30.4 nm Cr/Al/Cr自支撑滤光片的研制

 依据材料的质量吸收系数和波长的关系,选择Cr和Al 设计和制备30.4 nm自支撑滤光片。在制备时以NaCl为脱膜剂,以热蒸发方式蒸镀Al,以电子束蒸发方式蒸镀Cr, 制备了30.4 nm的Cr/Al/Cr自支撑滤光膜,并对滤光片的表面缺陷进行了分析。通过显微镜观察,滤光膜均匀纯净,无明显针孔。Cr/Al/Cr自支撑滤光片在合肥国家同步辐射实验室进行了测量, Cr/Al/Cr厚度为5 nm/500 nm/5 nm和12.5 nm/500 nm/12.5 nm的滤光片在30.4 nm波长处的透过率分别为7.6%和4.6%,透过率曲线和理论计算基本一致。用紫外分光光度计测量得滤光片在200～800 nm波长范围的透过率小于0.02%,满足使用要求。     

薄片Cr:LiSAF激光器

本文报道了据我们所知的第-个用氪离子激光器泵浦500um厚的Cr:LiSAF激光晶体,实现了激光输出在泵浦功率为320mW时,得到了55mW的连续波激光输出.     

连续波Cr:LiSAF激光器

连续波Cr:LiSAF激光器阮双琛,侯洵,王水才,唐建明,丰善(中国科学院西安光学精密机械研究所710068)Cr:LiSAF(Cr³⁺:LiSrAlF6)晶体是一种新型的性质优良的近红外可调谐激光晶体。     

Y-Ba-Cu(Cr)氧化物超导体

我们在Y-Ba-Cu-O系中得到零电阻温度Tcf为94.1K,中点转变温度Tc为95K,起始转变温度Tci为100K,转变宽度△Tc为1K的超导体。低温X光衍射结构分析结果表明,多相超导体在低温区(123—173K)有相变。因此,我们认为Y-Ba-Cu-O系中多相超导体的高Tet是低温相变引起的,并不完全是超导转变点。在该系氧化物中以Cr取代1/3的Cu,仍然得到Tcf=82.8K、Tc=83.5K、Tci=92K、△Tc=1K的超导体。     

50,52,53,54Cr光核反应数据评价

通过分析光子诱发52,50Cr核反应的各类实验数据，澄清52Cr光子吸收截面评价数据与中子、质子出射截面测量值间的分歧，给出了52Cr中子出射截面实验数据的修正；选取EGLO模型光子强度函数，结合准氘模型，给出光子吸收截面。在此基础上，采用最新研制的光子与中重核反应计算程序MEND-G，通过优化理论模型参数，包括剩余核的能级密度和对能修正参数，给出光子能量在200 MeV范围内的n、p、${{\rm{\alpha }}}$等粒子出射核反应的截面，52,50Cr的计算结果在30 MeV以下能区很好地符合了现有实验数据，并按国际标准ENDF/B-6库格式给出了50,52,53,54Cr的全套数据文档，便于核工程用户使用。     

RPIC/ICP-MS测定水中的Cr(Ⅲ)和Cr(Ⅵ)

建立了反相离子对色谱-电感耦合等离子体-质谱(RPIC/ICP-MS)联用技术测定水中痕量三价铬Cr(Ⅲ)和六价铬Cr(Ⅵ)的分析方法。通过对流动相的组成、浓度、pH值等色谱条件的实验,确定当流动相组成为0.25mmol.L-1乙二胺四乙酸二钠和2mmol.L-1四丁基氢氧化铵,5%(V/V)甲醇,pH=7.0时,成功分离了Cr(Ⅲ)和Cr(Ⅵ)离子。ICP-MS测定时选用碰撞反应接口技术(CRI)消除40Ar12C+与35Cl16OH+对52Cr+的质谱干扰,Cr(Ⅲ)和Cr(Ⅵ)的检出限分别为0.50、0.34μg.L-1,RSD<10%(n=5)。应用于湖北黄冈、黄石、襄阳等地企业废水中Cr(Ⅲ)和Cr(Ⅵ)含量的测定,加标回收率为86.1%—100.1%。与分光光度法比对,实验证明本方法能克服用分光光度法测定水中六价铬由样品本身带来的干扰。     

离子膜富集—XRFA法测定Cr（Ⅲ）和Cr（Ⅵ）

本文利用离子交换膜富集和分离Ｃｒ（Ⅲ）与Ｃｒ（Ⅵ），并用ＸＲＦＡ测定。     

锁模Cr:LiSAF激光器

锁模Ｃｒ：ＬｉＳＡＦ激光器阮双琛，侯洵，王水才，刘国荣，唐建明，丰善（中国科学院西安光学精密机械研究所，瞬态光学技术国家重点实验室，７１０６８）Ｃｒ：ＬｉＳＡＦ晶体是继Ｔｉ：Ｓａｐｐｈｉｒｅ晶体之后的又一种宽带可调谐激光晶体，最近几年在国际上形成了新...     

