Si中离子注入S杂质引起的深能级研究

本文在n型硅中通过离子注入方法用500 keV的能量注入剂量为1×1014cm-2的过量S以引入杂质,并通过深能级瞬态谱方法(DLTS)对离子注入引入的深能级进行研究,得到多个S的深能级峰,计算了各深能级的位置和其俘获截面等参数。同时也发现,采用离子注入工艺在Si中引入了大量缺陷深能级。     

p-ZnO薄膜及其异质结的光电性质

采用射频磁控溅射法,在不同的Ar∶O2条件下,以高掺磷n型Si衬底为磷掺杂源制备了p型ZnO薄膜和p-ZnO/n-Si异质结.对ZnO∶P薄膜进行了光致发光谱(PL)、霍尔参数、Ⅰ-Ⅴ特性、扫描电镜(SEM)和X射线衍射谱(XRD)等测试.结果表明,获得的ZnO∶P薄膜沿(0002)晶面高取向生长,以3.33 eV近带边紫外发光为主,伴有2.69 eV附近的深能级绿色发光峰,空穴浓度为8.982 × 1017/cm3,空穴迁移率为9.595 cm2/V·s,p-ZnO/n-Si异质结I-V整流特性明显,表明ZnO∶P薄膜具有p型导电特性.     

硅离子注入SOI晶片中发光研究

本文报道了通过500 keV从1013cm-2到3×1014cm-2的不同剂量的28Si离子自注入技术,结合不同温区退火,在SOI晶片中引入一系列发光中心(X,W,R,D4,D3,D2和D1中心)研究。采用光致发光测量表征,分别研究了退火温度、注入剂量以及测试温度对样品光学性质的影响。研究发现,W线的最佳退火温度大约为275℃,注入剂量为1013cm-2量级;R线发光强度最大时需要的注入剂量为3×1013cm-2,退火温度为700℃;与体Si晶体不同,离子注入SOI晶片内仅在275℃的低温退火3 min,在1013cm-2小剂量样品的PL谱中也观察到D1和D2带。本研究结果为硅基红外光电器件的探索奠定了基础。     

二次退火制备Ⅲ-Ⅴ族半导体量子点

利用离子注入法在一块Si(001)衬底上注入了In+和As+,注入能量分别为210keV,150keV,注入剂量6.2×1016cm-2,8.6×1016cm-2,另一块Si(001)衬底上注入Ga+和Sb+,注入能量分别为140keV,220keV,注入剂量分别为8.2×1016cm-2,6.2×1016cm-2,然后对样品分别经过一次退火和二次退火处理制备出了Si基量子点材料。用透射电子显微镜(TEM)和高分辨透射电子显微镜(HRTEM)观察了退火后量子点截面像,用PL探测量子点的光致发光谱,发现经二次退火生长的量子点微晶格结构和Si衬底损伤的修复均明显优于一次退火。     

热退火诱导C+注入Si晶体的蓝光发射

在室温和注入能量为60 keV的条件下,在硅晶片中注入C+,使其剂量达到5.0×1016 cm2,随后即对样品进行高温退火处理.采用X射线衍射(XRD),拉曼和光致发光(PL)光谱技术对样品进行了表征.实验结果显示:C+注入后经高温退火的样品的XRD图谱中,在40°附近处出现了衍射峰,表明经退火后样品中形成了纳米尺寸的SiC团簇,并观察到了强烈的蓝光发射.PL光谱中的蓝光峰起源于量子限制效应.     

退火温度对Li:ZnO薄膜紫外发射性能影响

利用溶胶-凝胶法在Si衬底上制备不同退火温度的Li∶ZnO薄膜。借助X射线衍射(XRD)、X射线光电子谱(XPS)、扫描电镜(SEM)和光致发光(PL)谱研究样品结晶质量、成分、表面形貌和发光特性。结果表明:所有样品均高度c轴择优取向生长;随退火温度升高,样品结晶性变好,紫外发射增强。LiOH在退火温度超过700℃分解,使Li、H进入到ZnO晶格,在ZnO薄膜中形成LiZn-H复合缺陷,这种复合缺陷使H被困在ZnO薄膜中,形成H施主,显著提高ZnO薄膜紫外发光强度,抑制ZnO薄膜绿光发射。     

热退火对电子束蒸镀方法制备的ZnO:Al薄膜光电性质的影响

采用电子束蒸镀方法在Si(100)衬底上沉积了ZnO:Al(ZAO)薄膜.在氧气气氛下对ZnO:Al薄膜进行了退火处理,退火温度的范围为400～800℃.X射线衍射(XRD)图样表明所制备的ZnO:Al薄膜具有六方结构,为c轴(002)择优取向的多晶薄膜.用Van der Pauw法测量了ZAO薄膜的电学特性,结果显示其电导率在500℃达到最大值.测量了ZAO薄膜的室温微区光致发光和变温发光光谱,观测到了ZnO自由激子、束缚在中性施主中心(D0)上的束缚激子以及束缚在离化施主中心(D+0)上的束缚激子发射.     

