一维Ga2O3纳米材料及其光电导性能研究进展

一维纳米材料以其特殊的物理和化学性质成为了现在纳米材料研究的热点.目前国内对一维纳米材料研究主要体现在两方面：一是一维纳米材料的制备;二是纳米材料的功能器件研究,如光电探测器、气敏探测器等.本文综述了一维Ga2O3纳米材料的几种常用的制备方法,包括工艺参数及生长机理,并简单介绍了Ga2O3光电导探测器的工作原理及最近的研究成果.     

硅薄膜材料的光电导谱分析

利用甚高频等离子体增强化学气相沉积法（VHF-PECVD）,通过改变氢稀释比制备出一系列硅薄膜样品。由弱光条件下光电导谱分析了材料的吸收系数及缺陷态密度,结果表明随着氢稀释比的增加,材料的长波响应增大,缺陷态密度（NS）逐渐减小,当大于16.7时,NS开始增加,这是杂质与晶粒间界相互作用的结果。     

Generation and detection of spin polarization in parallel coupled double quantum dots connected to four terminals

A four-terminal parallel double quantum dots (QDs) device is proposed to generate and detect the spin polarization in QDs. It is found that the spin accumulation in QDs and the spin-polarized currents in the upper and down leads can be generated when a bias voltage is applied between the left and right leads. It is more interesting that the spin polarization in the QDs can be detected using the upper and down leads. Moreover, the direction and magnitude of the spin polarization in the QDs, and in the upper and down leads can be tuned by the energy levels of QDs and the bias.     

用于太阳电池的表面等离激元陷光技术的研究进展

表面等离激元(SPPs)作为一种新颖的陷光技术成为目前光伏领域的研究热点.本文介绍了近几年国内外SPPs陷光技术的研究进展,并分析了存在的问题.     

Exchange between sub-surface and surface oxygen vacancies on CeO2(111): a new surface diffusion mechanism

Using first principles calculations for O vacancy diffusion on CeO(2)(111), we locate a surface diffusion mechanism, the two-step O vacancy exchange one, which is more favored than the most common hopping mechanism. By analyzing the results, we identify quantitatively the physical origin of why the two-step exchange mechanism is preferred.     

偏最小二乘和量子化学参数预测酯类物质的闪点

基于化合物定量结构与性质的关系,对其中88个酯类化合物进行了B3LYP/6-31G*水平上的结构优化,并在优化结构基础上进行了量子化学结构参数的计算。应用偏最小二乘(PLS)方法对酯类化合物闪点温度这个理化性质与量子化学参数进行了关联。结果表明,分子热力学自由能(ΔG)结合偶极距(μ)可以很好地表达酯类化合物闪点温度与量子化学参数间的定量关系。所建立的QSPR模型具有较强的稳健性和预测能力。     

基于聚锂均苯三甲酸/多壁碳纳米管复合膜的葡萄糖生物传感器的研究

利用电聚合方法在裸玻碳(GC)电极上修饰一种新型金属有机框架化合物锂均苯三甲酸(Li-BTC),并采用滴涂技术制备了Nafion/GOx/MWNTs/poly-Li-BTC/GC葡萄糖生物传感器。利用扫描电镜分析了复合膜(含MWNTs和poly-Li-BTC)的形貌,采用循环伏安和交流阻抗方法对修饰电极的电化学性能进行了研究。结果表明,此复合膜可增大裸玻碳电极的有效表面积、改善电极的电催化活性。利用循环伏安法和计时安培法研究了葡萄糖在Nafion/GOx/MWNTs/poly-Li-BTC/GC电极上的电化学特性。结果表明:葡萄糖的浓度在0.02～1.56 mmol/L范围内,此修饰电极的电流响应与葡萄糖的浓度呈线性关系,其相关系数为0.9992,检出限为5.1μmol/L(信噪比为3∶1)。修饰电极的米氏常数为0.832 mmol/L,回收率为96.3#～100.3#。本研究制备的葡萄糖生物传感器具有较好的重复性、重现性、选择性与稳定性,用于葡萄糖注射液中葡萄糖含量的检测,结果满意。     

一种滑移区气体流动的格子Boltzmann曲边界处理新格式

针对滑移区复杂气-固边界存在速度滑移现象,提出了一种基于格子Boltzmann方法的非平衡态外推与有限差分相结合的曲边界处理新格式.该格式具有可考虑实际物理边界与网格线偏移量的优势,较传统half-way DBB(diffusive bounce-back)格式更能准确反映实际边界情况,同时还可获取壁面处气体宏观量及其法向梯度等信息.采用本文所提曲边界处理格式模拟分析了滑移区气体平直/倾斜微通道Poiseuille流、微圆柱绕流和同心微圆柱面旋转Couette流问题.研究结果表明,采用曲边界处理新格式所得结果与理论值以及文献结果符合良好,适用于滑移区气体流动的复杂边界处理,且比half-way DBB格式具有更高的精度,较修正DBB格式具有更好的适应性.     

Au core-PtAu alloy shell nanowires for formic acid electrolysis

Inefficient electrocatalysts and high-power consumption are two thorny problems for electrochemical hydrogen(H2)production from acidic water electrolysis.Herein we report the one-pot precise synthesis of ultrafine Au core-Pt Au alloy shell nanowires(Au@PtxAu UFNWs).Among them,Au@Pt_0.077 Au UFNWs exhibit the best performance for formic acid oxidation reaction(FAOR)and hydrogen evolution reaction(HER),which only require applied potentials of 0.29 V and-22.6 m V to achieve a current density of 10 m A cm^-2,respectively.The corresponding formic acid electrolyzer realizes the electrochemical H2 production at a voltage of only 0.51 V with 10 m A cm^-2 current density.Density functional theory(DFT)calculations reveal that the Au-riched Pt Au alloy structure can facilitates the direct oxidation pathway of FAOR and consequently elevates the FAOR activity of Au@Pt_0.077 Au UFNWs.This work provides meaningful insights into the electrochemical H₂ production from both the construction of advanced bifunctional electrocatalysts and the replacement of OER.     

Infrared studies of oxygen-related complexes in electron-irradiated Cz-Si

This paper investigates the infrared absorption spectra of oxygen-related complexes in silicon crystals irradiated with electron (1.5~MeV) at 360~K. Two groups of samples with low [O_i]=6.9× 10¹⁷~cm^-3 and high [ O_i]=1.06× 10¹⁸~cm^-3 were used. We found that the concentration of the VO pairs have different behaviour to the annealing temperature in different concentration of oxygen specimen, it is hardly changed in the higher concentration of oxygen specimen. It was also found that the concentration of VO₂ in lower concentration of oxygen specimen gets to maximum at 450~℃ and then dissapears at 500~℃, accompanied with the appearing of VO₃. For both kinds of specimens, the concentration of VO₃ reachs to maximum at 550~℃ and does not disappear completely at 600~℃.