Cr: LiNbO_3 Planar Waveguide

Ｃｒ：ＬｉＮｂＯ_３ＰｌａｎａｒＷａｖｅｇｕｉｄｅ￥ＺＨＵＳｈｅｎｇｘｉａｎｇ；ＪＩＡＮＧＸｕｙａｎｇ；ＱＩＵＹｕａｎｗｕ（ＰｏｈｌＩｎｓｔｉｔｕｔｅ，ＴｏｎｇｊｉＵｎｉｖｅｒｓｉｔｙ，ｓｈａｎｇｈａｉ２０００９２）ＷＵＹｏｎｇｊｉａｎ；ＸＵＺｈｅｎ?..     

Optical and hydrophilic properties of Cr doped TiO2-SiO2 nanostructure thin film

Cr doped TiO₂-SiO₂ nanostructure thin film on glass substrates was prepared by a sol-gel dip coating process. X-ray diffraction (XRD) and X-ray photoelectron spectroscopy (XPS) were used to characterize the structural and chemical properties of the films. A UV-vis spectrophotometer was used to measure the transmittance spectra of the thin film. The hydrophilicity of the thin film during irradiation and storage in a dark place was measured by a contact angle analyzer. The results indicated that Cr doping has a significant effect on the transmittance and super-hydrophilicity of TiO₂-SiO₂ thin film.     

Electronic properties of anatase TiO2 doped by lanthanides: A DFT+U study

The effects of mono-doping of 4f lanthanides with and without oxygen vacancy defect on the electronic structures of anatase TiO₂ have been studied by first-principles calculations with DFT+U (DFT with Hubbard U correction) to treat the strong correlation of Ti 3d electrons and lanthanides 4f electrons. Our results revealed that dopant Ce is easy to incorporate into the TiO₂ host by substituting Ti due to its lower substitutional energy (∼−2.0 eV), but the band gap of the system almost keeps intact after doping. The Ce 4f states are located at the bottom of conduction band, which mainly originates from Ti 3d states. The magnetic moment of doped Ce disappears due to electron transfer from Ce to the nearest O atoms. For Pr and Gd doping, their substitutional energies are similar and close to zero, indicating that both of them may also incorporate into the TiO₂ host. For Pr doping, some 4f spin-down states are located next to the bottom of the conduction band and narrow the band gap of the doping system. However, for Gd doping, the 4f states are located in deep valence band and there is no intermediate band in the band gap. The magnetic moment of dopant Gd is close to the value of isolated Gd atom (∼7 μB), indicating no overlapping between Gd 4f with other orbitals. For Eu, it is hard to incorporate into the TiO₂ host due to its very higher substitutional energy. The results also indicated that oxygen vacancy defect may enhance the adsorption of the visible light in Ln-doped TiO₂ system.     

Structural and magnetic properties of MoS2 monolayer zigzag nanoribbon doped by Ti,V, Cr,and Mn

In order to find new functions of monolayer MoS₂ in nanoelectronics or spin electronic devices, using spin-polarized density functional theory (DFT) calculations with on-site coulomb interaction (U), we investigated substitutional doping of Mo atoms of monolayer zigzag MoS₂ nanoribbon (ZZ-MoS₂ NR) by transition metals (TM) (where TM = Ti, V, Cr, Mn) at the Mo-edge, S-edge, and the middle of the NRs. The results of this study indicate the NR widened irrespective of the doped TM position and type, and the Mo-edge was found as the easiest substitutional position. For ZZ-MoS₂ NR doped by Mn, Cr or V atoms, the preferred magnetic coupling state is the edge atoms of S at the S-edge, exhibiting the same spin polarization with TM (named the FM1 state), attributing the NR with metallic magnetism. For Ti-doped monolayer ZZ-MoS₂ NR, in addition to the FM1 state, other preferred magnetic coupling state was observed in which the edge atoms of S at the S-edge exhibit the opposite spin polarization with that of Ti (named the FM2 state). Thus, the NR doped by Ti atom possesses metallic (FM1 state) or half-metallic (FM2 state) magnetism. The total magnetic moments of the ZZ-MoS₂ NR doped by TM follows a linear relationship as a function of the TM dopants (Mn, Cr, V, and Ti). Under $>4\text{\%}$ applied strain, the NR doped by Ti atom only presents the characteristics of half-metallic magnetism as the initial one in the FM2 state, and its total magnetic moment always remained 0 μB, i.e., it was not affected by the width of the NR. This study provides a rational route of tuning the magnetic properties of ZZ-MoS₂ NRs for their promising applications in nanoelectronics and spin electronic devices.     

