基于化学气相沉积方法的石墨烯-光子晶体光纤的制备研究

本文利用常压化学气相沉积方法,在光子晶体光纤内孔壁上直接生长石墨烯薄膜,实现了石墨烯-光纤复合材料的直接制备.研究发现光纤中石墨烯层数和缺陷主要受生长温度、生长时间以及甲烷流量等参数影响.拉曼光谱和扫描电子显微镜等表征结果表明:石墨烯在光子晶体光纤孔内的生长均匀性良好,适当的高温、较长的生长时间以及合适的甲烷流量有利于生长高质量的石墨烯.石墨烯-光子晶体光纤复合材料的制备,对基于光纤平台的石墨烯光电器件的研究、开发和应用有着重要的推动作用,也为石墨烯全光纤集成应用提供了新的思路.     

石英衬底上生长的高光学质量的纳米金刚石薄膜

采用射频等离子体增强的热丝化学气相沉积(RFHFCVD)技术在石英玻璃衬底上制备了表面光滑、晶粒致密均匀的纳米金刚石薄膜.用扫描电子显微镜(SEM)和台阶仪观测薄膜的表面形貌和粗糙度,x射线衍射(XRD)和Raman光谱表征膜层的结构,并用紫外可见近红外光谱仪测量其光透过率.实验结果表明,衬底温度、反应气压及射频功率对金刚石膜的结晶习性、表面粗糙度及光透过率均有很大程度的影响,其最佳值分别为700℃,2×133Pa和200W.在该最佳参量下经1h的生长即获得连续、平滑的纳米金刚石膜,其平均晶粒尺寸为约25 关键词： 纳米金刚石薄膜 射频等离子体增强热丝化学气相沉积 光透过率     

氮化镓/蓝宝石异质结构中极性的研究

用低压金属有机气相外延方法设备在蓝宝石衬底两个相反取向的C面上同时生长六方相氮化镓薄膜,对此进行了扫描电子显微镜、透射电子显微镜的分析和研究.发现当衬底表面是向籽晶面时,生长的六方相氮化镓薄膜为(0001)取向,而当衬底表面是背籽晶面时,生长的氮化镓薄膜则为(0001)取向.     

沉积时间对球状微米金刚石聚晶结构的生长及其场发射特性影响

利用微波等离子体化学气相沉积法,在覆盖金属钛层的陶瓷衬底上,通过改变沉积时间制备出不同结构的类球状微米金刚石聚晶碳膜.通过扫描电子显微镜、喇曼光谱、X射线衍射谱对碳膜进行了分析测试,并研究了不同沉积时间下沉积的类球状微米金刚石聚晶薄膜的场致电子发射特性,结果显示:不同的沉积时间所制备的碳膜形貌有很大变化,场致电子发射的...     

石墨烯/硅肖特基太阳能电池的光电特性

以甲烷作为反应气体,利用化学气相沉积法在硅衬底表面上沉积石墨烯薄膜,制备了石墨烯/硅肖特基太阳能电池.利用原子力显微镜和拉曼光谱观察了石墨烯薄膜的表面形貌,并用紫外-可见光光谱仪和光-电流测试仪器研究了石墨烯样品和太阳电池的光电特性.实验结果表明:制备的石墨烯薄膜厚度为几个原子层,薄膜表面均匀,并具有良好的电学特性,石墨烯/硅太阳能电池的能量转换效率可达3.7%.     

立方氮化硼薄膜的生长特性与粘附性研究

用X射线衍射技术、红外吸收光谱、扫描电子显微镜、X射线光电子能谱对热丝辅助射频等离子体化学汽相沉积法制备的立方氮化硼(c-BN)薄膜的生长特性和粘附性进行了研究.改变生长条件，在Si、不锈钢和Ni衬底上沉积c-BN薄膜，进而研究了c-BN薄膜的质量和生长条件与衬底之间的关系.实验发现，Ni衬底上生长的薄膜c-BN含量较高，且粘附性好.当Si衬底上溅射一层Ni过渡层，再生长c-BN薄膜，薄膜中c-BN含量提高，与Si衬底的粘附性也显著增强. 关键词：     

