并苯纳米环[6]CA及其衍生物的电子结构和光物理性质的密度泛函理论研究

采用密度泛函理论PBE0方法在6-31G(d, p) 基组水平上对比研究并六苯纳米环[6]CA及BN取代纳米环[6]CA-BN的几何结构及电子性质. 同时探讨锂离子掺杂对不同体系的芳香性、前线分子轨道、电子吸收光谱及传输性质的影响. 通过电离势、亲合势及重组能的计算, 预测纳米环体系得失电子的能力及传输性能. 结果表明:[6]CA的能隙很小, BN取代后, 能隙明显增大; 锂离子掺杂到两种纳米环中, 在不明显改变前线分子轨道分布的前提下, 几乎同步降低了最高占据轨道、 最低未占据轨道能级, 锂离子掺杂使载流子传输性能得到很大改善; 电子吸收光谱拟合发现, BN取代使吸收光谱很大程度蓝移, 吸收强度明显减小; 而锂离子掺杂对光谱的强度及吸收范围没有明显影响. 关键词： 碳纳米环 硼氮纳米环 锂离子掺杂 密度泛函理论     

基于Web的图书馆管理系统访问控制策略

针对基于Web的图书馆管理系统资源访问控制的动态性问题，提出了一种基于角色的访问控制策略描述方案．通过对基于Web的图书馆管理系统访问控制管理影响因素和访问控制需求的分析，结合NIST基于角色的访问控制统一模型标准，构造了一种基于角色的访问控制元模型．并在这一元模型的基础上，提出了一种紧凑的基于角色的访问控制XML策略描述语言框架．结果表明该访问控制策略描述语言框架适合表述动态环境下对图书馆资源的访问策略，提高了基于Web的图书馆管理系统资源访问的安全性．     

离子色谱电导检测法测定酒中的有机酸和无机阴离子

采用淋洗液发生器-抑制电导检测法,同时分离和检测16种无机阴离子和低分子量有机酸,建立了用亲水性阴离子交换分离柱,KOH为淋洗液等浓度泵作梯度淋洗的离子色谱分离方法. 该方法具有良好的重现性、线性关系. 除马来酸外,所有被测离子的检测限都在0.16 mg/L以下. 方法用于测定4种酒样品的分析,结果满意.样品测定的回收率在93.52%到116.08%之间,除富马酸外其它RSD都小于3.8%.     

基于Blackman窗函数的插值FFT在电网谐波信号分析中的应用

对插值快速傅里叶变换（FFT）算法在电网谐波参数估计的研究表明：窗函数的类型和宽度是影响插值FFT算法分析精度的主要原因．通过对常用窗函数和电网信号的分析,Blaekman窗适合分析电网信号,同时给出了基于Blackman窗的插值FFT算法．仿真结果表明,基于Blackman窗的插值FFT算法对电网谐波幅值、频率和相位的估计精度都达到了电能质量的国家标准．     

Self-Assembled Multistable Scattering Mode for Versatile Energy-Saving Smart Windows

Smart windows are crucial to dynamic control over light transmission to fulfill various demands in energy saving, privacy, and information display; however, most present technologies still perform a single function (often tint or haze adjustment) and require continuous electricity for operation. In this study, novel self-assembled ionic liquid crystals (ILCs) doped with negative cholesteric liquid crystals (CLCs) to offer electrically switchable and stable scattering-mode light modulators are presented. The novel smectic A phase based on the ILCs exhibits high solubility in the adopted nematics, enhancing the LC device's performance in several ways, including improved homogeneity, stable alignment quality, prolonged stability, and simplified fabrication. The LC device can potentially offer a dynamically rapid switching function between stable transparent (imperfect fingerprint textures) states and stable scattering (focal conic textures with small domains) states by using external stimuli and highly maintained multistable states for prolonged periods, even when the external stimuli are removed. The LC device also offers polarization-independent scattering and transparent-mode LC light modulators, low operating voltage, excellent contrast, and broad viewing angles. Its versatility and outstanding field-off stability make it ideal for various applications such as smart lighting, building climate control, energy-saving displays, and augmented reality (AR) glasses.     

离子能量分析器测量特性的仿真研究

针对空间等离子体及其模拟环境、空间原子氧及其模拟环境对离子能谱测量的需要,利用仿真软件COMSOL,对离子能量分析器的低能离子测量特性进行了仿真研究。介绍了离子能量分析器的工作原理,对离子能谱测量过程进行了公式推导。通过对三种待选仪器设计方案进行离子透过率仿真分析,确定了一种较优的仪器设计方案。多种离子温度下的误差分析结果也表明,该设计方案能够较为准确地测量离子能量分布。分析了电场畸变、等离子鞘层、栅网对齐方式和离子温度对测量结果的影响,根据仿真结果对一些仿真实验现象做出了合理的解释。     