稀土钇、镧掺杂TiO2薄膜的拉曼谱分析

采用溶胶-凝胶法在石英玻璃衬底上用旋涂法制备了未掺杂、掺杂钇和掺杂镧的TiO₂薄膜样品,对样品在700—1100 ℃范围内进行退火处理,并对样品的拉曼光谱进行了分析.分析表明:随着退火温度的升高,未掺杂TiO₂薄膜发生了从锐钛矿相经混相最终向金红石相的转换,掺杂钇和掺杂镧对TiO₂薄膜的晶相转换起阻碍作用,掺杂镧的阻碍作用更强;稀土掺杂能使TiO₂薄膜晶粒细化,并使晶粒内部应力增大从而阻碍晶格振动,掺杂镧比掺杂钇的效果 关键词： 2薄膜')" href="#">TiO₂薄膜 稀土掺杂 拉曼光谱 溶胶-凝胶     

P掺杂锐钛矿相TiO2的第一性原理计算

利用基于密度泛函理论的第一性原理对不同P掺杂形式(P替位Ti, P替位O, 间隙P)的锐钛矿相TiO₂的晶格常数、电荷布居、能带结构、分态密度和吸收光谱进行了计算. 结果表明, P替位Ti时, TiO₂体积减小, P替位O和间隙P的存在使TiO₂的体积膨胀; 替位Ti的P和间隙P均有不同程度的氧化, 而替位O的P带有负电荷. 三种P掺杂形式均导致锐钛矿相TiO₂禁带宽度的增大, 并在TiO₂禁带之内引入了掺杂局域能级. P掺杂导致TiO₂禁带宽度增大的程度依次为: 间隙P>P替位Ti>P替位O. 吸收光谱的计算结果表明, P替位Ti并不能增强TiO₂的可见光吸收能力, 但间隙P的存在大幅提高了TiO₂的可见光光吸收能力, 间隙P有可能是造成实验上P掺杂增强锐钛矿相TiO₂光催化活性的重要原因. 关键词： P掺杂 2')" href="#">锐钛矿相TiO₂ 第一性原理     

Sputter deposition of high transparent TiO2−xNx/TiO2/ZnO layers on glass for development of photocatalytic self-cleaning application

In this study, TiO_2−xN_x/TiO₂ double layers thin film was deposited on ZnO (80 nm thickness)/soda-lime glass substrate by a dc reactive magnetron sputtering. The TiO₂ film was deposited under different total gas pressures of 1 Pa, 2 Pa, and 4 Pa with constant oxygen flow rate of 0.8 sccm. Then, the deposition was continued with various nitrogen flow rates of 0.4, 0.8, and 1.2 sccm in constant total gas pressure of 4 Pa. Post annealing was performed on as-deposited films at various annealing temperatures of 400, 500, and 600 °C in air atmosphere to achieve films crystallinity. The structure and morphology of deposited films were evaluated by X-ray diffraction (XRD), field emission scanning electron microscopy (FE-SEM), and atomic force microscopy (AFM). The chemical composition of top layer doped by nitrogen was evaluated by X-ray photoelectron spectroscopy (XPS). Photocatalytic activity of samples was measured by degradation of Methylene Blue (MB) dye. The optical transmittance of the multilayer film was also measured using ultraviolet-visible light (UV-vis) spectrophotometer. The results showed that by nitrogen doping of a fraction (∼1/5) of TiO₂ film thickness, the optical transmittance of TiO_2−xN_x/TiO₂ film was compared with TiO₂ thin film. Deposited films showed also good photocatalytic and hydrophilicity activity at visible light.     