微波等离子体化学气相沉积方法在Si衬底上生长SiC纳米线

应用微波等离子体化学气相沉积方法,在单晶Si(100)衬底上生长出SiC纳米线.应用扫描电子显微镜、透射电子显微镜、能量损失谱(EDS)和选区电子衍射(SAD)等方法对纳米线化学组成和结构进行了分析和表征.给出该纳米线的生长机理 关键词： 微波等离子体化学气相沉积 SiC纳米线 生长机理     

高质量大面积石墨烯的化学气相沉积制备方法研究

石墨烯因其奇特的能带结构和优异的物理性能而成为近年来大家研究的热点, 但是目前单层石墨烯的质量与尺寸制约了其实际应用的发展. 本文采用常压化学气相沉积(CVD)方法, 基于铜箔衬底, 利用甲烷作为碳源制备了高质量大面积的单层与多层石墨烯. 研究发现: 高温度、稀薄的甲烷浓度、较短的生长时间以及合适的气体流速是制备高质量、大面积石墨烯的关键. Raman光谱, 扫描电子显微镜、透射电子显微镜等表征结果表明: 制备的石墨烯主要为单层, 仅铜箔晶界处有少量多层石墨烯. 电学测试表明CVD制备的石墨烯在低温时呈现出较明显的类半导体特性; 薄膜电阻随外界磁场的增大而减小.     

低温制备微晶硅薄膜生长机制的研究

采用热丝化学气相沉积技术制备了一系列处于不同生长阶段的薄膜样品，用原子力显微镜系 统地研究生长在单晶硅衬底和玻璃衬底上薄膜表面形貌的演化.按照分形理论分析得到：在 玻璃衬底上的硅薄膜以零扩散随机生长模式生长；而在单晶硅衬底上，薄膜早期以有限扩散 生长模式生长，当膜厚超过某一临界厚度时转变为零扩散随机生长模式.岛面密度与膜厚的 依赖关系表明，在临界厚度时硅衬底和玻璃衬底上的岛面密度均出现了极大值.Raman谱的测 量证实，玻璃衬底上薄膜临界厚度与非晶/微晶相变之间存在密切的关系.不同的衬底材料直 接影响反应 关键词： 生长机制 微晶硅薄膜 表面形貌 热丝化学气相沉积     

铜箔上生长的六角氮化硼薄膜的扫描隧道显微镜研究

利用扫描隧道显微镜研究了采用化学气相沉积法在铜箔表面生长出的高质量的六角氮化硼薄膜. 大范围的扫描隧道显微镜图像显示出该薄膜具有原子级平整的表面, 而扫描隧道谱则显示, 扫描隧道显微镜图像反映出的是该薄膜样品的隧穿势垒空间分布. 极低偏压的扫描隧道显微镜图像呈现了氮化硼薄膜表面的六角蜂窝周期性原子排列, 而高偏压的扫描隧道显微镜图像则呈现出无序和有序排列区域共存的电子调制图案. 该调制图案并非源于氮化硼薄膜和铜箔衬底的面内晶格失配, 而极有可能来源于两者界面处的氢、硼和/或氮原子在铜箔表面的吸附所导致的隧穿势垒的局域空间分布.     

Quantum superreplication of states and gates

Although the no-cloning theorem forbids perfect replication of quantum information, it is sometimes possible to produce large numbers of replicas with vanishingly small error. This phenomenon, known as quantum superreplication, can occur for both quantum states and quantum gates. The aim of this paper is to review the central features of quantum superreplication and provide a unified view of existing results. The paper also includes new results. In particular, we show that when quantum superreplication can be achieved, it can be achieved through estimation up to an error of size O(M/N²), where N and M are the number of input and output copies, respectively. Quantum strategies still offer an advantage for superreplication in that they allow for exponentially faster reduction of the error. Using the relation with estimation, we provide i) an alternative proof of the optimality of Heisenberg scaling in quantum metrology, ii) a strategy for estimating arbitrary unitary gates with a mean square error scaling as log N/N², and iii) a protocol that generates O(N²) nearly perfect copies of a generic pure state U|0>while using the corresponding gate U only N times. Finally, we point out that superreplication can be achieved using interactions among k systems, provided that k is large compared to M²/N².     

