去氢枞酸类成核剂改性聚丙烯的非等温结晶动力学研究

对以去氢枞酸盐为成核剂的聚丙烯非等温结晶动力学进行了研究，用修正Avrami方程的Jexiorny法和莫志深法进行处理。结果表明：修正Avrami方程的Jeziorny方法和莫志深法都适用于去氢枞酸类成核剂改性的聚丙烯的非等温结晶动力学。在同样的降温速率下纯聚丙烯的t1/2比成核聚丙烯的t1／2要长，当降温速率为20K/min时，纯聚丙烯和成核聚丙烯的t1/2分别为0．78min和0．51min。同时从莫志深法得到的F(T)结果可以看出，达到相同的结晶度时纯聚丙烯所需的降温速率要大于成核聚丙烯所需的降温速率，说明成核剂的加入提高了聚丙烯的结晶速率。从Jeziorny法求出的纯聚丙烯和成核聚丙烯的Avrami指数分别为4．46和2．77，表明成核剂改变了聚丙烯的结晶成核和生长方式。     

Isometric crystallization of stretched poly(e-caprolactone) sheets for medical applications

Low melting temperature thermoplastic sheets based on poly(e-caprolactone) (PCL) can be formed directly on the patient and are used as immobilization device (mask) in the radiation therapy. The immobilization mask is allowed to harden in isometric conditions on the body at room temperature. A new method for isometric crystallization kinetics of thermoplastic polymer sheets is developed using a tensile-strength instrument. The isometric crystallization method allows investigating the shrinkage force on time of crystallization of stretched samples of thermoplastic polymer sheets or immobilization medical devices. The dependence of the shrinkage force on time is described by Avrami equation and the kinetics parameters of isometric crystallization are calculated. This revised version was published online in July 2006 with corrections to the Cover Date.     

The Crystallisation Kinetics of Nitrate Cancrinite Na7.6[AlSiO4]6(NO3)1.6 (H2O)2 Under Low Temperature Hydrothermal Conditions

Investigations on the formation of nitrate enclathrated cancrinite were performed under low temperature hydrothermal conditions (353 K, autogeneous pressure). The alkaline transformation of kaolinite in the presence of sodium nitrate was selected as the preferred method of synthesis. All experiments were carried out at high alkalinity, using a 16 molar NaOH solution as well as at low NaOH concentrations (2 molar NaOH). Qualitative phase analysis was performed by X-ray-powder diffraction and IR-spectroscopy. Besides cancrinite formation no further intermediate phases were formed. Quantitative data of the educt conversion into cancrinite was determined by ²⁷Al MAS NMR spectroscopy and integration of the resonance signals of four- and six-coordinated aluminium. Whereas full conversion could be found already after 24 h of reaction under highly alkaline conditions, only an insufficient progress of the reaction resulted in the case of low alkalinity.     

交叉克尔非线性对二阶非线性诱导透明的影响

考虑耦合介质存在交叉克尔非线性的情形下,研究了交叉克尔效应对耦合双谐振腔中二阶非线性诱导透明的影响.首先给出了描述体系理论模型的哈密顿量,再通过对海森堡-朗之万方程进行线性化,得到了探测场的透射率,进而得出系统的吸收和色散关系.研究结果表明,在交叉克尔非线性强度较小时,可忽略其对诱导透明的影响;随着交叉克尔非线性强度的增大,诱导透明窗口宽度随之快速变窄.此外,吸收曲线中还出现了双吸收峰.进一步增强交叉克尔非线性,导致原本出现的诱导透明消失,并在新吸收峰处产生了新的诱导透明,新的诱导透明的吸收零点位置随着交叉克尔非线性增加而向左偏移.这些结果可能在不透明介质的窄窗口光传输和提高光学腔的性能方面提供一些参考.     

Rovibrational matrix elements of polarizability of HD, HT and DT molecules

Fresh computations of rovibrational matrix elements of the polarizability α[=(α_||+2α_⊥)/3] and the polarizability anisotropy γ(=α_||−α_⊥) of the heteronuclear isotopomers, HD, HT, and DT, of the hydrogen molecule are presented. The computations combine the most accurate polarizability functions α(R) and γ(R) (R being the bond distance) on the one hand and the most accurate adiabatic potential on the other. The calculations are extended to the product operators xα and xγ where x is the centre of mass to centre of charge separation in the heteronuclear species. The latter matrix elements are needed, additionally, for elucidating the absorption intensities of some of the zero-phonon rovibrational transitions peculiar to the heteronuclear species in the crystalline phase.     

