比塔派克斯的根尖诱导效果

目的　探讨比塔派克斯在根尖诱导术中的诱导效果 .方法　选择根尖尚未形成的年轻恒牙牙髓炎或根尖周炎共 112个患牙 (患者 97例 ) .随机分为两组 ,实验组 6 4个牙用比塔派克斯糊剂诱导根尖成形 ,对照组 4 8个牙用氢氧化钙糊剂诱导根尖成形 .结果　实验组根尖诱导效果优于对照组 ,两组间有显著性差异 (P <0 .0 5 ) .结论　比塔派克斯糊剂比氢氧化钙糊剂具有更好的根尖诱导作用     

Ab initio study of the effects of Ag/Mn doping on the electronic structure of LiFePO_4

Based on density functional theory (DFT) of the first-principle for the cathode materials of lithium ion battery, the electronic structures of Li(Fe1-xMex)PO4 (Me = Ag/Mn, x = 0―0.40) are calculated by plane wave pseudo-potential method using Cambridge serial total energy package (CASTEP) program. The calculated results show that the Fermi level of mixed atoms Fe1-xAgx moves into its conduction bands (CBs) due to the Ag doping. The Li(Fe1-xAgx)PO4 system displays the periodic direct semiconductor characteristic with the increase of Ag-doped concentration. However, for Fe1-xMnx mixed atoms, the Fermi level is pined at the bottom of conduction bands (CBs), which is ascribed to the interaction be-tween Mn(3d) electrons and Fe(4s) electrons. The intensity of the partial density of states (PDOS) near the bottom of CBs becomes stronger with the increase of Mn-doped concentration. The Fermi energy of the Li(Fe1-xMnx)PO4 reaches maximum at x = 0.25, which is consistent with the experimental value of x = 0.20. The whole conduction property of Mn-doped LiFePO4 is superior to that of Ag-doped LiFePO4 cathode material, but the structural stability is reverse.     

Theoretical study on the lithium bond interaction of furan homologues C_4H_4Y (Y=O, S) with LiCH_3 via DFT and MP2

The optimizations geometries and interaction energy corrected by BSSE of the complexes between C4H4Y (Y=O, S) and CH3Li have been calculated at the B3LYP/6-311 G** and MP2/6-311 G** levels. Three complexes were obtained. Abnormally, the calculations showed that all the C10—Li14 bond lengths increased obviously but the blue-shift of C10—Li14 stretching frequency occurred after formed complexes. The calculated binding energy with basis set super-position error (BSSE) and zero-point vibrational energy corrections of complexes I―III is ?45.757, ?35.700 and ?39.107 kJ·mol?1, respectively. The analyses on the combining interaction with the atom-in-molecules theory (AIM) also showed that a relatively strong lithium bond interaction presented in furan homologues C4H4Y---LiCH3 systems. Natural bond orbital theory (NBO) analysis has been performed, and the results revealed that the com- plex I is formed with n-σ type lithium bond interaction between C4H4O and LiCH3, complex II is formed with π-s type lithium bond interaction between C4H4O and LiCH3, and complex III is formed with π-s and n-s type lithium bond interactions between C4H4S and LiCH3, respectively.     

氢氧化镁表面改性及其在LDPE中的应用

采用表面改性剂对氢氧化镁颗粒进行表面改性，探讨了表面改性剂种类、用量对氢氧化镁颗粒表面性质的影响．结果表明：当多磷酸酯的质量分数为1％时，氢氧化镁的物理性质趋于最佳．进而将改性氢氧化镁与聚乙烯共混，其拉伸强度明显提高．     

Sol-gel水热偶合法制备纳米AlOOH及其表征

以AL2（SO4）3为原料，在pH值为3．5，溶胶浓度为0．3-0．5mol/L，分散剂0．3％，温度为80℃的条件下，胶溶4h，后经5h100-150℃的水热处理，制得平均粒度小于70nm的AlOOH；用TEM、X射线衍射、TG-DTA对样品进行了表征，并研究了不同介质、不同pH、不同分散剂用量对分散性能的影响。     

熔融碳酸盐燃料电池阴极材料制备与导电性

研究了熔融碳酸盐燃料电池（MCFC）阴极材料锂铁氧化物电极的导电性能。实验结果表明在合成锂铁氧化物的过程中，使Li2CO3轻微过量，可以提高锂铁氧化物电极的导电性。在同一温度下，随着Li:Fe值的增大，锂铁氧化物电极的导电性增加。相同Li:Fe条件下，锂铁氧化物电极的导电性随着温度升高按指数规律增加。扫描电镜研究（SEM）表明，Li:Fe比值不同，制备的锂铁氧化物电极表面形貌也不同。     

超声喷雾热分解法制备电极材料LiCoO2薄膜

以硝酸锂和乙酸钴为原料,玻璃为基片,通过超声喷雾热分解法制备了锂钴氧化物薄膜,并讨论了制备条件对形成薄膜如Li与Co摩尔比对薄膜晶型、不同溶剂对雾化效果、热分解温度对产物晶型和薄膜外观、反应时间对膜厚等的影响,经X-射线衍射分析和电镜测试,给出了制备较好晶型结构LiCoO2薄膜的条件.     

液相法制备LiMn2O4及掺杂研究

以LiNO3,Mn(NO3)2和弱有机酸为原料,将其按一定比例混合,先于低温蒸干水分,再在250℃加热1h,得到黑色前驱物粉末;将前驱物在650～800℃焙烧10～20h便可得到LiMn2O4晶体.此外,研究了生产LiMn2O4晶体过程中温度及添加Ni,Co,Al对LiMn2O4晶化程度和结晶结构的影响.研究结果表明:利用液相法可以使反应物充分反应,能够得到晶形完整、结晶度高的尖晶石型LiMn2O4;并通过该液相法能更均匀掺杂,得到晶粒粒径更小的掺杂Ni,Co,Al型LiMxMn2-xO4.     

微电极在 Ni(OH)_2 使用寿命测定中的应用

采用粉末微电极技术，通过循环伏安法对Ｎｉ（ＯＨ）２使用寿命的测定进行了研究．通过控制微电极孔穴深度，使电极过程不受液相扩散控制，从而提高了电极的充放电电流．在电极循环过程中，放电峰电流随着循环次数而变化，从而反映出电极的循环性能．在每次循环扫描过程中，充电深度达到７５％，能够满足常规检测的要求．对含Ｃｏ与不含Ｃｏ两种Ｎｉ（ＯＨ）２的检测结果说明，Ｃｏ有利于延长Ｎｉ（ＯＨ）２的寿命，这一点与已往的结论是相符的．应用这一技术，完成一次测试所需时间不到１０ｈ．这种方法对于研究Ｎｉ（ＯＨ）２掺杂元素对寿命的影响是非常快速而有效的．     

锂金属与室温熔盐相互作用的电化学和SEM研究

用电化学交流阻抗，循环伏安法和扫描电镜方法研究了锂和１－甲－３－乙咪唑氯化物／ＡｌｃＬ３室温熔卤体系的相互作用结果表明，锂与该室温熔盐体系发生快的化学反应，生成两种钝化膜。