自由质点测地线仿射参量时空坐标系

以时序t为自变量,可给出自由质点空间测地线的参数方程组{Xⁱ(t)},借助于仿射参量R(t)变换实现测地线微分方程的齐次化, 推导出仿射参量R满足的一阶微分方程、获得以有理数C_u为标志的序列解析解R.基于R定义平直四维坐标系{t,r,θ,φ}的空间距离单位,建立自由质点测地线仿射参量时空坐标系{t,ξ,θ,φ}.研究{t,ξ,θ,φ}中狭义相对论时空间隔模型度规张量g的对角化过程, 发现与对角化度规对应的特征量t₁(t,ξ), τ₁(τ,ξ),t_t(t,τ,ξ),τ_τ1(t,τ,ξ); 从而推出时空坐标系{t,ξ,θ,φ}维数小于4.     

用于诊断纳秒脉冲电流的微分环现场标定技术

分析了用于纳秒脉冲电流测量的微分环标定难点,提出微分环现场标定方法。通过脉冲形成线脉冲充电以解决微分环标定中信噪比较低、可信度较差等问题;分析了脉冲形成线充电时间、充电电压及脉冲形成开关击穿电压等回路参数对标定结果的影响。基于闪光二号加速器,对测量二极管电流的微分环进行了现场标定,前级隔离开关平均击穿电压为25 kV时,微分环标定回路电流达到1.3 kA,微分环灵敏度为9.311010,方差为0.151010。     

基于液氮低温冷刀系统的冻结组织温度场分布研究

设计了基于液氮的低温冷冻治疗系统,并进行动物组织实验研究,得到组织关键测温点的温度变化;并对冷冻过程进行数值模拟,将实验结果与模拟冷冻结果进行对比,根据二者的差异对数值模拟中采用的组织热物性参数进行修正,使模拟结果更接近于实际冷冻过程.     

带有高压储液器的制冷系统建模研究

通过对制冷系统循环特性、变工况特性和参数间耦合特性的分析,遵循热力学基本定律和能量、动量、质量守恒定律,采用稳态和动态建模相结合的方法建立压缩式制冷系统的数学模型。针对换热器建模难点采用分相区和移动边界相结合的方法建立其集总参数动态模型,并且冷凝器与高压储液器相结合,构成冷凝器加储液器的整体部件,文中建立的制冷系统的整体模型,反映了制冷系统工况变化时制冷剂质量的重新分配及其对状态变量的影响,提高了系统建模的精度,最后通过实验对所建模型的准确性进行了验证。     

基于X射线衍射仪的X光晶体本征参量的标定

X光晶体本征参量的实验标定是准确鉴定X光晶体种类和品质,研制各种类型晶体谱仪,X光线谱定量测量和高分辨X光单能成像的基础.基于X射线衍射仪,通过制作平面晶体样品架,采取控制X射线管电源、滤波片选取和厚度控制等措施,极大地抑制了Cu-KJ3及韧致辐射,使X射线管光源Cu-Kα单能化,提出了用滤片作为光源单能化的判据.对X光线谱测量中常用的X光分光晶体季戊四醇[PET(002)]的晶格常量2d和Cu-Ka能点的积分衍射效率R.进行了标定方法研究,其标定值分别为(0.87425±0.00042)nm和(1.759±0.024)×10-4 Rad.基于X射线衍射仪的X光晶体本征参量的精密实验标定方法既快速高效,且十分方便和灵活.通过更换衍射仪的X射线管靶材,采取类似方法,可以标定其它能点的晶体积分衍射效率,可为X光晶体的本征参量库提供更多的标定数据.     

