CBCT评价过渡性义齿在全口义齿重新修复中的应用效果

本研究探讨锥形束CT技术(CBCT)评价过渡性义齿在全口义齿重新修复中的应用价值。选择107例全口义齿重新修复患者,根据修复效果分为修复失败组(n=26)与修复成功组(n=81)。修复前后均接受CBCT检查,对比两组佩戴新旧义齿颞下颌关节前间隙、中间隙、后间隙变化值。结果显示,修复失败组佩戴新旧义齿颞下颌关节前间隙、中间隙、后间隙变化值大于修复成功组(P<0.05);佩戴新旧义齿颞下颌关节前间隙、中间隙、后间隙变化值与颌位关系指数、咀嚼效率、美学评分、舒适度变化值呈负相关(P<0.05);Logistic单因素、多因素回归分析表明,颞下颌关节前间隙、中间隙、后间隙变化值与全口义齿重新修复效果独立相关(P<0.05);颞下颌关节前间隙、中间隙、后间隙变化值联合评估修复效果的AUC为0.905,敏感度为80.77%,特异度为88.89%,明显优于各指标单独评估。CBCT检查指标可有效评估过渡性义齿在全口义齿重新修复中的应用效果,为临床提供可靠的参考依据。     

Theoretical Study on the Long-lived Complexes for the Na＋I2 Collision System

For the Na I2 collision system, theoretical study is performed on the QCISD(T) level by using ab initio method. The ab initio potential energy surfaces are got and on them the long-lived complexes are found and optimized. These results verify the crossed molecule beam experimental phenomenon and the detailed geometry structures are given for the first time. The role of the complexes in the reaction path is also described in detail.     

一维有限深方势阱能量本征方程的泰勒级数解和二次近似解

一维有限深方势阱能量本征方程的求解受限于超越方程,无法严格求解.本文将奇、偶宇称情况的超越方程归结为一个方程,自洽地给出两种近似解析解：一阶泰勒级数解和二次近似解.分析二者适用范围并做误差分析,发现泰勒级数解可以很好地理解能谱随量子数n平方变化的数值解(即,所谓n平方律),但在特定参数R下失效,该参数正比于势阱宽度乘以势阱高度开方.二次近似解对所有参数R都适用,能谱在大R极限下,可退化为精确求解的无限深势阱情况.对于任意参数R,二次近似波函数的保真度始终大于99.7%.     

1,3-取代方酸衍生物非线性光学性质的从头算和半经验方法的比较研究

The structures of 1,3-substituted squaraine derivatives Sq1 ～ Sq12 were fully optimized by ab initio HF method with 6-31G* basis set level,and the electronic structures of Sq1 ～ Sq12 were also calculated. Based on the optimized structures,the electronic spectra were obtained by the CIS / 6-31G* method,which suggested that the max absorption wavelength mainly resulted from the electronic transition from HOMO to LUMO. The second nonlinear optical coefficients（β0）were calculated using ab initio CPHF method at 6-31G* basis set level and FF / AM1,FF / PM3,FF / MNDO,FF / MINDO3 methods. A systematic comparison between the results was carried out. It indicated that the second nonlinear optical coefficients were affected dramatically by the properties of five-membered hetero-rings. β0 can be enhanced by introducing pyrrole,thiazole and oxazole. The position of five-membered rings containing two heteroatoms which were connected with four-membered squaraine rings also affected β0 .     

Special Issue for the Chinese Chemical Society＇s 13th National Chemical Dynamics Symposium

Chemical kinetics and reaction dynamics, as a crucial branch of physical chemistry, mostly concerns with the ＂how, why and when＂ of chemical reactions, which is not only an exciting intellectual frontier but also addresses grand societal needs. These two aspects promote rapidly developing a series of experimental techniques, including ultrafast lasers, high resolution mass spectrometry and optical spectroscopy, and crossed molecular beam etc. Thanks to the rapid development of computer sci- ence, nowadays it is possible to calculate the reaction rates of complex reaction systems by advanced statistical kinetic theories based on accurate potential energy surfaces,     

W/VO2周期性纳米盘阵列可调中红外宽频吸收器

为了实现对3～5μm中红外光的完美吸收,仿真设计了一种基于W/VO2周期性纳米盘阵列的可调中红外宽频吸收器,利用时域有限差分法模拟计算了结构参数对吸收器性能的影响.在最佳结构参数条件下,吸收器表现出偏振无关和广角吸收的特性,在3.1～3.6μm范围内吸收率达99%以上,峰值吸收率为99.99%.低温时入射光的磁场被束缚在各单元VO2介质层的中心并得到完美吸收;高温时VO2发生相变表现为金属相,抑制吸收,高低温的吸收率差值可达78.8%.该吸收器有效弥补了传统吸收器吸收频带窄、吸收率不可调的缺陷,对中红外光电器件的应用有参考价值.     

有限CN-p-群

每个子群都C-正规的有限群称为CN-群.本文首先给出二元生成的CN-p-群的完全分类.在此基础上得到CN-p-群的结构:当p为奇素数时,有限群G为CNp-群当且仅当G的每个元都平凡地作用在Φ(G)上;有限群G为CN-2-群当且仅当对任意给定的a∈G,都有对任意g∈Φ(G),g~a=g或者对任意g∈Φ(G),g~a=g~(-1).最后给出两个CN-p-群的直积是CN-p-群的判定条件.     

一类特定的AF-代数

讨论了一类特定的AF-代数,其上的恒等同态可以用一列有限维值域的自同态逐点逼近.给出了这类AF-代数的K-理论刻画,并给出了一个不在这一类中的RFD AF-代数的例子.     

离子液体辅助水热法合成六方WO3纳米棒束

提出了利用简单的离子液体1-甲基-3-乙基-咪唑溴辅助水热法合成六方WO₃纳米棒束的方法,对其结构进行了表征,并讨论其形成机理。TEM照片表明：WO₃纳米棒束由长200~300 nm、直径25~30 nm的纳米棒组装而成。离子液体1-甲基-3-乙基-咪唑溴在纳米棒的形成过程中起到了结构导向剂的作用。