退火工艺对含Ti-Al阻挡层的硅基Pb(Zr_(0.4),Ti_(0.6))O_3铁电电容器结构和性能影响的研究

应用非晶的Ti-Al薄膜为导电阻挡层,采用射频磁控溅射法和溶胶-凝胶法在Si衬底上制备了La_(0.5)Sr_(0.5)CoO_3/Pb(Zr_(0.4),Ti_(0.6))O_3/La_(0.5)Sr_(0.5)CoO_3/Ti-Al/Si (LSCO/PZT/LSCO/Ti-Al/Si)异质结,研究了550 ℃常规退火(CTA)和快速退火(RTA)工艺对LSCO/PZT/LSCO/Ti-Al/Si结构和性能的影响.实验发现非晶Ti-Al薄膜在经过不同退火工艺后仍具有非晶结构,快速退火6 min的样品具有较好的物理性能.在418 kV/cm的外加电场下,LSCO/PZT/LSCO电容器的剩余极化强度和矫顽电场强度分别为22 μC/cm~2和83 kV/cm.LSCO/PZT/LSCO电容器的漏电行为不依赖于退火工艺,当电场强度低于46.7 kV/cm时为欧姆导电,高于46.7 kV/cm时为肖特基导电机制.     

二维BN材料中n型掺杂探索:基于第一性原理的带电缺陷计算

半导体材料的有效掺杂可为半导体器件的成功应用提供保障.理论上,通过计算缺陷形成能和电荷转移能级可以预测掺杂的难易性以及缺陷能级的深浅性.基于密度泛函理论,结合二维带电缺陷计算方法,系统计算二维BN材料中四种(CB,SiB,GeB,SnB)潜在n型掺杂体系的缺陷性质.结果表明,CB(SnB)体系最稳定价态为+1价(-1价)和0价,而SiB,GeB体系最稳定价态为+1价,0价和-1价,CB,SiB与GeB体系相应的施主离子化能为2.00 eV,3.57 eV和4.06 eV,均表现为深能级施主,很难为BN提供n型载流子.另外,CB体系在宿主BN为p型掺杂时+1价态具有负形成能,将会严重降低BN p型掺杂效率及空穴导电率.该研究结果可为实验上对二维BN进行掺杂尝试提供理论依据.     

退火处理对ZnO薄膜发光特性的影响

用脉冲激光沉积法(PLD)在MgO(100)、α-Al2O3(0001)和MgAl2O4(111)衬底上沉积了ZnO薄膜,测量了它们的发射光谱,观察到430nm的蓝光发射,并研究了退火、衬底和激发波长对ZnO薄膜这一蓝光发射的影响.指出ZnO薄膜中430nm的蓝光发射是由锌填隙原子缺陷能级到价带顶能级间的跃迁以及电子从氧空位浅施主能级到价带顶能级间的跃迁两种机理共同作用的结果.在MgO衬底上沉积的ZnO薄膜在350nm光激发下蓝光发射峰最强.     

Crystal structures of the cis and trans isomers of a tetrathia[3.3.3.3]cyclophane

Both the cis and trans isomers of 3,11,18,26-tetrathiatricyclo[26.2.2.1^5,9.2^13,16.1^20,24] hexatriaconta-5,7,9,20,22,24-hexene have been prepared and structurally characterized. Each of these centrosymmetric tetrathia dimers includes two cyclohexane rings in chair conformations with either 1,4-cis or 1,4-trans bonding and two meta-substituted benzene rings. The cis isomer packs into the monoclinic space group P2₁/a with a = 10.485(3)Å, b = 10.3956(18)Å, c = 14.1343(10)Å, = 105.200(13)°, Z = 2 and refined to an R factor of 0.046. The trans isomer crystallizes in the monoclinic space group P2₁/c with a = 10.7217(12)Å, b = 5.6797(7)Å, c = 25.415(5)Å, = 96.001(12)°, Z = 2 and refined to an R factor of 0.043. In the cis structure each benzene ring faces a cyclohexane ring while in the trans structure the cyclohexane rings face one another.     

