单晶ZnO纳米线的合成和生长机理研究

用化学气相输运(CVT)方法合成了直径在20～120nm呈单晶结构的ZnO纳米线.利用场发射扫描电 镜(FESEM)、高分辨透射电镜(HRTEM)以及选区电子衍射(SAED)等技术对ZnO纳米线的生长机理和结构进行 了系统研究,结果表明,纳米线的成核与Au Zn合金催化颗粒的饱和度有直接的关系,先饱和的颗粒上纳米线首 先成核.纳米线顶端合金颗粒组成的变化是导致纳米线生长终止的重要原因,大量纳米线的生长不是同时进行 的.本工作提供了支持纳米线气液固(V L S)生长机理的新实验证据,提出了氧化物纳米线的生长机理.     

激光溅射沉积制备的ZnO:Ga薄膜表面形貌分析

薄膜表面形貌定量研究有助于薄膜生长机理的认识.研究的薄膜是用激光脉冲沉积法(PLD)制备的ZnO:Ga(GZO)透明导电薄膜.由于GZO薄膜的生长是在远离平衡态情况下实现的,具备自仿射分形特征,可以用高度-高度相关函数进行描述.通过对用原子力显微镜(AFM)获得的表面高度数据进行相关运算,定量地分析了PLD制备的GZO...     

ZnO薄膜的性质对水热生长ZnO纳米线阵列的影响

用水热法在ZnO薄膜上制备了直径、密度及取向可控的ZnO纳米线阵列。ZnO薄膜是通过原子层沉积(ALD)方法制备并在不同温度下退火处理得到的,退火温度对ZnO薄膜的晶粒尺寸、结晶质量和缺陷性质有很大的影响。而ZnO薄膜的性质对随后生长的ZnO纳米线的直径、密度及取向能起到调节控制的作用。通过扫描电子显微镜(SEM)、X射线衍射(XRD)仪和光致发光(PL)测试对ZnO薄膜和ZnO纳米线进行了表征。最后得到的垂直取向的ZnO纳米线阵列适合在发光二极管和太阳能电池等领域使用。     

表面钝化对ZnO纳米线压电性的影响

本文利用第一性原理方法,研究了四种表面钝化对六角形[001]方向ZnO纳米线压电性质的影响. 研究发现,在50%H/50%Cl和50%H/50%F两种钝化中,体积效应和表面效应都起到了增强压电性的作用. 而在100%H和100%Cl的两种钝化中,表面效应被弱极化的表面电荷屏蔽,不能起到增强压电性的作用. 此外,结果还揭示了体积效应和表面效应的竞争使得实验上不能观察到ZnO纳米线压电性的直径依赖现象,并提出了利用表面钝化缩小纳米线轴向晶格常数或增大表面极化来提高压电性的方法.     

Pd颗粒表面修饰ZnO纳米线阵列的制备及其气敏特性

采用化学气相沉积(CVD)方法在SiO_2/Si衬底生长了ZnO纳米线阵列,纳米线长约为15μm,直径为100~500 nm。通过改变溅射沉积时间(0~150 s),在ZnO纳米线表面包覆了不同厚度的Pd薄膜。在Ar气氛中,经800℃高温退火后,制备出Pd颗粒表面修饰的ZnO纳米线阵列并对其进行了气敏测试。对于乙醇而言,所有传感器最佳工作温度均为280℃。溅射时间的增加(3~10 s)导致ZnO纳米线表面Pd纳米颗粒数量及尺寸增加,传感器响应值由2.0增至3.6。过长的溅射时间(30~150 s)将导致Pd颗粒尺寸急剧增大甚至形成连续膜,传感器响应度显著降低。所有传感器对H2均表现出相对较好的选择性,传感器具有较好的响应-恢复特性和稳定性。最后,探讨了Pd颗粒表面修饰对ZnO纳米线阵列气敏传感器气敏特性的影响机制。     

