Eu2+激活的BaFCl1-xBrx,BaFCl1-xIx和BaFBr1-xIx体系的发光性质

本文研究了BaFCl1-xBrx,BaFCl1-xIx和BaFBr1-xIx体系中Eu2+的发光光谱和相对发光强度,并讨论了在这些体系中Eu2+的4f65d1能级随组成的变化。     

Can (H2O) n (n = 1–2) as effective catalysts in the CH2OO + H2S reaction under tropospheric conditions?

The addition reaction of CH₂OO?+?H₂S → HSCH₂OOH without and with catalyst X (X?=?H₂O and (H₂O)₂) has been investigated by CCSD(T)-F12a/VTZ-F12//B3LYP/aug-cc-pVTZ method and canonical variational transition state theory with small curvature tunneling correction. When H₂O was introduced in the CH₂OO?+?H₂S reaction, it not only acts as a catalyst for producing HSCH₂OOH, but also plays as a reactant to forming HOCH₂OOH. The formation channel of HSCH₂OOH is more important than the formation channel of HOCH₂OOH with its calculated rate constant larger by 11.0–43.2 times within the temperature 280–320?K. Then, (H₂O)₂ catalysed CH₂OO?+?H₂S → HSCH₂OOH reaction has been taken into account with its rate lower 1.9–4.2 times than the reaction of CH₂OO?+?H₂S → HSCH₂OOH with water. Also, CH₂OO?+?H₂S with H₂O cannot compete with the CH₂OO?+?H₂S reaction without water. This is different from CH₂OO?+?(H₂O)₂ reaction, which is about 4 orders of magnitude larger than the rate constant for CH₂OO?+?H₂O reaction. Such discrepancy is possible because C(CH₂OO)···O(H₂O) interaction has been enhanced more obviously by H₂O as compared to that of C(CH₂OO)···O(H₂S) interaction.     

可溶性离子对煅烧烟气脱硫石膏水化的影响

本文主要研究了不同水溶性离子对煅烧烟气脱硫石膏水化过程,也就是对大块煅烧石膏向石膏转化的相变过程的影响. 研究表明,在煅烧石膏向石膏转化的相变过程中,所有的阳离子都能加速煅烧石膏的水化作用,其中Ca²⁺的加速效应最弱. 对于最终沉淀得到的晶体,除了钠离子外,晶体尺寸不受不同种类盐的影响. 而在钠离子中,可以观察到长度大于130 μm的巨型结晶. 本研究阐明了不同离子对煅烧石膏水化的影响,为原始的烟气脱硫石膏在实际应用前的预处理提供了充分的指导.     

Applications of Markov spectra for the weighted partition network by the substitution rule

The weighted self-similar network is introduced in an iterative way. In order to understand the topological properties of the self-similar network, we have done a lot of research in this field.Firstly, according to the symmetry feature of the self-similar network, we deduce the recursive relationship of its eigenvalues at two successive generations of the transition-weighted matrix.Then, we obtain eigenvalues of the Laplacian matrix from these two successive generations.Finally, we calculate an accurate expression for the eigentime identity and Kirchhoff index from the spectrum of the Laplacian matrix.     

第三族金属氧化物离子对二氧化碳转化的红外光谱研究

本文利用红外光解离光谱研究了第三族金属氧化物离子对二氧化碳分子的转化机制. 研究表明,对于[ScO(CO₂)_n]⁺体系,在n≤4时,形成了溶剂化结构;在n=5时,形成了碳酸盐结构,实现了二氧化碳的转化. 对于[YO(CO₂)_n]⁺体系,需要4个二氧化碳分子就可以实现二氧化碳的转化. 而在[YO(CO₂)_n]⁺体系中,只发现了溶剂化结构,没有观察到碳酸盐结构. 理论计算表明,[YO(CO₂)_n]⁺体系拥有最小的溶剂化结构向碳酸盐结构转化能垒,[LaO(CO₂)_n]⁺体系拥有最大的溶剂化结构向碳酸盐结构转化能垒. 本文从分子水平揭示了不同金属氧化物离子对二氧化碳分子转化的影响规律.     

对薄层柱壳爆炸膨胀断裂过程的研究

 本文提出了一个用于描述动态破坏发展过程的损伤度函数。从这个损伤度函数出发,把材料特征性方程取为强化粘塑性本构方程形式,导出了薄层柱壳爆炸膨胀运动在两种近似下（恒定膨胀速度近似合恒定应变速率近似）断裂判据的解析表达式。结果分析表明,在上述条件下,存在着一个动态断裂“塑性峰”,在这个峰值条件的应变率下,柱壳出现贯穿断裂时刻的应变最大。以软钢为算例,本断裂判据可以比较好地解释Иванов和陈大年等给出的实验结果。这时,动态断裂“塑性峰”对应的应变率为4×10⁴ s^-1,相应的应变约为60%~80%。     

高温高压下CeTbO3合成过程中电阻的动态测试研究

 在0.5 GPa、4.0 GPa的压力下，从室温到800 ℃的温度范围内测量了氧化物CeTbO₃、单稀土氧化物Tb₄O₇、CeO₂和摩尔比维4∶1配比的混合物CeO₂+Tb₄O₇等的电阻随温度变化关系。对这四种物质均反映出电阻随温度增加而减小的半导体特征。在压力维0.5 GPa，温度高于600 ℃时发现了混合物CeO₂+Tb₄O₇、氧化物Tb₄O₇中电阻变化的起伏。X射线衍射谱表明，对应这一电阻变化，在结构上出现了变化。结果分析表明，这一变化与Tb⁴⁺→Tb³⁺的价态变化密切相联。     

稀土焦绿石化合物R2Fe4/3W2/3O7的高温高压稳定性研究和X射线相分析

 本文利用X射线粉末衍射和位敏探测技术，研究了R₂Fe_4/3W_2/3O₇（R=Er、Yb、Dy）化合物经高温高压处理后的变化情况。在3.7 GPa，1 200 ℃条件下，六方相R₂Fe_4/3W_2/3O₇化合物按两种方式分解，而直接由R₂O₃，Fe₂O₃和WO₃原料出发，经上述同样的高温高压条件合成所得的产物与六方相高温高压分解产物相同，均为R₂WO₆、RFeO₃、WO₃和Fe₂O₃的多相聚合物。同时给出了R₂Fe_4/3W_2/3O₇六方相高温高压下的稳定区范围。     

Polarization density matrix forZ decay intoWff' with generalZWW couplings

We give the polarization density matrix ofZ andW for the decay processZ ⁰→Wff' with generalZWW couplings. The matrix elements are expressed in terms of kinematical invariants so that they can be readily used in \(p\bar p \to Z^0 W\) as well. Using these formulas, we analyze the possibilities of probing theZWW couplings through the decay of polarizedZ ⁰.