To determine the fraction of ions in long-lived energy levels within the parent ion beam, three models are employed.&lt;/sec&gt;&lt;sec&gt;Our results, which include the contribution of metastable states, accord well with the experimental results of Stenke et al. Compared with the theoretical calculation result of Pindzola et al. our calculaiton provides a more comprehensive understanding of the electron-impact single-ionization process for W&lt;sup&gt;6+&lt;/sup&gt; ions. The comparison is illustrated in the attached figure.&lt;/sec&gt;

Tungsten single atoms incorporated in cobalt spinel oxide for highly efficient electrocatalytic oxygen evolution in acid

Individual tungsten (W) atoms incorporated into the spinel lattice of Co3O4 (W–Co3O4) can present remarkable OER activity and stability. The PEMWE with W–Co3O4 as an anode catalyst can be stably operated at 1 A cm−2 for 240 hours.