ZnO纳米线的合成与生长机理

采用化学气相沉积系统制备ZnO纳米线,以覆盖一层约5nm厚的Ag薄膜的单晶Si(001)为衬底,纳米线的生长遵循气-液-固(VLS)机理。对得到的样品采用X射线衍射(XRD)和扫描电镜(SEM)进行晶体结构和形貌的表征。XRD结果表明衬底温度在600~700℃时生长的ZnO纳米线具有六方结构和统一的取向。通过扫描电子显微镜分析,比较了生长温度对纳米线直径和长度的影响。实验表明我们可以通过催化剂和温度来实现ZnO纳米线生长的可控。与传统的VLS生长方式不同的是在我们制备的ZnO纳米线顶端并没有看到催化剂颗粒,表明纳米线的生长方式是底部生长,我们对其生长机理进行了研究。     

单晶ZnO、TiO_2纳米线拉伸力学特性的分子动力学研究

采用分子动力学方法,模拟了不同加载速度、不同温度下单晶ZnO、TiO_2纳米线的拉伸破坏过程.通过模拟结果,对比、分析了两种单晶金属氧化物纳米线拉伸力学特性的差异.研究表明,1)ZnO纳米线的断裂机制为:表面微裂纹-微孔-微裂纹与微孔贯穿-断裂,而TiO_2纳米线的断裂机制为:局部屈服-颈缩-断裂;2)TiO_2纳米线的承载能力优于ZnO纳米线,而承受变形的能力劣于ZnO纳米线;3)温度较低的情况下,纳米线的抗拉性能较好;加载速度越高,纳米线的抗载性能越好,而抗变形能力越差.     

Cr掺杂ZnO纳米线的电子结构和磁性

采用自旋极化密度泛函理论系统研究了Cr掺杂ZnO纳米线的电学、磁学以及光学属性.计算结果显示,Cr原子沿[0001]方向替代ZnO纳米线中的Zn原子时体系一般呈现铁磁耦合,沿[1010]和[0110]方向替代Zn原子时体系呈现反铁磁耦合,且磁性耦合状态在费米能级附近出现了明显的自旋劈裂现象,发生了强烈的Cr 3d和O 2p杂化效应.自旋态密度计算结果显示,磁矩主要来源于Cr原子未成对3d态电子的贡献,磁矩的大小与Cr原子的电子排布有关.光学性质计算结果显示,Cr掺杂ZnO纳米线在远紫外和近紫外都具有明显的吸收峰,吸收峰发生了明显的红移.这些结果都表明Cr掺杂ZnO纳米线也许是一种很有前途的稀磁半导体材料. 关键词： ZnO 纳米线 第一性原理 磁性     

自支撑Ag掺杂ZnO花状纳米线阵列及其光学性质

利用简单、温和的二步水浴法制备一种大面积自支撑、可自由迁移的Ag掺杂ZnO花状纳米线阵列。通过场发射扫描电子显微镜（FESEM）、元素能谱（EDS）、X射线衍射谱（XRD）、室温和变温光致发光谱（PL）等一系列表征手段对所制备的自支撑Ag掺杂ZnO纳米线阵列进行了研究。研究结果显示：这种自支撑纳米材料具有良好的晶体质量和光学性质,在低温（85 K）下显示出A⁰X和FA为主导的受主相关发射峰,通过理论公式计算受主结合能为118 meV。在变温光致发光光谱中,FA发射峰位随温度的变化符合理论模型。     

自支撑Ag掺杂ZnO花状纳米线阵列及其光学性质

利用简单、温和的二步水浴法制备一种大面积自支撑、可自由迁移的Ag掺杂ZnO花状纳米线阵列。通过场发射扫描电子显微镜(FESEM)、元素能谱(EDS)、X射线衍射谱(XRD)、室温和变温光致发光谱(PL)等一系列表征手段对所制备的自支撑Ag掺杂ZnO纳米线阵列进行了研究。研究结果显示:这种自支撑纳米材料具有良好的晶体质量和光学性质,在低温(85 K)下显示出A0X和FA为主导的受主相关发射峰,通过理论公式计算受主结合能为118 meV。在变温光致发光光谱中,FA发射峰位随温度的变化符合理论模型。     

Effect of Sb-doping on the morphology and dielectric properties of chrysanthemum-like ZnO nanowire clusters

Chrysanthemum-like ZnO nanowire clusters with different Sb-doping concentrations were prepared using a hydrothermal process. The microstructures, morphologies, and dielectric properties of the as-prepared products were characterized by X-ray diffraction (XRD), high-resolution transmission electron microscopy (HRTEM), field emission environment scanning electron microscope (FEESEM), and microwave vector network analyzer respectively. The results indicate that the as-prepared products are Sb-doped ZnO single crystallines with a hexagonal wurtzite structure, the flower bud saturation degree F d is obviously different from that of the pure ZnO nanowire clusters, the good dielectric loss property is found in Sb-doped ZnO products with low density, and the dielectric loss tangent tanδ e increases with the increase of the Sb-doping concentration in a certain concentration range.     