CsI-LiCl共晶材料的坩埚下降法生长与闪烁性能研究

本文采用坩埚下降法,在真空密封的石英坩埚中成功生长出CsI-LiCl与CsI-LiCl:Na共晶闪烁体。通过扫描电子显微镜(SEM)观察晶体微结构表明该共晶中LiCl相与CsI相存在周期性的层状排列,CsI相的厚度在5 μm左右。共晶样品的X射线激发发射谱显示在CsI-LiCl和CsI-LiCl:Na共晶样品存在缺陷发光,在CsI-LiCl样品中还观察到了纯CsI的自陷激子(STE)发光。CsI-LiCl样品在α粒子激发下的多道能谱中观察到明显的全能峰,这一结果证明CsI-LiCl共晶可用于热中子探测的潜力。     

静电纺丝法制备CeO2微纳米纤维及其除氟性能

以聚丙烯腈(PAN)为载体,六水合硝酸铈[Ce(NO₃)₃·6H₂O]为原料,采用静电纺丝法制备了Ce(NO₃)₃/PAN纤维,在空气中热处理得到CeO₂微纳米纤维,通过XRD、BET和SEM对CeO₂微纳米纤维进行表征。采用静态吸附实验探讨了CeO₂微纳米纤维去除水溶液中氟离子的性能,考察了溶液pH值、初始氟离子浓度及共存阴离子等对吸附性能的影响。结果表明,pH=3时,CeO₂微纳米纤维对F^-的吸附性能最佳,CeO₂吸附量随着F^-浓度的增大呈上升趋势。CeO₂微纳米纤维对F^-的吸附等温线遵循Langmuir模型,二级动力学模型能很好地描述CeO₂微纳米纤维对F^-的吸附过程。CeO₂微纳米纤维的除氟性能优良,可为其实际应用提供理论参考。     

Triethyl ammonium salt of O,O′-bis(p-tolyl)dithiophosphate, [Et3NH]+[(4-MeC6H4O)2PS2]−

Triethyl ammonium Salt of O,O′-bis(p-tolyl)dithiophosphate and O,O′-bis(m-tolyl)dithiophosphate have been obtained by reaction of p- and m-cresol, respectively with P₂S₅ in toluene and have been characterized by elemental analysis, IR, ¹H and ³¹P NMR spectroscopy. The molecular structure of O,O′-bis(p-tolyl)dithiophosphate has been determined. Crystal data: [Et₃NH]⁺[(4-MeC₆H₄O)₂PS₂]⁻: Monoclinic, P2₁/c, a=15.2441(9) ?, b=10.415(2) ?, c=3.9726(9) ?, β=91.709(7)°, V=2217.5(1) ?⁻³, Z=4.Supplementary materials Additional material available from the Cambridge Crystallographic Data Centre (CCDC no. 600927 for [Et₃NH]⁺[(4-MeC₆H₄O)₂PS₂]⁻ comprises the final atomic coordinates for all atoms, thermal parameters, and a complete listing of bond distances and angles. Copies of this information may be obtained free of charge on application to The Director, 12 Union Road, Cambridge CB2 2EZ, UK (fax: +44-1223-336033; email: deposit@ccdc.cam.ac.uk or www:http://www.ccdc.cam.ac.uk).     

电沉积法制备ZnO纳米棒阵列及其发光特性

本文以掺F的SnO2导电玻璃为基板,以硝酸锌水溶液为电解液,采用三电极恒电位体系电沉积制备ZnO纳米棒阵列,系统考察了硝酸锌浓度和沉积电位等工艺参数对ZnO纳米棒阵列的微观形貌及其发光性能的影响规律.结果表明,硝酸锌浓度和沉积电位对纳米棒阵列的形貌有显著影响,控制适宜的工艺条件可以制备出直径分布均匀、结晶性好且纯度高的六方纤锌矿ZnO纳米棒阵列.荧光光谱分析表明,电沉积制备出的ZnO纳米棒阵列在385 nm附近有一个强荧光发射峰,且发光性能稳定、对纳米棒阵列微观形貌的细微变化不敏感,使其在发光二极管和激光器等领域具有广阔的应用前景.     

Phase Properties of Hexanedioldiacrylate/E7 Blends

Abstract

Equilibrium phase diagrams of uncured and UV-cured difunctional hexanedioldiacrylate and the eutectic mixture of low molecular weight liquid crystals E7 are established by polarized optical microscopy and differential scanning calorimetry. Data are analyzed using the Maier-Saupe model of nematic order. In the case of the uncured system the Flory-Huggins free energy of isotropic mixing is applied while for the cured system, the Flory-Rehner elastic free energy model is used. A good correlation between experimental and theoretical phase diagrams is found in both systems.     

