金属纳米颗粒的热导率

本文使用统计模拟方法对金属纳米颗粒的电子平均自由程进行了计算,并考察了纳米颗粒的晶格比热和声子平均群速度,最后应用动力学理论对纳米颗粒的电子热导率和声子热导率分别进行了求解.研究结果表明:具有相同特征尺寸的方形、球形纳米颗粒的无量纲电子(或声子)平均自由程比较接近.金属纳米颗粒的电子热导率远大于声子热导率;电子、声子热导率随着直径减小呈现降低趋势,而电子热导率的颗粒尺度依赖性比声子热导率更为明显;随着颗粒直径进一步减小,声子热导率与电子热导率趋于同一数量级.当纳米颗粒特征尺寸大于4倍块材电子(或声子)平均自由程,其电子(或声子)热导率的颗粒尺度依赖性将减弱.     

Transition between layered and filamentary types of anisotropy in layered superconducting structures

A model of layered superconducting structure consisting of alternating anisotropic superconducting layers S₁ and S₂ with different transition temperatures is considered. It is shown that due to competition between two origins of anisotropy - effective-mass anisotropy of individual layers and proximity-induced anisotropy the effective anisotropy of the whole system signficiantly varies temperature. The components of the effective-mass tensor m_c (along the anisotropy axis) and m_a (perpendicular to the anisotropy axis) strongly depend upon temperature. This may lead to transition between layered (m_c > m_a) and quasi one-dimensional (m_c < m_a) types of anisotropy as well as to biaxial-type anisotropy which is also temperature dependent. The field distribution in a tilted vortex in a biaxial superconductor is calculated. The change in the properties of the vortex lattice with temperature in such systems is also investigated. The properties of YBa₂Cu₃O_x/PrBa₂Cu₃O_y multilayers are discussed in this connection.     

N4H4分子取代基效应的量子化学研究

本文计算了甲基(-CH3),羟基（-OH）对1-丁氮烯和2-丁氮烯的取代基效应。当1-丁氮烯引入取代基后,N=N双键的键长变短,而N-N单键的键长增长。异构体2-丁氮烯的键长变化较小。当引入甲基或羟基后,N原子的孤对电子会与相应的N-C(N-O)键之间发生相互作用,使整个分子的超共轭作用增强。随着取代基数目的增多,总能量和生成热就会降低,取代基数目与分子能量（生成热）之间具有很好的相关性。     

基于贝叶斯序贯方法的微波效应实验设计

提出了一种基于贝叶斯验后概率的序贯检验方法,建立了检验的判别准则,给出了判别准则临界值的计算方法。在给定截尾实验次数的条件下,提出了一种截尾方案,建立了截尾判断方法。将其用于解决验证效应物在微波作用下失效概率达到给定水平的微波效应实验设计问题,给出了相应的实验方案和所需样本量的估计。最后,通过实例对上述方法的应用过程进行了说明,并和现有方法进行了分析比较。     

拉曼效应对负折射介质中超短脉冲传输的影响

通过数值法对包含拉曼延迟响应的(3+1)维非线性薛定谔方程进行求解,研究了超短脉冲激光在负折射介质中传输时拉曼效应对自聚焦传输特性的影响,着重分析其不同与常规介质的反常传输现象.结果表明:由于负的折射率影响,拉曼效应将导致超短脉冲在自聚焦过程中频谱发生蓝移现象,这与常规介质对应情形相反;而它对负折射介质中超短脉冲的自聚焦特性的影响与常规介质相同,即拉曼效应将诱导自聚焦效应首先发生在脉冲的前沿.本文研究工作对将来利用负折射介质来操控超短光脉冲串产生、自聚焦等许多实际应用领域研究具有重要的指导意义.     

吸收谱交迭的双组分混合液的荧光谱校正研究

荧光内滤效应以及样品池中荧光物质对激发光的吸收分布会直接影响荧光谱的强度和谱形,共同制约荧光分析法的应用。使用吸收谱及荧光谱存在交迭的双组分混合溶液,研究一种新的基于物理吸收模型的校正方法,以校正荧光内滤效应及吸收分布对荧光强度的影响。对三聚噻吩和五聚噻吩混合液的光谱研究表明,使用所述校正方法可以达到较为理想的校正效果, 误差小于5%。     

Implementation of the Laser Diffraction Technique for Acoustic Cavitation Bubble Investigations

Knowledge of the acoustic cavitation cloud would be useful for improving ultrasound reactor design. Among the characterisation techniques, few are adapted to bubble investigations in an intense ultrasound field. Some problems raised by these measurements result from interactions between the acoustic pressure wave and the measuring light wave. This paper reports the implementation of the laser diffraction technique to determine the size and volume concentration of bubbles generated by a dipping horn operating at 20 kHz. Measurements were performed with a Malvern 2600 instrument. The size distribution, deduced from the diffraction pattern scattered by the bubble cloud crossed by a laser beam, is disturbed by the acoustic pressure wave involving deviation of a light beam at low diffusion angles (acousto‐optic effect). A bubble size correction procedure based on the subtraction of the light energy due to the ultrasound wave is described. The size measurements, and thus the correction procedure, were validated by a second laser technique based on a different measuring principle: phase Doppler interferometry. The measurement reliability was further confirmed by an original application of laser diffraction based on measurements performed just after sonication. These three methods lead to a mean bubble size (Sauter mean diameter) of about 10 μm at a high ultrasound power input. Concerning the void fraction, only measurements achieved after sonication and by laser diffraction predict a correct estimation of this parameter.     

脂肪胺类化合物氨基15N NMR化学位移规律的研究

提出了计算脂肪胺类化合物的¹⁵N NMR化学位移的经验公式：δ_cal（¹⁵N）=-380.2+ΣΔα+ΣΔβ+ΣΔγ+ΣΔδ+ΣC,结合最小二乘法通过线性回归得到了11种取代基参数,计算结果以133种化合物的133个¹⁵N NMR化学位移数据为样本点进行回归检验,置信度为99.5 %,约有94.7 %的¹⁵N NMR化学位移计算值的计算误差小于5.0（相对误差小于0.5 %）.     

羧酸甲乙酯中羰基17O-NMR化学位移研究

提出了计算羧酸甲乙酯中羰基¹⁷O-NMR化学位移的公式：δ_cal（¹⁷O）=360.0+Δα+Δβ+Δγ,通过线性回归法确定了22种取代基参数.经回归检验表明该公式计算结果置信度为99.5%,与实验值的偏差Δδ在5.0以内的羰基¹⁷O-NMR化学位移计算值~100%.     

粉末微波滤波器的制备和特性

利用通电导线的电磁感应和铜粉的趋肤效应,试制了在超导量子计算实验系统中使用的粉末微波滤波器.滤波器的频率响应随频率升高而平缓下降,在1GHz左右衰减至-80dB.我们分析了滤波器的原理,并通过改变参数对滤波器性能的变化进行了详细的研究.