Mo掺杂Mn4Si7的光电性质的第一性原理计算

采用基于密度泛函理论(DFT)的第一性原理计算方法,计算了Mn4Si7及Mo掺杂Mn4Si7的电子结构和光学性质.计算结果表明Mn4 Si7的禁带宽度Eg=0.804 eV,Mo掺杂Mn4Si7的禁带宽度Eg=0.636 eV.掺杂使得Mn4 Si7费米面附近的电子结构发生改变,导带底由Γ点转移为Y点向低能方向下偏移,价带顶向高能方向上偏移,带隙变窄.计算还表明Mo掺杂Mn4Si7使介电函数、折射率、吸收系数及光电导率等光学性质增加.     

碳酸盐岩钙同位素化学分离方法改进及其在青藏高原地质样品中的应用前景

本文报导了在前人基础上改进的碳酸盐岩(白云石－方解石)地质样品钙同位素化学分离方案。通过对比云南永善桧溪剖面白云岩－灰岩过渡岩性在不同浓度盐酸下淋洗结果,确定了4N浓度盐酸能有效富集白云石－方解石体系中的钙元素,且热电离质谱(TIMS)测试结果显示4N盐酸与1.6N盐酸淋洗方案处理后钙同位素测试结果一致,表明在相同测试精度的情况下,针对白云石－方解石体系下碳酸盐岩地质样品化学分离方案能提高化学分离效率。本文进一步结合青藏高原研究热点问题,对钙同位素在青藏高原地质样品的应用前景进行了分析,分析表明,钙同位素在青藏高原隆升前古海洋环境重建、隆升期构造活动恢复及隆升后火成岩来源示踪上具有广泛应用前景。     

Inorganic electrochromic materials based on tungsten oxide and nickel oxide nanostructures

Electrochromic devices, which dynamically change color under applied potentials, are widely studied for use in energy-efficient smart windows. The operation of electrochromic materials and devices involves the gain or loss of electrons and simultaneous insertion/extraction of ions with opposite charges to balance the internal electric fields. The performance is therefore limited by kinetics of charge transport in the electrochromic materials as well as ion migration in the electrolyte, materials and at their interfaces. Nanostructured electrochromic materials have an extremely short charge transport distance facilitating charge transport in electrochromic devices and large specific surface area for interaction with electrolytes, and thus may provide fast charge and ions transport, high electrochemical activities and remarkable enhancement of electrochromic properties. The recent progress in application of nanostructures, including nanoparticles, 1D and 2D nanostructures, in metal oxide electrochromic materials and devices is reviewed. A perspective on the development trends in electrochromic materials and devices is also proposed.     

零维物质体和微态物质体

在这篇文章里,R.G Muncaster的零维弹性体被推广到一般的高阶零维物质体。从非极连续介质力学理论出发,我们推出了零维物质体的所有平衡方程和热力学不等式。再从这些方程和不等式推出微态物质体的相应平衡方程和热力学不等式。这样,我们在零维物质体理论和微态物质体理论之间建立了一个类似于刚性质点力学和古典非极连续介质力学之间关系的关系。     

考虑上部结构的桩筏基础非线性共同作用分析

当前虽然已有考虑桩筏非线性的设计,但仍无人在此基础上,考虑上部结构。因此考虑上部结构,进一步认识其与桩筏基础非线性共同作用机理,优化桩筏基础设计,具有重要的现实意义。本文以子结构法凝聚上部结构的荷载及刚度,以平面壳体单元模拟筏板,按有限层法模拟桩土之间的弹性相互作用,用广义剪切位移法模拟桩的非线性工作性状,建立了一种考虑上部结构共同作用的桩筏基础非线性分析方法,并编制了分析程序。通过实例分析,探讨了上部结构与桩筏基础非线性共同作用的机理,研究了合理布桩方式,探讨了以差异沉降为目标的优化设计的可能途径。     

Surface-Polarity-Induced Spatial Charge Separation Boosts Photocatalytic Overall Water Splitting on GaN Nanorod Arrays

Photocatalytic overall water splitting has been recognized as a promising approach to convert solar energy into hydrogen. However, most of the photocatalysts suffer from low efficiencies mainly because of poor charge separation. Herein, taking a model semiconductor gallium nitride (GaN) as an example, we uncovered that photogenerated electrons and holes can be spatially separated to the nonpolar and polar surfaces of GaN nanorod arrays, which is presumably ascribed to the different surface band bending induced by the surface polarity. The photogenerated charge separation efficiency of GaN can be enhanced significantly from about 8 % to more than 80 % via co-exposing polar and nonpolar surfaces. Furthermore, spatially assembling reduction and oxidation cocatalysts on the nonpolar and polar surfaces remarkably boosts photocatalytic overall water splitting, with the quantum efficiency increased from 0.9 % for the film photocatalyst to 6.9 % for the nanorod arrays photocatalyst.     