Effect of iron doping on the hydrophobicity of titanium dioxide film: experiment and simulation

In this study, we carried out experiments and molecular dynamics simulations to identify the effect of Fe doping on the hydrophobicity of a titanium dioxide film. TiO₂ and Fe-doped TiO₂ films were fabricated in situ by atomic layer deposition without annealing. X-ray diffraction (XRD) and X-ray photoelectron spectroscopy (XPS) were used to characterise the crystal structure and elemental composition. Iron doping resulted in the TiO₂ becoming more hydrophobic at a macroscopic level, as estimated by atomic force microscopy observations and static contact angle measurements. Furthermore, the effect of iron doping on the structure and kinetics of water molecules on the exterior of TiO₂ were studied by molecular dynamics simulations. On the basis of the XPS results, the Fe-TiO₂ surface matrix has a Ti:Fe ratio of 36:5. In addition, the density distribution of oxygen and hydrogen atoms indicate that interfacial water molecules enter the Fe-TiO₂ film more easily and hydrogen atoms in the water molecules are oriented upward at the interface. The self-diffusion coefficients indicate that iron doping makes the TiO₂ more hydrophobic, which is consistent with the macroscopic test results.     

Synergistic effects of C-Cr codoping in TiO2 and enhanced sonocatalytic activity under ultrasonic irradiation

C and Cr co-doped TiO₂ (C-Cr-TiO₂) sonocatalyst were synthesized by doping TiO₂ with glucose and CrCl₃ in a sol-gel method. The samples were characterized by X-ray diffraction, transmission electron microscopy, ultraviolet-visible (UV-vis) diffuse reflectance spectroscopy, and X-ray photoelectron emission spectroscopy (XPS). C and Cr were detected by XPS analysis. The influence of dopants on the properties and sonocatalytic activity of TiO₂ was studied. The sonodegradation products of methylene blue were analyzed by UV-vis absorption spectroscopy. The presence of C-Cr-TiO₂ catalysts substantially enhanced the sonocatalytic degradation of MB in aqueous suspensions. The possible sonocatalytic mechanisms were also discussed.     

First-principles study of ferromagnetism in Zn- and Cd-doped SnO2

The electronic structures and magnetic properties of Zn- and Cd-doped SnO₂ are investigated using first-principles calculations within the generalized gradient approximation (GGA) and GGA+U scheme. The substitutional Zn and Cd atoms introduce holes in the 2p orbitals of the O atoms and the introduced holes are mostly confined to the minority-spin states. The magnetic moment induced by doping mainly comes from the 2p orbitals of the O atoms, among which the moment of the first neighboring O atoms around the dopant are the biggest. The U correction for the anion-2p states obviously increases the moment of the first neighboring O atoms and transforms the ground states of the doped SnO₂ from half-metallic to insulating. The magnetic coupling between the moments induced by two dopants is ferromagnetic and the origin of ferromagnetic coupling can be attributed to the p–d hybridization interaction involving holes.     

Photocatalytic Activities of Boron Doped Titanium Dioxide Nanoparticles and its Composite with Polyaniline

Abstract

Titanium dioxide (TiO₂) was doped with a nonmetalic element, boron (B), and the boron doped TiO₂ (B-TiO₂) was combined with polyaniline (Pani) through an in-situ polymerization technique. The photocatalytic activity of the prepared samples was monitored by the degradation of methylene blue under UV light irradiation. X-ray diffraction (XRD) and Fourier transform infrared (FTIR) spectroscopy were used to reveal the effect of boron doping on the crystalline and chemical structure of the photocatalyst, respectively. The morphological and elemental compositional characteristics of the samples were evaluated using field emission scaning electron microscopy (FE-SEM) and energy dispersive x-ray analysis. The optical band gap energy of the prepared samples was obtained by UV-Visible (UV-Vis) spectroscopy. B-TiO₂ exhibited enhanced photocatalytic performance compared to the undoped photocatalyst. Furthermore, compared with TiO₂ and B-TiO₂, Pani/B-TiO₂ displayed superior photocatalytic activity. The composite achieved almost 26% methylene blue degradation within 150?minutes. Although the boron doping enhanced the crystallinity of TiO₂ slightly, it did not affect the morphology. FTIR confirmed the presence of tri-coordinated interstitial boron in the Ti–O–B bonds. The UV-Vis spectra displayed a red shift with the incorporation of the boron atoms. The incorporation of the boron atoms in the TiO₂ crystal structure are suggested to promote the separation of the photoinduced electron-hole pairs, a possible reason for the enhanced photocatalytic activity. B-TiO₂ and its composite with polyaniline could be considered as a promising photocatalyst to remove organic dyes from the wastewater.