Modelling alkali metal emissions in large-eddy simulation of a preheated pulverised-coal turbulent jet flame using tabulated chemistry

The numerical modelling of alkali metal reacting dynamics in turbulent pulverised-coal combustion is discussed using tabulated sodium chemistry in large eddy simulation (LES). A lookup table is constructed from a detailed sodium chemistry mechanism including five sodium species, i.e. Na, NaO, NaO₂, NaOH and Na₂O₂H₂, and 24 elementary reactions. This sodium chemistry table contains four coordinates, i.e. the equivalence ratio, the mass fraction of the sodium element, the gas-phase temperature, and a progress variable. The table is first validated against the detailed sodium chemistry mechanism by zero-dimensional simulations. Then, LES of a turbulent pulverised-coal jet flame is performed and major coal-flame parameters compared against experiments. The chemical percolation devolatilisation (CPD) model and the partially stirred reactor (PaSR) model are employed to predict coal pyrolysis and gas-phase combustion, respectively. The response of the five sodium species in the pulverised-coal jet flame is subsequently examined. Finally, a systematic global sensitivity analysis of the sodium lookup table is performed and the accuracy of the proposed tabulated sodium chemistry approach has been calibrated.     

Electronic and optical properties of Fe<Subscript>2</Subscript>SiO<Subscript>4</Subscript> under pressure effect: ab initio study

We report first-principles studies the structural, electronic, and optical properties of the Fe₂SiO₄ fayalite in orthorhombic structure, including pressure dependence of structural parameters, band structures, density of states, and optical constants up to 30 GPa. The calculated results indicate that the linear compressibility along b axis is significantly higher than a and c axes, which is in agreement with earlier work. Meanwhile, the pressure dependence of the electronic band structure, density of states and partial density of states of Fe₂SiO₄ fayalite up to 30 GPa were presented. Moreover, the evolution of the dielectric function, absorption coefficient (α(ω)), reflectivity (R(ω)), and the real part of the refractive index (n(ω)) at high pressure are also presented.     

Probing top-quark couplings indirectly at Higgs factories

We perform a global effective-field-theory analysis to assess the combined precision of Higgs couplings,triple gauge-boson couplings, and top-quark couplings, at future circular e~+e~- colliders, with a focus on runs below the tt production threshold. Deviations in the top-quark sector entering as one-loop corrections are consistently taken into account in the Higgs and diboson processes. We find that future lepton colliders running at center-of-mass energies below the tt production threshold can still provide useful information on top-quark couplings, by measuring virtual top-quark effects. With rate and differential measurements, the indirect individual sensitivity achievable is better than at the high-luminosity LHC. However, strong correlations between the extracted top-quark and Higgs couplings are also present and lead to much weaker global constraints on top-quark couplings. This implies that a direct probe of top-quark couplings above the tt production threshold is also helpful for the determination of Higgs and triple-gauge-boson couplings. In addition, we find that below the e~+e~-→tth production threshold, the top-quark Yukawa coupling can be determined by its loop corrections to all Higgs production and decay channels. Degeneracy with the ggh coupling can be resolved, and even a global limit is competitive with the prospects of a linear collider above the threshold. This provides an additional means of determining the top-quark Yukawa coupling indirectly at lepton colliders.     

一种骨小管中液体流动产生的流量及切应力模型

骨组织受力变形后其内部液体就会流动,同时在其微观结构——骨单元壁中扩散,并进一步产生一系列与骨液流动相关的物理效应,如流体剪切应力、流动电位等,这些物理效应被细胞感知并做出破骨或成骨等反应,来使骨适应外部载荷环境.鉴于骨组织产生的内部液体流动很难实验测定,理论模拟是目前的主要研究手段.基于骨单元的多孔弹性性质建立了骨小管内部液体的流动模型,该模型将骨单元所受的外部载荷与骨小管内部液体的压力、流速、流量和切应力联系起来,并进一步可以研究其力传导与力电传导机制.骨小管模型的建立分别基于中空和考虑哈弗液体的骨单元模型,并考虑了骨单元外壁的弹性约束和刚性位移约束两种边界条件.最终得到骨单元在外部轴向载荷作用下,骨小管内部液体的流量及流体切应力的解析解.结果表明:骨小管中的液体流量与流体切应力都正比于应变载荷幅值和频率,并由载荷的应变率决定.因此应变率可以作为控制流量和流体切应力的一种生理载荷因素.流量随着骨小管半径的增大而非线性增大,而流体切应力则随着骨小管半径的增大而线性增大.此外,在相同的载荷下,含哈弗液体的骨单元的模型中,骨小管中液体的流量和切应力均大于中空骨单元模型.     

