A Generalized Surface Chalcogenation Strategy for Boosting the Electrochemical N2 Fixation of Metal Nanocrystals

Electrocatalytic nitrogen reduction reaction (NRR) is a promising process relative to energy-intensive Haber–Bosch process. While conventional electrocatalysts underperform with sluggish paths, achieving dissociation of N₂ brings the key challenge for enhancing NRR. This study proposes an effective surface chalcogenation strategy to improve the NRR performance of pristine metal nanocrystals (NCs). Surprisingly, the NH₃ yield and Faraday efficiency (FE) (175.6 ± 23.6 mg h^–1 g^–1_Rh and 13.3 ± 0.4%) of Rh-Se NCs is significantly enhanced by 16 and 15 times, respectively. Detailed investigations show that the superior activity and high FE are attributed to the effect of surface chalcogenation, which not only can decrease the apparent activation energy, but also inhibit the occurrence of the hydrogen evolution reaction (HER) process. Theoretical calculations reveal that the strong interface strain effect within core@shell system induces a critical redox inversion, resulting in a rather low valence state of Rh and Se surface sites. Such strong correlation indicates an efficient electron-transfer minimizing NRR barrier. Significantly, the surface chalcogenation strategy is general, which can extend to create other NRR metal electrocatalysts with enhanced performance. This strategy open a new avenue for future NH₃ production for breakthrough in the bottleneck of NRR.     

Identification of heavy metal-contaminated Tegillarca granosa using laser-induced breakdown spectroscopy and linear regression for classification

Tegillarca granosa (T. granosa) is susceptible to heavy metals, which may pose a threat to consumer health. Thus, healthy and polluted T. granosa should be distinguished quickly. This study aimed to rapidly identify heavy metal pollution by using laser-induced breakdown spectroscopy (LIBS) coupled with linear regression classification (LRC). Five types of T. granosa were studied, namely, Cd-, Zn-, Pb-contaminated, mixed contaminated, and control samples. Threshold method was applied to extract the significant variables from LIBS spectra. Then, LRC was used to classify the different types of T. granosa. Other classification models and feature selection methods were used for comparison. LRC was the best model, achieving an accuracy of 90.67%. Results indicated that LIBS combined with LRC is effective and feasible for T. granosa heavy metal detection.     

Fabrication of dense Ce0.9Mg0.1P2O7-PmOn composites by microwave heating for application as electrolyte in intermediate-temperature fuel cells

In the present work, we report a method of fabrication of dense 10 mol% Mg²⁺-doped cerium pyrophosphate-phosphate (Ce_0.9Mg_0.1P₂O₇-P_mO_n; CMP-P) composites by microwave heat-treatment of the preformed Ce_0.9Mg_0.1P₂O₇ substrates in the presence of phosphoric acid. The composite was characterized by X-ray diffraction (XRD), scanning electron microscopy (SEM) and electrochemical impedance spectroscopy (EIS). The microwave heating at 375 °C for 5 min resulted in the formation of dense CMP-P composites which retained most of the pyrophosphate phase. The electrical conductivity was extracted from the EIS data and for the CMP-P composite prepared by H₃PO₄ loading for 10 h and microwave heat-treatment for 5 min it was found to be >10^?2 S m^?1 in 100–250 °C range with a maximum of 0.062 S cm^?1 at 190 °C, which was significant for its application as electrolyte in intermediate temperature fuel cells.     

A first-principles investigation on mechanical and metallic properties of titanium carbides under pressure

The titanium carbides are potential candidates to achieve both high hardness and refractory property. We carried out a structural search for titanium carbides at three pressures of 0 GPa, 30 GPa and 50 GPa. A phase diagram of the Ti-C system at 0 K was obtained by elucidating formation enthalpies as a function of compositions, and their mechanical and metallic properties of titanium carbides were investigated systematically. We also discussed the relation of titanium concentration to the both mechanical and metallic properties of titanium carbides. It has been found that the average valence electron density and tractility improved at higher concentrations of titanium, while the degree of covalent bonding directionality decreased. To this effect, the hardness of titanium carbide decreases as the content of titanium increases. Our results indicated that the titanium content significantly affected the metallic properties of the Ti-C system.     