复杂成分内混合体光散射等效性分析的判据选取

使用离散偶极子近似算法DDSCAT7.1与米散射理论算法MIEV0研究复杂成分混合体等效性时, 由于两者为不同的原理和实现算法, 考察DDSCAT7.1和MIEV0所计算出的相同光学量的相对偏差将非常必要。通过比较两种算法所计算出的球形散射型粒子海盐和吸收型粒子含碳气溶胶的光学量的相对偏差, 结果表明: 两种算法所计算的非散射角函数光学量的相对偏差较小; 在瑞利散射区, 散射相矩阵分量M1和S21的相对偏差较小, 而M2和D21只在一定的散射角范围内相对偏差较小; 在米散射区, M1、M2、S21在有限的散射角范围内相对偏差较小, 而D21的相对偏差则普遍较大。在光散射等效性判据选取时, 非散射角函数光学量适合用来研究内混合体的等效性, 而散射相函数则不太适合用来研究内混合体等效性, 除非综合考虑粒子尺度参数以及选择合适的散射角等因素。在光散射技术中对粒子谱分布和折射率相当敏感的D21, 比较难以用在以两种方法为基础的内混合体等效性研究中。     

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引进了美国GAMMA公司的高精度数字式可调标准光源RS-5B,并对其性能参数进行了测试。结果表明,该光源光强空间分布非常稳定,在光强大于0.001μW•cm-2时,复位性优于1%;在光强大于0.01μW•cm-2时,稳定性优于0.5%。其输出光强与标称值呈线性分布关系。这些优良的参数和特性满足聚变物理标定研究中对标定源的需求,为物理实验数据分析和计算模拟提供了条件。     

Comparative study of kinetics isomerization of substituted polyacetylene (Cl,F and I): Ab initio and DFT calculations

Ab initio and DFT methods were used to investigate the interconversions of substituted polyacetylene conformers C₁₀H₆X₆ (X=F, Cl and I) in the vapour phase. The rates of this geometrical isomerization have been calculated and the Arrhenius parameters evaluated. In the case of unsubstituted polyacetylene as the reference, the B3LYP Arrhenius parameters obtained are A₁=2.99 × 10¹⁷ s^–1 and E_a=17.30 kcal mol^–1. The values of the equilibrium constant for the reaction have also been determined at various temperatures between 300 and 500 K and the value of the energies change calculated. The results also suggest that the straightforward kinetics characterizing the majority of substituted polyacetylene isomerizations above 300 K. The isomerization energies are positive and the barrier heights ΔE_barrier are expected to be sensitive for the magnitude of halogens effects. According to geometries features the Cis → Trans isomerization in the gas phase occurs by a rotational mechanism.     

Development of Abraham model IL-specific correlations for N-triethyl(octyl)ammonium bis(fluorosulfonyl)imide and 1-butyl-3-methylpyrrolidinium bis(fluorosulfonyl)imide

ABSTRACT

Abraham model correlations are derived for describing gas-to-ionic liquid and water-to-ionic liquid partition coefficients from published experimental data for solutes dissolved in both N-triethyl(octyl)ammonium bis(fluorosulfonyl)imide and 1-butyl-3-methyl-pyrrolidinium bis(fluorosulfonyl)imide. Derived Abraham model correlations describe the observed partition coefficient data to within 0.13 log units. As part of the current study the existing equation coefficients for the N-triethyl(octyl)ammonium cation were updated and reported for the first time were equation coefficients for the bis(trifluorosulfonyl)imide anion.     

Study of molecular properties using acoustic non-linearity parameter in the ternary liquid mixtures at different temperatures

The parameters of non-linearity (B/A) of ternary liquid mixtures, namely phenol and o-cresol with dimethyl sulfoxide (DMSO) in carbon tetrachloride have been evaluated at 293.15, 303.15 and 313.15?K. The non-linearity parameter has been computed by three different methods, namely Tong and Dong's method, Beyer's method and Beyer's method using Tong–Dong coefficients. The excess values of non-linearity parameter (B/A)^E have also been evaluated and discussed in the light of intermolecular interactions present in the liquid mixtures. Sehgal's relations for evaluating molecular properties for pure liquids are extended to ternary liquid mixtures.