铋化物发光玻璃中银表面等离激元对铒离子的发光增强作用

局域表面等离激元可以由自由空间的光直接激发,这也是局域表面等离激元的优点所在。研究铋化物发光玻璃中纳米银颗粒的表面等离激元对铒离子发光的增强效应、进一步的提高铋化物发光玻璃中铒离子的发光性能很有意义。首先,测量了(A)Er 3+(0.5%)Ag(0.5%):铋化物发光玻璃与(B)Er 3+(0.5%):铋化物发光玻璃样品的吸收谱,发现(A)Er 3+(0.5%)Ag(0.5%):铋化物发光玻璃在约600.0 nm处有一个较弱的宽的银表面等离激元共振吸收峰。同时发现两者都有典型的铒离子的吸收峰,它们的吸收几乎完全一样:在波峰形状、峰值强度和峰值波长等方面都很相近。测量了(A)Er 3+(0.5%)Ag(0.5%):铋化物发光玻璃和(B)Er 3+(0.5%):铋化物发光玻璃样品的激发谱,发现有位于379.0,406.0,451.0,488.0和520.5 nm的5个550.0 nm可见光的可见激发谱峰,和位于379.0,406.5,451.0,488.5,520.5,544.0,651.5和798.0 nm的8个1531.0 nm红外光的红外激发谱峰,容易指认出依次为Er 3+的4I 15/2→4G 11/2,4I 15/2→2H 9/2,4I 15/2→(4F 3/2,4F 5/2),4I 15/2→4F 7/2,4I 15/2→2H 11/2,4I 15/2→4S 3/2,4I 15/2→4F 9/2和4I 15/2→4I 9/2跃迁的吸收峰,通过测量发现(A)Er 3+(0.5%)Ag(0.5%):铋化物发光玻璃相对于(B)Er 3+(0.5%):铋化物发光玻璃样品的可见和红外激发谱的最大增强依次分别是238%和133%。最后,测量了它们的发光谱,发现有位于534.0,547.5和658.5 nm的三组可见发光峰,容易指认出依次为Er 3+的2H 11/2→4I 15/2,4S 3/2→4I 15/2,4F 9/2→4I 15/2荧光跃迁。还发现红外发光峰位于978.0和1531.0 nm,依次为Er 3+的4I 11/2→4I 15/2和4I 13/2→4I 15/2的荧光跃迁。通过测量发现(A)Er 3+(0.5%)Ag(0.5%):铋化物发光玻璃相对于(B)Er 3+(0.5%):铋化物发光玻璃样品的可见和红外发光谱的最大增强依次分别是215%和138%。对于银表面等离激元增强铒离子发光的机理,认为主要为纳米银颗粒的局域表面等离激元共振,造成金属纳米结构附近产生的局域电场的强度要远大于入射光的电场强度,从而导致了金属纳米结构对入射光产生强烈的吸收和散射,进而导致了荧光的增强;即局域表面等离子体共振局域场的场增强效应。     

重离子核反应与核物质状态方程

核物质状态方程描述核物质结合能、压强、密度和中子—质子数差异等宏观量之间的关系。核物质状态方程不仅仅与核力属性、核结构性质以及重离子核反应的动力学过程紧密相关,还与致密星体如中子星的结构、演化、辐射与并合等天体过程紧密相关。基于加速器装置的重离子核反应实验,是地面实验室模拟产生极端条件核物质的唯一手段,因而也成为研究核物质状态方程的有效途径。当核物质中的中子数远大于质子数时,例如中子星内部的情形,核物质状态方程中的主要贡献项是对称能项。迄今为止,对称能关于密度的函数是核物理和天体物理中一个未知而又非常重要的物理量。通过重离子核反应的实验和理论研究来确定对称能的密度依赖关系及其在核反应以及致密星天体事件中的物理效应,是当代核物理基础研究的重要前沿。文章介绍了中能重离子核反应和核物质状态方程的一些背景知识和研究方法,以及近年来的一些进展。     

The effect of high-power ultrasound on the rheological properties of strawberry pulp

This study investigated the effects of high-power ultrasound (HPU, 0–45 °C, 242–968 W/cm², 2–16 min) on the rheological properties of strawberry pulp. Following the HPU treatment, the strawberry pulp exhibited an increase in apparent viscosity, storage modulus (G′), and loss modulus (G″). The water-soluble pectin (WSP), pectin methylesterase (PME) activity, and free calcium ions (Ca²⁺) of the strawberry pulp after HPU treatment were investigated to determine a possible reason for this phenomenon. HPU caused a significant decrease in the degree of esterification (DE), molecular weight (Mw), and particle size of strawberry WSP, but no significant changes were evident in the galacturonic acid (GalA) content and the zeta (ζ)-potential (P > 0.05), resulting in decrease in the apparent viscosity. Moreover, the largest reduction of PME activity was 22.6% after HPU treatment at 605 W/cm² and 45 °C for 16 min, indicating that the PME was resistant to the HPU treatments. The free Ca²⁺ content in the strawberry pulp was significantly decreased after exposure to HPU (P < 0.05). The maximal reduction of 52.01% in the free Ca²⁺ was achieved at 605 W/cm² and 45 °C for 16 min. The overall results indicated that the high residual activity (RA) of PME after HPU might induce the low esterification of WSP, while HPU promoted the interaction of free Ca²⁺ and low-methylated pectin, to form the network structure of Ca²⁺-low-methylated pectin, resulting in an increase in viscosity in the complex strawberry system.     

Metal ion capacitor composed of the thin-walled surfaces enabling high-rate performance and long cycling stability

Electrochemical capacitors (referred to as supercapacitors) have high power density, long cycling stability, and are eco-friendly for use in electronic applications. The proper and stable utilization of supercapacitor systems can expand the practical scope of energy-powering applications in various device platforms. Nevertheless, the low energy density of conventional oxide and sulfide electrode materials still limits the practical realization of supercapacitor devices in real electronic applications. This limitation results from the poor surface stability, structural collapse, and low electrical conductivity of the oxide and sulfide materials. Single metal electrodes with multivalent metal ions exhibit promising energy-storing kinetics and may be viable alternatives to these oxide and sulfide electrode materials. Here, we report a metal zinc (Zn) electrode supercapacitor (ZIC) consisting of a thin-walled architecture as an electrode by means of a voltage-controlled electroplating method. The optimized ZIC exhibited excellent pseudo-capacitive performance, excellent high-rate performance, and an outstanding cycling stability.