Excellent destabilization effect and ideal desorption temperature in the hydride Mg2FeH6 substituted with yttrium; a first principles study

We investigated some properties of the hydride Mg₂FeH₆ substituted with yttrium by a first principles calculation. Some experimental results showed that 4d transition metal, yttrium serves as a good catalyst for magnesium based hydrogen storage alloys, but there are a few theoretical studies about magnesium based hydrides substituted with it. Mg₂FeH₆ is regarded as a cheaper material than pure MgH₂, while it is crystalized into Fm3m structure (space group 225). Although it has high hydrogen storage capacity, many investigations have not been devoted to it due to its extremely high thermodynamic stability. The yttrium substituted Mg₂FeH₆ exhibits very low energy of formation, and its desorption temperature, 75 °C is very suitable for practical hydrogen storage applications. Our results showed that Mg₂FeH₆ is destabilized effectively by yttrium substitution and introducing vacancy defects has additive effect to the improvement of dehydrogenation performance.     

改性防护蜡对轮胎胎侧胶性能的影响

研究改性防护蜡对轮胎胎侧胶性能的影响。结果表明,与传统防护蜡相比,改性防护蜡异构烷烃质量分数较小,结晶尺寸小且致密程度高。改性防护蜡可在不影响胎侧胶硫化特性和物理性能的前提下,大幅提高胎侧胶抗喷霜性能,保证轮胎表面不受臭氧侵蚀,在防止裂纹产生的同时明显改善成品轮胎外观。     

移动边缘计算环境下的动态资源分配策略

在通讯设备爆炸式增长的时代,移动边缘计算作为5G通讯技术的核心技术之一,对其进行合理的资源分配显得尤为重要。移动边缘计算的思想是把云计算中心下沉到基站部署(边缘云),使云计算中心更加靠近用户,以快速解决计算资源分配问题。但是,相对于大型的云计算中心,边缘云的计算资源有限,传统的虚拟机分配方式不足以灵活应对边缘云的计算资源分配问题。为解决此问题,提出一种根据用户综合需求变化的动态计算资源和频谱分配算法(DRFAA),采用"分治"策略,并将资源模拟成"流体"资源进行分配,以寻求较大的吞吐量和较低的传输时延。实验仿真结果显示,动态计算资源和频谱分配算法可以有效地降低用户与边缘云之间的传输时延,也可以提高边缘云的吞吐量。     

转底炉处理赤泥工艺技术

为了综合利用氧化铝冶炼产生的赤泥，探索在转底炉中直接还原赤泥、磨矿磁选获得高品位直接还原铁。通过实验室试验摸索了转底炉还原工艺参数，并在转底炉工业试验线进行了工业试验。实验室结果表明，赤泥还原后的直接还原铁(DRI)金属化率可达88.6%，磁选后的铁品位可达82.1%，磁选后的铁回收率可达88.9%。工业试验中，转底炉还原后，产品金属化率平均为69.2%，将还原后的DRI磁选获得高品位的DRI产品，磁选后DRI的铁品位为72.8%，磁选后铁回收率达到了85.2%,初步打通了在转底炉中还原赤泥、磁选的工艺路径。     

严寒地区室内多层贯通空间热湿环境实测研究

通过对严寒地区贯通空间温湿度在水平方向及垂直方向上的连续实测，分析了供暖前后，太阳辐射、建筑开口、供暖等因素对贯通空间热湿环境的影响有很大差异。结果表明供暖前贯通空间受到太阳辐射、建筑开口的影响较大，温湿度波动明显；供暖期间受供暖因素影响，温差波动不稳定但幅度小。水平方向上非供暖期最大温差为2℃，供暖期最大温差为8℃；垂直方向上非供暖期的最大温差为3℃，供暖期最大温差为7℃。     