基于无机元素分析对地理标志五常大米鉴别技术的研究

五常大米是我国著名地理标志产品之一,品质高、产量低,导致制假售假的现象严重。为维护五常大米的品牌形象和消费者利益,急需一种有效鉴别五常大米的方法。应用电感耦合等离子体光谱及电感耦合等离子体质谱测定大米中无机元素含量,结合主成分分析(PCA)、Fisher判别、人工神经网络(ANN)对五常大米鉴别模型进行研究。结果表明：PCA法对样品的分类效果较差,采用Fisher判别和ANN则可准确识别五常地区的大米样品和其他地区的大米样品。Fisher判别法对校正集和验证集样品平均准确识别率分别为93.5%,而ANN法对同样的校正集和验证集样品的平均准确识别率为96.4%,优于Fisher判别法。可准确对五常大米进行鉴别,为该产品的地理标志保护提供了一种技术手段。     

废轮胎回转窑中试热解炭的重金属离子吸附特性

对废轮胎回转窑中试热解炭的重金属离子Pb2＋、Cr3＋和Cr6＋吸附特性进行了研究，分析了溶液pH值、接触时间、吸附剂用量以及溶液初始浓度对重金属去除率的影响。结果表明，溶液pH值对热解炭的重金属去除率有显著影响，阳离子Pb2＋、Cr3＋的去除率随pH的增加而增大，在弱酸和中性环境中去除率接近100％；Cr6＋在强酸性溶液中被还原成为Cr3＋，经二次吸附，总Cr去除率可达99％以上；Pb2＋和Cr3＋的去除率随热解炭用量和吸附时间的增大而增加，热解炭用量和吸附时间有一个最佳值。Pb2＋和Cr3＋的吸附为单分子层吸附，可用Langnuir和两段Freundlich等温吸附式描述，Freundlich拟合指数表明，热解炭具有较好的吸附性能。经酸洗后的热解炭对Pb2＋的去除率变低。     

Effects of microcracks on the poroelastic behaviors of a single osteon

It has been suggested that microcracks do play a key role in the triggering of the bone remodeling process. In order to evaluate the influence of microcracks on the poroelastic behaviors of an osteon, a finite element model is established and investigated by using the Comsol Multiphysics software. The findings show that the presence of a microcrack in the osteon wall strongly modifies (enlarges) its local fluid pressure and velocity. Especially, the pressure and velocity amplitudes produced in the microcracked region are larger than those of the non-cracked region. Thus, this study can also be used for proposing a likely mechanism that bone can sense the changes of surrounding mechanical environments.     

Near-field infrared response of graphene on copper substrate

The electronic properties of graphene are very sensitive to its dielectric environment. The coupling to a metal substrate can give rise to many novel quantum effects in graphene, such as band renormalization and plasmons with unusual properties, which are of high technological interest. Infrared nanoimaging are very suitable for exploring these effects considering their energy and length scales. Here, we report near-field infrared nanoimaging studies of graphene on copper synthesized by chemical vapor deposition. Remarkably, our measurements reveal three different types of near-field optical responses of graphene, which are very distinct from the near-field edge fringes observed in the substrate. These results can be understood from the modification of optical conductivity of graphene due to its coupling with the substrate. Our work provides a framework for identifying the near-field response of graphene in graphene/metal systems and paves the way for studying their novel physics and potential applications.     

Sensitive detection of H(2)O(2) and H(2)O(2)-related reactant with Ru(bipy)(2)(7,8-dimethyl-dipyridophenazine)(2+) and oligodeoxyribonucleotide

A sensor for H(2)O(2) and H(2)O(2)-related reactant was constructed with oligonucleotides and Ru(bipy)(2)dppx(2+) (bipy = 2,2'-bipyridine, dppx = 7,8-dimethyl-dipyridophenazine), which was performed by converting the H(2)O(2)-induced DNA cleavage into the change of luminescence. The 'DNA light switch' Ru(bipy)(2)dppx(2+) could emit strong luminescence in the presence of dsDNA. DNA cleavage occurred upon addition of H(2)O(2) due to the Fenton reaction, which resulted in the decrease of the luminescence of Ru(bipy)(2)dppx(2+). Therefore, the luminescence intensity depended on the concentration of H(2)O(2) and H(2)O(2)-related reactants, and the detection limits for H(2)O(2), uric acid and cholesterol were 0.20 μM, 0.46 μM and 1.25 μM, respectively. The recovery varied between 94.0% and 105.0% when the assay was applied to the determination of uric acid and cholesterol in biological samples, which demonstrated the good practicability of the assay.     

Conductivity exponent in three-dimensional percolation by diffusion based on molecular trajectory algorithm and blind-ant rules

Diffusion on random systems above and at their percolation threshold in three dimensions is carried out by a molecular trajectory method and a simple lattice random walk method, respectively. The classical regimes of diffusion on percolation near the threshold are observed in our simulations by both methods. Our Monte Carlo simulations by the simple lattice random walk method give the conductivity exponent μ/ν=2.32±0.02 for diffusion on the incipient infinite clusters and μ/ν=2.21±0.03 for diffusion on a percolating lattice above the threshold. However, while diffusion is performed by the molecular trajectory algorithm either on the incipient infinite clusters or on a percolating lattice above the threshold, the result is found to be μ/ν=2.26±0.02. In addition, it takes less time step for diffusion based on the molecular trajectory algorithm to reach the asymptotic limit comparing with the simple lattice random walk.