ICP—AES法同时测定硼铁中的主要成分及杂质

本文研究了用ＩＣＰ－ＡＥＳ法同时测定硼铁中的主要成分Ｂ、Ｆｅ及杂质元素、Ａｌ、Ｍｎ，Ｓｉ的方法。采用碱熔融法分解样品，选Ｃｄ作为内标元素。     

Spectral structure of CuBr vapor laser lines

The atomic density, the buffer gas pressure, and the voltage dependence of the 510.6 nm laser line shape and its temporal evolution emitted from a Cu/CuBr vapor laser are measured. It is found that the monochromaticity of these laser lines can be improved greatly at a relative high buffer gas pressure. The temporal evolution of the line shape offers a stereoscopic view of a laser pulse. The sequence of appearance of the peaks of the line shape is governed by the intensity of the hyperfine component of the copper line.     

Effect of sound wave stress on antioxidant enzyme activities and lipid peroxidation of Dendrobium candidum

The effect of sound wave stress on important medicinal plant, Dendrobium candidum Wall. ex Lindl, was investigated, including the responses on malondialdehyde (MDA) content, the activities change of superoxide dismutase (SOD), catalase (CAT), peroxidase (POD) and ascorbate peroxidase (APX). Results were found that the activities of SOD, CAT, POD and APX enhanced totally in different organs of D. candidum, as leaves, stems and roots, in response to the stress. Furthermore there happened similar shift of antioxidant enzymes activities, which increased in the initial stimulation and decreased afterwards. Data showed SOD, CAT, POD and APX activities ascended to max at day 9, 6, 9 and 12 in leaves, at day 9, 6, 12 and 9 in stems, and at day 12, 6, 9 and 9 in roots, respectively. As a lipid peroxidation parameter, MDA content in different organs increased in the beginning, dropped afterward, and increased again in the late. Anyway the total trend was the rise of MDA level compared to the control. It was interesting that the MDA content appeared the lowest levels almost when the antioxidant enzymes activities were up to the highest. Our results demonstrated the different organs of D. candidum might produce accumulation of active oxygen species (AOS) under initial treatment of sound wave stress. Later AOS might start to reduce due to the enhancement of antioxidant enzymes activities treated by the stress. The data revealed that the antioxidant metabolism was to be important in determining the ability of plants to survive in sound stress, and the up regulation of these enzymes activities would help to reduce the build up of AOS, which could protect plant cells from oxidative damage. Moreover, different cell compartments might activate different defensive system to reduce excessive amount of AOS. Finally the mechanism of this action was also discussed simply.     

Elucidation of stabilizing pickering emulsion with jackfruit filum pectin-soy protein nanoparticles obtained by photocatalysis

There is still the dearth of reports of jackfruit filum pectin-based nanoparticles as the Pickering emulsifiers with respect to the applications in foods, cosmetics and medicines. So we fabricated soy protein-jackfruit filum pectin nanoparticles (SPP) by photocatalysis as Pickering emulsifier. Jackfruit filum pectin exhibited lower yield (17.31%), degree of methoxylation (15.53%), but higher galacuronic acid content (74.22%). A strong linkage between pectin and soy protein was formed by photocatalysis. The conjugated polymer could self-assemble into compact near globular nanoparticle. The mean size of SPP was larger than that of soy protein nanoparticles but smaller than that of soy protein-pectin complex without photocatalysis. Besides, the zeta potential of SPP was ?33.8?mV, significantly lower than that of soy protein nanoparticles but higher than that of control sample, further confirming that SPP surfaces were completely covered with pectin molecules. Compared with control sample, the three-phase contact angle increased from 42.7 to 90.6°, indicated that SPP could be developed as effective Pickering emulsifiers. The emulsions stabilized by SPP exhibited high thermal stability and excellent salt tolerance as well as good freeze-thaw stability in comparison with emulsions covered with control sample. These findings would provide a potential way of producing effective Pickering emulsifier.GRAPHICAL ABSTRACT