On the thermal conductivity of bimodal SiC/A356 composites fabricated via powder metallurgy route

The present study investigates the thermal conductivity of bimodal SiC particulate distribution in aluminum matrix composites fabricated via powder metallurgy route. The effects of the SiC_p reinforcement size distribution and processing parameters such as sintering time and temperature on the thermal conductivity have been examined. The Box–Behnken experimental array was employed to identify the effects of selected variables on the thermal conductivity of the composite. A reasonable augmentation in the thermal conductivity was observed with an increase in sintering time and %volume fraction of fine SiC particulates. It has been demonstrated that the matrix doped with fine SiC particulates (37?µm) occupied interstitial positions and formed continuous SiC–matrix network resulting in minimizing the micropores that contributed for good thermal conductivity, that is, 235?W/mK. Scanning electron microscopy (SEM) and x-ray diffraction (XRD) were conducted to evaluate the microstructure architecture and interfacial phase formation.     

Wide-band,passively Q-switched Yb- and Tm-doped fibre laser using WSSe saturable absorber

A wide-band, passively Q-switched fibre lasers based on ytterbium- and thulium-doped fibre gain medium are proposed and demonstrated. The lasers employ a transition metal dichalcogenide, tungsten sulphoselenide as a saturable absorber (SA) which is prepared by mechanical exfoliation technique. By integrating the SA in the laser cavities, self-starting Q-switched at 1038 and 1982?nm are obtained. The generated pulses exhibit a microsecond pulse duration with few kilohertz repetition rate. The proposed SA has high potential as a new material to cater to the needs of various scientific, industrial and biomedical applications.     

基于弥散燃料颗粒开裂的金属基体裂纹特征模型

金属基弥散燃料元件在特殊工况下会发生表面起泡失效。燃料颗粒开裂是金属基体开裂的前提条件，只有当金属基体开裂后元件才会发生表面起泡。燃料颗粒开裂后，裂纹宽度和塑性区长度等裂纹特征决定了金属基体开裂行为。基于弹塑性断裂力学和应力平衡条件，建立了基于弥散燃料颗粒开裂的金属基体裂纹特征模型。计算结果表明：裂纹张开位移随退火温度和燃耗深度的升高而增加；裂纹尖端塑性区长度主要与退火温度相关。裂纹张开位移和塑性区长度的计算结果与实验数据均符合较好，验证了金属基体裂纹特征模型的有效性。     

拉深筋对板材变形特征和力学性能的影响研究

采用实验方法将金属板材拉过不同尺寸的拉深筋镶块，分析了拉深筋高度、圆角半径以及过筋次数对板材变形特征的影响规律，研究了过筋产生的预应变对板材后续力学性能的影响规律。结果表明：板材流过拉深筋后，流动方向上发生均匀的拉伸变形；过筋产生的预应变随着拉深筋高度增大而增大，随着圆角半径增大而减小，随着过筋次数增加而近似线性增大；预应变越大，材料后续屈服强度和抗拉强度越高，但后续延伸率越小，总延伸率随着预应变增大表现出先减小后增大的趋势。     

The Electron–Phonon Interaction of Low-Dimensional and Multi-Dimensional Materials from He Atom Scattering

Atom scattering is becoming recognized as a sensitive probe of the electron–phonon interaction parameter λ at metal and metal-overlayer surfaces. Here, the theory is developed, linking λ to the thermal attenuation of atom scattering spectra (in particular, the Debye–Waller factor), to conducting materials of different dimensions, from quasi-1D systems such as W(110):H(1 × 1) and Bi(114), to quasi-2D layered chalcogenides, and high-dimensional surfaces such as quasicrystalline 2ML-Ba(0001)/Cu(001) and d-AlNiCo(00001). Values of λ obtained using He atoms compare favorably with known values for the bulk materials. The corresponding analysis indicates in addition, the number of layers contributing to the electron–phonon interaction, which is measured in an atom surface collision.