Effect of Sb-doping on the morphology and the dielectric properties of chrysanthemum-like ZnO nanowire clusters

Chrysanthemum-like ZnO nanowire clusters with different Sb-doping concentrations were prepared by using the hydrothermal process. The microstructures, morphologies, and dielectric properties of the as-prepared products were characterized by X-ray diffraction (XRD), high-resolution transmission electron microscopy (HRTEM), field emission environment scanning electron microscope (FEESEM), and microwave vector network analyzer respectively. The results indicate that the as-prepared products are Sb-doped ZnO single crystallines with hexagonal wurtzite structure, the flower bud saturation degree F_d is obviously different from that of the pure ZnO nanowire clusters, the good dielectric loss property is found in Sb-doped ZnO products with low density, and the dielectric loss tangent tanδ _e increases with the increase of the Sb-doping concentration in a certain concentration range.     

Optoelectronic characterisation of an individual ZnO nanowire in contact with a micro-grid template

Optoelectronic characterisation of an individual ZnO nanowire in contact with a micro-grid template has been studied.The low-cost micro-grid template made by photolithography is used to fabricate the ohmic contact metal electrodes.The current increases linearly with the bias,indicating good ohmic contacts between the nanowire and the electrodes.The resistivity of the ZnO nanowire is calculated to be 3.8 ·cm.We investigate the photoresponses of an individual ZnO nanowire under different light illumination using light emitting diodes(λ = 505 nm,460 nm,375 nm) as excitation sources in atmosphere.When individual ZnO nanowire is exposured to different light irradiation,we find that it is extremely sensitive to UV illumination;the conductance is much larger upon UV illumination than that in the dark at room temperature.This phenomenon may be related to the surface oxygen molecule adsorbtion,which indicates their potential application to the optoelectronic switching device.     

Physical model for the exotic ultraviolet photo-conductivity of ZnO nanowire films

Employing a simple and efficient method of electro-chemical anodization,ZnO nanowire films are fabricated on Zn foil,and an ultraviolet(UV)sensor prototype is formed for investigating the electronic transport through back-to-back double junctions.The UV(365 nm)responses of surface-contacted ZnO film are provided by I–V measurement,along with the current evolution process by on/off of UV illumination.In this paper,the back-to-back metal–seconductor–metal(M–S–M)model is used to explain the electronic transport of a ZnO nanowire film based structure.A thermionic-field electron emission mechanism is employed to fit and explain the as-observed UV sensitive electronic transport properties of ZnO film with surface-modulation by oxygen and water molecular coverage.     

Effect of Mn-doping on the growth mechanism and electromagnetic properties of chrysanthemum-like ZnO nanowire clusters

Chrysanthemum-like ZnO nanowire clusters with different Mn-doping concentrations are prepared by a hydrothermal process. The microstructure, morphology and electromagnetic properties are characterized by x-ray diffractometer high-resolution transmission electron microscopy (HRTEM), a field emission environment scanning electron microscope (FEESEM) and a microwave vector network analyser respectively. The experimental results indicate that the as-prepared products are Mn-doped ZnO single crystalline with a hexagonal wurtzite structure, that the growth habit changes due to Mn-doping and that a good magnetic loss property is found in the Mn-doped ZnO products, and the average magnetic loss tangent tanδ_m is up to 0.170099 for 3% Mn-doping, while the dielectric loss tangent tanδ_e is weakened, owing to the fact that ions Mn^{2 +} enter the crystal lattice of ZnO.     