Crystal structure of Zn4Na(OH)6SO4Cl·6H2O

The structure of Zn₄Na(OH)₆SO₄Cl·6H₂O, a secondary mineral from Hettstedt, Germany, was determined by single-crystal X-ray diffraction. The crystals are hexagonal,a=8.413(8),c=13.095(24) Å, space group $P\bar 3$ , Z=2. The structure was refined to R=0.0554 and R_w=0.0903 for 970 reflections with I≥3σ(I). The structure can be described as zinc hydroxide layers perpendicular toc, from which sulfates and chlorides extend. The layers are held together by a system of hydrogen bonds involving hexaaquo Na⁺ ions which occupy the interlayer space.     

C–H...O,C–H...π and π–π stacking interactions in 3-(2,4-dimethylphenyloxymethyl)-3,4-dihydroisocoumarin

3-(2,4-Dimethylphenyloxymethyl)-3,4-dihydroisocoumarin (C₁₈H₁₈O₃) was prepared by the alkylation of o-lithio N-methyl benzamide with 2-(2,4-dimethylphenoxy)methyl oxirane, followed by alkaline hydrolysis. The compound crystallizes in the orthorhombic space group Pbca with unit cell parameters : a = 8.239(2) Å, b = 14.918(5) Å, c = 24.831(9) Å, Z = 8. The crystal structure was solved by direct methods and refined to R = 0.0514 for 1564 observed reflections. The heterocyclic ring adopts a distorted half-chair conformation. Molecules are connected by π–π interactions between phenyl rings of the isocoumarin nucleus forming dimers. Dimers are connected via C–H...O hydrogen bonds forming chains. Further intermolecular C–H...π hydrogen bonds link the dimer chains to form supramolecular structure.     

A new method for the investigation of orientation relationships in meteoritic plessite

The orientation relationship (OR) between the bcc and fcc phase in the plessite microstructure of the iron meteorites Watson, Agpalilik and Gibeon has been analysed in a scanning electron microscope using electron back‐scattered diffraction (EBSD). A very strong OR exists, independently on the analysed plessite type and the observed spreading of single orientation data. The agreement between the experimental orientation distribution and existing models varies for each meteorite. The black plessite in the Agpalilik corresponds to the Nishiyama‐Wassermann model whereas the duplex plessite of the Gibeon meteorite shows an OR close to the Kurdjumov‐Sachs model. The Watson meteorite is strongly deformed so that a general OR is difficult to determine due to the blurred experimental orientation distribution. (© 2004 WILEY‐VCH Verlag GmbH & Co. KGaA, Weinheim)     

Synthesis and Crystal Structure of 5-[2-(6-bromonaphthalenyloxymethyl)]-3-(4-morpholinomethyl)-1,3,4-oxadiazole-2(3<Emphasis Type="Italic">H</Emphasis>)-thione

Abstract  The title compound, C₁₈H₁₈BrN₃O₃S, a derivative of 1,3,4-oxadiazole, crystallizes in the triclinic space group P-1 with unit cell parameters a = 6.8731(3), b = 8.9994(4), c = 15.7099(6) ?, α = 92.779(3)°, β = 130.575(3)°, γ = 107.868(4)°, Z = 2. The dihedral angle between the mean planes of the planar naphthyl and morpholine (chair) rings with the planar oxadiazol ring is 50.1(8) and 76.8(6)°, respectively. The planar naphthyl ring is twisted 52.2(5)° with the mean plane of the morpholine ring. A group of four intermolecular close contacts are observed between a bromine atom and hydrogen atoms from the closely packed naphthyl, morpholine and oxy–methyl groups in the unit cell. These molecular interactions in concert with an additional series of π–π stacking interactions that occur between the center of gravity of the two 6-membered rings of the naphthalene group influence the twist angles of each of these three groups. A MOPAC AM1 calculation of the conformation energy of the crystal structure [226.0128(9) kcal] compared to that of the minimum energy structure after geometry optimization [29.9744(1) kcal] reveals a significantly reduced value. The twist angles of the three groups above also change after the AM1 calculation giving support to the influence of both intermolecular C–H···Br short-range interactions and Cg π–π stacking interactions on these angles which therefore play a role in stabilizing crystal packing. Graphical Abstract  Crystal structure of 5-{[(6-bromonaphthalen-2-yl)oxy]methyl}-3-(morpholin-4-ylmethyl)-1,3,4-oxadiazole-2(3H)-thione, C₁₈H₁₈BrN₃O₃S, is reported and its geometric and packing parameters described and compared to a MOPAC computational calculation. Electronic supplementary material  The online version of this article (doi:) contains supplementary material, which is available to authorized users.