锝化学研究 Ⅸ.脑显像剂Tc~(Ⅴ)ON_2S_2类配合物结构稳定性和价态的研究

采用改进的ＣＮＤＯ／２法模拟了ＢＡＴ类脑显像剂Ｔｃ（Ⅴ）Ｏ配合物价态的转换过程，发现Ｎ２Ｓ２类配体与Ｔｃ（Ⅴ）Ｏ核配位时，可能存在配位平衡离子Ｘ。在溶液中由于Ｘ离子的优先解络，瞬间存在＋１价对称性９９Ｔｃｍ配合物，并且，它又自动向相对稳定的０价不对称性９９Ｔｃｍ配合物转换，在动态转换过程中，将导致仅有一个配位Ｎ原子保留一个质子，这与实验结果一致。采用键级削弱百分数概念，表征配位过程的二个配位Ｎ原子上保留程度，解释了Ｔｃ（Ⅴ）Ｏ核、Ｔｃ（Ⅴ）≡Ｎ核Ｎ２Ｓ２类配合物两个Ｎ－Ｈ键上质子保留程度不同的原因，为今后设计不同价态锝配合物结构提供理论依据。     

基于微机的X射线分析自动测量系统

本文介绍了一个基于微机的X射线分析自动测量系统。该系统有三个基本功能:自动获取数据、自动换样和处理谱数据。     

EC与~（99m）Tc－GH之间的配体交换反应动力学研究

实验表明，ＥＣ浓度与配体交换反应速度常数无关，体系的ｐＨ值对速度常数和９９ｍＴｃ－ＥＣ的标记率影响较大。测定并计算了不同ｐＨ值的交换反应速度常数。结果表明，为保证用配体交换法制备９９ｍｃ－ＥＣ时９９ｍｃ－ＥＣ的标记率大于９０％，体系的ｐＨ值必须≥８。     

宽频带函数波形产生器的研制

本文介绍以ＭＡＸ０３８为基础而研制的宽频带函数波形产生器，它可以产生２￣２×＾７Ｈｚ频率范围的正弦波、三角波、锯齿波和矩形波以及与它们同步的ＴＴＬ脉冲信号。     

GRU-based capsule network with an improved loss for personnel performance prediction

Applied Intelligence - Personnel performance is a key factor to maintain core competitive advantages. Thus, predicting personnel future performance is a significant research domain in human...     

Granular multiple kernel learning for identifying RNA-binding protein residues via integrating sequence and structure information

Neural Computing and Applications - RNA-binding proteins play an important role in the biological process. However, the traditional experiment technology to predict RNA-binding residues is...     

煤中吡啶型氮热解机理的量子化学研究

用密度泛函 ( DFT)方法 ,在 UB3LYP/6- 31 G( d)水平上研究了煤中吡啶型氮的热解机理 ,对热解过程中由于官能团周围环境的不同而形成的三类吡啶自由基进行了量子化学计算 ,通过对键的 Mulliken布居数等计算结果的分析 ,分别得到了这三类自由基的热解途径 .并优化得到了反应物、中间体和产物的几何构型 .计算结果表明 ,吡啶型氮主要是以 HCN的形式释放出来的 .NH3 是 HCN二次反应的产物 .     

Dynamic response of Ti3SiC2 under shock compression up to 112 GPa

Ti₃SiC₂ is of interest due to its unique dual nature reminiscent of both brittle ceramics and ductile metals at ambient conditions. In this work, plate-impact experiments have been performed to study the dynamic behavior of Ti₃SiC₂ under shock compression up to 112 GPa by using laser velocity interferometer and electric pin techniques. Hugoniot elastic limits (HEL), spall strength, and Hugoniot equations of state have been obtained based on measured particle velocity profiles and shock wave velocities. The ratio of spall strength to HEL for Ti₃SiC₂ is larger than brittle ceramics but smaller than metals. This result indicates that the dual nature of Ti₃SiC₂ remains at least up to 10 GPa. On the other hand, the linearity of the Hugoniot equation of state, $D=6.9\text{0}1(22)+1.153(53)u_{\text{p}}$, suggests that the initial structure of Ti₃SiC₂ should be stable up to 112 GPa, in contrast to the result reported by Jordan et al. [J. Appl. Phys., 93 (2003) 9639].     

国产软硬件环境下图像组织浏览构件设计

针对在国产软硬件环境下,应用系统读取、浏览大量图像数据的速度慢问题,设计了图像组织浏览构件。通过改进图像组织方式,将基础影像和目标对象图像分开组织管理,并对目标对象图像的属性和分层、分类进行探讨,实现图像信息的快速展现。对图像组织浏览构件进行了插件化设计与实现,利用QT跨平台开发工具,实现了应用集成框架,并通过实现统一集成接口,进行各业务插件的集成。     

Relations between quantum correlations,purity and teleportation fidelity for the two-qubit Heisenberg XYZ system

Quantifying and understanding quantum correlations may give a direct reply for many issues regarding the interesting behaviors of quantum system. To explore the quantum correlations in quantum teleportation, we have used a two-qubit Heisenberg XYZ system with spin–orbit interaction as a quantum channel to teleport an unknown state. By using different measures and standard teleportation protocols, we have derived the analytical expressions for quantum discord, entanglement of formation, purity, and maximal teleportation fidelity of the system. We compare their different characteristics and analyze the relationships between these quantities.