上水口环形吹氩对中间包内渣眼形成的影响

 中间包上水口环形吹氩可以在塞棒周围形成清洗钢液的环形气幕，同时部分氩气泡随钢液进入上水口内，可以减少非金属夹杂物在水口内壁的黏附，起到防止水口堵塞的作用。然而，不合理的吹氩量会导致中间包内液面渣层受过强的气液羽流冲击而形成渣眼，使得钢液裸露并发生二次氧化，严重影响铸坯质量。采用标准 k ε 湍流模型研究中间包内流体流动，采用DPM模型和VOF模型耦合方法，研究上水口环形吹氩条件下渣眼的形成及演化规律。结果表明，上水口环形吹氩在塞棒周围形成较强的上升流，塞棒上部邻近区域存在多个涡流区；在钢液涡流的影响下，中间包液渣下层远离塞棒区域，上层向塞棒区域迁移；随着吹氩量的增大，平均湍动能增大，塞棒附近钢液速度逐渐增大，钢渣界面钢液速度先增大后减小，渣眼边缘钢液速度先增大后减小然后再增大，速度与垂直方向夹角逐渐减小；增大吹氩量，中间包熔池液面形成以塞棒为中心的渣眼，渣眼面积逐渐增大。试验条件下不产生渣眼的临界吹氩量为4.2 L/min，对应的钢渣界面最大速度为0.247 m/s，与垂直方向夹角为70°。     

High areal capacitance of FeOOH-carbon nanotube negative electrodes for asymmetric supercapacitors

The relatively low capacitance of negative electrodes, as compared to the capacitance of advanced positive electrodes, poses a serious problem, since this limits the development of asymmetric supercapacitor (SC) devices with a large voltage window and enhanced power-energy characteristics. We fabricate negative SC electrodes with a high capacitance that match the capacitance of advanced positive electrodes at similar active mass loadings, as high as 37?mg?cm^?2. Cyclic voltammetry, impedance spectroscopy, galvanostatic charge-discharge data and the power-energy characteristics of the asymmetric SC device exhibit good electrochemical performance for a voltage window of 1.6?V. Our approach involves the development and application of particle extraction through liquid-liquid interface (PELLI) methods, new extraction mechanisms and efficient extractors to synthesize α-FeOOH and β-FeOOH electrode materials. The use of PELLI allows agglomerate-free processing of powders, which facilitates their efficient mixing with multiwalled carbon nanotubes (MWCNT) and allows improved electrolyte access to the particle surface. Experiments to determine the properties of FeOOH-MWCNT composites provided insight into the influence of the electrode material and the structure of extractor molecules on the composite properties. The highest capacitance of 5.86?F?cm^?2 for negative electrodes and low impedance were achieved using α-FeOOH-MWCNT composites and a 16-phosphonohexadecanoic acid (PHDA) extractor. This extractor allows adsorption on particles, not only at the liquid-liquid interface, but also in the bulk aqueous phase and can potentially be used as a capping agent for particle synthesis and as an extractor in the PELLI method.     

Solid-state phase transformations toward a metal-organic framework of 7-connected Zn4O secondary building units

In the development of metal-organic frameworks (MOFs), secondary building units (SBUs) have been utilized as molecular modules for the construction of nanoporous materials with robust structures. Under solvothermal synthetic conditions, dynamic changes in the metal coordination environments and ligand coordination modes of SBUs determine the resultant product structures. Alternatively, MOF phases with new topologies can also be achieved by post-synthetic treatment of as-synthesized MOFs via the introduction of acidic or basic moieties that cause the simultaneous cleavage/reformation of coordination bonds in the solid state. In this sense, we studied the solid-state transformation of two ndc-based Zn-MOFs (ndc = 1,4-naphthalene dicarboxylate) with different SBUs but the same pcu topology to another MOF with sev topology. One of the chosen MOFs with pcu nets is [Zn₂(ndc)₂(bpy)]_n (bpy = 4,4′-bipyridine), (6C_bpy-MOF) consisting of a 6-connected pillared-paddlewheel SBU, and the other is IRMOF-7 composed of 6-connected Zn₄O(COO)₆ SBUs and ndc. Upon post-structural modification, these pcu MOFs were converted into the same MOF with sev topology constructed from the uncommon 7-connected Zn₄O(COO)₇ SBU (7C-MOF). The appropriate post-synthetic conditions for the transformation of each SBUs were systematically examined. In addition, the effect of the pillar molecules in the pillared-paddlewheel MOFs on the topology conversion was studied in terms of the linker basicity, which determines the inertness during the solid-state phase transformation. This post-synthetic modification approach is expected to expand the available methods for designing and synthesizing MOFs with controlled topologies.