分子团簇表面吸附敏化ZnO纳米线的第一性原理研究

ZnO纳米线作为新型太阳能电池结构的重要组成部件之一, 其导电能力直接影响到太阳能电池的性能. 采用密度泛函理论平面波超软赝势方法, 计算并分析了C₂H₆O(乙醇)、 C₆H₅FS(4-氟苯硫酚)、 C₇HF₇S(4-(三氟甲基L)-2, 3, 5, 6-四氟硫代苯酚) 等小分子吸附的六边形结构\langle0001angle ZNWs (ZnO 纳米线) 的几何结构、 吸附能和电子结构. 首先, 通过几何优化得到了不同基团吸附的ZNWs的稳定结构, 同时吸附能计算结果表明C₇HF₇S吸附的体系结构最为稳定, 且吸附呈现放热反应; 其次, 为研究表面敏化对导电性能的影响, 计算了不同小分子基团吸附下的能带结构和态密度, 并利用能带理论分析了表面吸附敏化对禁带宽度的调控机理, 结果分析表明小分子表面吸附敏化对ZNWs的电学性能有一定的影响, 其中C₇H₇FS和C₆H₅FS分子均发生了不同程度的电荷转移.     

Water contact angles on charged surfaces in aerosols

Interactions between water and solid substrates are of fundamental importance to various processes in nature and industry. Electric control is widely used to modify interfacial water, where the influence of surface charges is inevitable. Here we obtain positively and negatively charged surfaces using LiTaO₃ crystals and observe that a large net surface charge up to 0.1 C/m² can nominally change the contact angles of pure water droplets comparing to the same uncharged surface. However, even a small amount of surface charge can efficiently increase the water contact angle in the presence of aerosols. Our results indicate that such surface charges can hardly affect the structure of interfacial water molecular layers and the morphology of the macroscopic droplet, while adsorption of a small amount of organic contaminants from aerosols with the help of Coulomb attraction can notably decrease the wettability of solid surface. Our results not only provide a fundamental understanding of the interactions between charged surfaces and water, but also help to develop new techniques on electric control of wettability and microfluidics in real aerosol environments.     

海胆状ZnO纳米线阵列的制备及其光学性能

采用一种低成本的有效方法制备出了有序排列的海胆状ZnO纳米线阵列。首先利用自组装的方法得到了单层的聚苯乙烯(PS)小球,以其为模板用水热法在小球表面生长ZnO纳米线,得到了由PS小球和ZnO纳米线构成的海胆状结构。纳米线的直径均一,长度可通过水热反应时间进行控制。利用这种方法制备的一维ZnO纳米结构在传感器、太阳能电池及光催化领域有潜在的应用价值。     

Characterization of ZnO nanowire field-effect transistors and exposed to ultraviolet radiation

A ZnO nanowire (NW) field-effect transistor (FET) is fabricated and characterized, and its characterization of ultraviolet radiation is also investigated. On the one hand, when the radiation time is 5~min, the radiation intensity increases to 5.1~μ W/cm², while the saturation drain current (I_\rm dss) of the nanowire FET decreases sharply from 560 to 320~nA. The field effect mobility (μ ) of the ZnO nanowire FET drops from 50.17 to 23.82~cm²/(V.s) at V_\rm DS=2.5~V, and the channel resistivity of the FET increases by a factor of 2. On the other hand, when the radiation intensity is 2.5~μ W/cm^2 , the DC performance of the FET does not change significantly with irradiation time (its performances at irradiation times of 5 and 20~min are almost the same); in particular, the I_\rm dss of NW FET only reduces by about 50~nA. Research is underway to reveal the intrinsic properties of suspended ZnO nanowires and to explore their device applications.     

Lasing behaviour from the condensation of polaronic excitons in a ZnO nanowire

Atoms under optical and magnetic trapping in a limited space at a very low temperature can lead to Bose-Einstein condensation (BEC),even in a one-dimensional (1D) optical lattice. However,can the confinment of dense excitons in a 1D semiconductor microstructure easily reach the excitonic BEC A lightly Mn(Ⅱ)-doped ZnO nanowire under a femtosecond laser pulse pump at room temperature produces single-mode lasing from coherent bipolaronic excitons,which is much like a macroscopic quantum state due to the condensation of the bipoaronic excitons if not real BEC. In this process,longitudinal biphonon binding with the exciton plays an important role. We revisit this system and propose possibility of bipolaronic exciton condensation. More studies are needed for this condensation phenomenon in 1D microcavity systems.