非晶钛酸铋的晶化过程

利用差热分析、X射线衍射和透射电子显微镜等技术对溶胶-凝胶法合成的凝胶的晶化过程进行了分析，实验结果表明，Bi₄Ti₃O₁₂非晶凝胶晶化过程经历了四个过程：首先在433℃先形成了Bi₂O₃和TiO₂亚稳相，然后在488℃时TiO₂亚稳相与Bi₂O₃反应形成Bi，Ti复合氧化物亚稳相Bi₂T 关键词： 钛酸铋 铁电材料 溶胶凝胶 非晶 晶化过程     

液相基质中重金属元素激光诱导击穿光谱实验参数的优化

针对混合溶液中重金属元素的激光诱导击穿光谱(LIBS)测量系统,为提高测量系统的检测灵敏度,以提高混合溶液中Ca和Cr金属元素LIBS光谱线强度的信噪比为目标,对LIBS测量系统中的激光脉冲能量、液相样品流速、ICCD门宽、延时等实验参数进行了优化,得到最优化参数激光脉冲能量、样品流速、ICCD门宽、延时分别为35 m J、30 ml/min、1400 ns和2400 ns,为降低LIBS技术应用于混合溶液中痕量重金属元素的检出限提供了实验参数支撑.     

A simulation study of microstructure evolution during solidification process of liquid metal Ni

A molecular dynamics simulation study has been performed for the microstructure evolution in a liquid metal Ni system during crystallization process at two cooling rates by adopting the embedded atom method (EAM) model potential. The bond-type index method of Honeycutt--Andersen (HA) and a new cluster-type index method (CTIM-2) have been used to detect and analyse the microstructures in this system. It is demonstrated that the cooling rate plays a critical role in the microstructure evolution: below the crystallization temperature $T_{\rm c}$, the effects of cooling rate are very remarkable and can be fully displayed. At different cooling rates of $2.0\times10^{13}$\,K\,$\cdot$\,s$^{-1}$ and $1.0\times10^{12}$\,K\,$\cdot$\,s$^{-1}$, two different kinds of crystal structures are obtained in the system. The first one is the coexistence of the hcp (expressed by (12 0 0 0 6 6) in CTIM-2) and the fcc (12 0 0 0 12 0) basic clusters consisting of 1421 and 1422 bond-types, and the hcp basic cluster becomes the dominant one with decreasing temperature, the second one is mainly the fcc (12 0 0 0 12 0) basic clusters consisting of 1421 bond-type, and their crystallization temperatures $T_{\rm c}$ would be 1073 and 1173\,K, respectively.     

Temperature dependence of the properties of strong-coupling bipolaron in a quantum dot

Temperature dependence of the properties of strong-coupling bipolaron in a quantum dot (QD) is studied based on the Lee-Low-Pines-Huybrechts variational method and quantum statistical theory. Results of the numerical calculation show that the vibration frequency as well as the absolute value of the induced potential and the effective potential all increase with increasing coupling strength and temperature, respectively, and they also increase with decreasing relative distance of electrons. The bipolarons are closer and more stable when the temperature is higher and coupling strength is larger. The influence of radius of QD and dielectric constant ratio on the effective potential is little.     

高温高压下SrB4O7：Eu2+玻璃的晶化

 利用X射线衍射和Eu²⁺发射光谱方法研究了非晶玻璃SrB₄O₇在高温高压下的晶化。结果表明：在5.0 GPa压力下，200 ℃仍为玻璃态，只有几个强度极低的小峰，表明有晶化的迹象；600 ℃时已基本晶化，但为SrB₄O₇正交相与SrB₄O₇高压立方相二相共存；当温度提高到1 000 ℃时，晶化成了近单相的与常压SrB₄O₇粉末晶体相同的正交结构。伴随晶化度的加强，Eu²⁺发射强度增强，与Ｘ射线衍射结果相一致。