3d过渡金属离子注入锐钛矿TiO2第一性原理研究

用金属离子注入方法在锐钛矿TiO2薄膜中掺杂3d过渡金属（V,Cr和Fe）离子,采用全势线性缀加平面波（FP-LAPW）方法计算3d过渡金属离子掺杂后锐钛矿TiO2的电子结构,通过紫外-可见吸收光谱测试方法检测3d过渡金属离子注入对TiO2薄膜吸收光谱的影响.实验结果和理论计算表明,离子注入后,锐钛矿TiO2薄膜带隙宽度变小,V,Cr和Fe离子的3d态在紫外-可见吸收光谱的红移中起关键作用.     

Ni、Cu、Pt掺杂改性锐钛矿相TiO2原理的全势线性缀加平面波法分析

利用基于密度泛函理论(DFT)的全势线性缀加平面波(FP-LAPW)法,计算并比较Ni、Cu、Pt掺杂前后锐钛矿相TiO2晶体的能隙和电子态密度.计算结果表明,Ni、Cu、Pt掺杂后TiO2 的带隙分别为1 33、1 87和1 17 eV,相对于未掺杂的锐钛矿相TiO2(带隙为2 30 eV)都有明显的变窄,因而使吸收光谱红移.对于相同剂量的掺杂,同周期的Ni比Cu的掺杂效果更明显,同副族的Pt比Ni的掺杂效果更明显.     

广域电力系统的量化输出反馈控制

采用量化器将测量输出数据进行量化,用于解决数据存储空间不足以及通信拥塞问题,便于系统扩展和监控.设计了基于观测器的量化输出反馈控制器,保证系统稳定性且改善系统的动态性能.通过电力系统仿真实验验证了该方法的有效性.     

Preparation and Photocurrent Performance of Highly Ordered Titania Nanotube Implanted with Ag/Cu Metal Ions

Ag/Cu-doped titania nanotubes （Ag/TiNT, Cu/TiNT） are prepared by a metal vapor vacuum arc implanter. A scanning electronic microscope is employed for microstruetural characterization. The photo-current performance of doped titania nanotubes under UV and visible light is tested by an electrochemical workstation CS300UA, the results show that the absorption edge of both Ag/TiNT and Cu/TiNT samples shifts to the visible light region and the band gap becomes narrower. Ag/TiNT possesses better photo-current ability than Cu/TiNT under UV and visible light. Titania doped with Ag and Cu metal ions is also studied based on the linearized augmented planewave method implemented by WIEN2k package, the result becomes better with the experimental performance.     

Effect of Laser Pulse Shape on the Wake Field in Relativistic Intense Laser—Plasma Interaction

We study the effect of laser pulse shape on the plasma wake field driven by an intense laser beam.It is found that the modified asymmetric laser pulse shape with a sharply rising front and broad falling back,due to some nonlinear interactions of an intense laser pulse with plasmas,can significantly enhance the magnitude of the wake field.     

Calculation of Electronic Structure of Anatase TiO2 Doped with Transition Metal V,Cr,Fe and Cu Atoms by the Linearized Augmented Plane Wave Method

The electronic density of states and band structures of doped and un-doped anatase TiO2 were studied by the Linearized Augmented Plane Wave method based on the density functional theory. The calculation shows that the band structures of TiO2 crystals doped with transition metal atoms become narrower. Interesting, an excursion towards high energy level with increasing atomic number in the same element period could be observed after doping with transition metal atoms.     

V+离子注入制备可见光灵敏TiO2光催化薄膜

利用金属蒸汽真空弧(MEVVA)源离子注入机在溶胶凝胶法制备的TiO2薄膜上注入V .薄膜表面的形态和结构分别用扫描电子显微镜(SEM)和X光衍射仪(XRD)进行了研究.通过紫外可见光漫反射谱仪(UV-Vis)测量了注入和退火后薄膜吸收光谱的扩展.在波长λ>400nm辐照下,甲基橙(MO)水溶液中的光催化实验证明,这种薄膜具备可见光波段的催化能力.这种催化效果在V 注量为1×1016 cm-2时最好.     

Ag/TiO2薄膜光催化性能的研究

用含有AgNO3的复合溶胶凝胶制备Ag/TiO2薄膜,然后对其进行了SEM,XRD,RBS研究,以甲基橙为反应物检验了含有不同n(Ag)/n(Ti)的Ag/TiO2薄膜在365nm紫外光作用下的光催化降解效率.具有最佳光催化降解效率的是溶胶中n(Ag)/n(Ti)=0.064的Ag/TiO2薄膜,与未掺银TiO2薄膜相比,效率提高了73%.     

钨离子沉积聚酯薄膜表面抗磨损特性

采用钨离子束磁过滤技术,对引出的钨离子束中大颗粒离子进行过滤后 ,再注入和沉积到聚酯薄膜(PET)表面,可获得抗磨损特性优异的沉积的金属钨膜.扫描电 子显微镜观察表明,大颗粒已被过滤,表面结构致密.测量表明,镀膜的硬度、弹性模量和 抗磨损特性得到了很大的提高,与基体的黏合特性有了明显改善.进一步对抗磨损机制进行了探讨.     

离子注入制备锐钛矿型Fe:TiO2薄膜紫外光、可见光和自然光催化效果研究

采用溶胶-凝胶法制备纳米Ti O2薄膜,然后用金属蒸汽真空弧(metal vapour vacuumarc,MEVVA)离子注入机注入从6×1015~6×1016cm24种注量的Fe离子,制备复合纳米Fe:Ti O2薄膜.用UV-Vis透射光谱和XRD对催化剂进行了表征.对薄膜在紫外光、可见光和自然光下降解甲基橙的光催化脱色效果进行了研究.