Graphene traps for cesium atoms

A significant increase in the surface concentration of cesium atoms intercalated under graphene islands on rhodium has been revealed when annealing the adsorbed layer in a ultrahigh vacuum. Heating leads to a decrease in the area of graphene islands due to the solution of carbon atoms in the metal bulk. At the same time, the edge carbon atoms in the islands, which are coupled with the surface by chemisorptive forces, prevent the leakage of the alkali metal from under the islands. This leads to the significant compression of cesium and to an increase in its surface concentration under the islands by a factor of almost 10. The desorption of cesium is observed only after the complete thermal destruction of graphene islands.     

Y掺杂空位石墨烯对NO及CO气体表面吸附的第一性原理研究

摘　要：基于第一性原理的计算方法,建立了本征石墨烯、空位石墨烯及钇( Y)掺杂空位石墨烯模型,并计算了CO、NO在三类石墨烯表面的吸附过程. 从表面能、吸附结构、吸附能和态密度四个方面进行分析讨论,研究掺杂Y对CO、NO气体吸附性能的影响. 结果表明：CO、NO与本征石墨烯之间的吸附为弱的物理吸附,掺杂Y后增强了材料表面对CO、NO的吸附效果,最大吸附能分别为7.414eV、6.702eV,属于化学吸附;掺杂Y使空位石墨烯费米能级附近有了更多的活跃电子,其吸附NO后体系由半金属转变为金属特性,该特性能为开发更加优良的石墨烯气敏材料提供理论支持.     

Density functional theory study on the adsorption of alkali metal ions with pristine and defected graphene sheet

The graphene-based materials along with the adsorption of alkali metal ions are suitable for energy conversion and storage applications. Hence in the present work, we have investigated the structural and electronic properties of pristine and defected graphene sheet upon the adsorption of alkali metal ions (Li⁺, Na⁺, and K⁺) using density functional theory (DFT) calculations. The presence of vacancies or vacancy defects enhances the adsorption of alkali ions than the pristine sheet. From the obtained results, it is found that the adsorption energy of Li⁺ on the vacancies defected graphene sheet is higher (3.05?eV) than the pristine (2.41?eV) and Stone–Wales (2.50?eV) defected sheets. Moreover, the pore radius of the pristine and defected graphene sheets are less affected by metal ions adsorption. The increase in energy gap upon the adsorption of metal ions is found to be high in the vacancy defected graphene than that of other sheets. The metal ions adsorption in the defective vacancy sheets has high charge transfer from metal ions to the graphene sheet. The bonding characteristic between the metal ions and graphene sheet are analysed using QTAIM analysis. The influence of alkali ions on the electronic properties of the graphene sheet is examined from the Total Density of States (TDOS) and Partial Density of States (PDOS).     

Intercalation of germanium oxide beneath large-area and high-quality epitaxial graphene on Ir(111) substrate

Epitaxial growth on transition metal surfaces is an effective way to prepare large-area and high-quality graphene.However,the strong interaction between graphene and metal substrates suppresses the intrinsic excellent properties of graphene and the conductive metal substrates also hinder its applications in electronics.Here we demonstrate the decoupling of graphene from metal substrates by germanium oxide intercalation.Germanium is firstly intercalated into the interface between graphene and Ir(111) substrate.Then oxygen is subsequently intercalated,leading to the formation of a GeO_x layer,which is confirmed by x-ray photoelectron spectroscopy.Low-energy electron diffraction and scanning tunneling microscopy studies show intact carbon lattice of graphene after the GeO_x intercalation.Raman characterizations reveal that the intercalated layer effectively decouples graphene from the Ir substrate.The transport measurements demonstrate that the GeO_x layer can act as a tunneling barrier in the fabricated large-area high-quality vertical graphene/GeO_x/Ir heterostructure.     

Heterogeneous catalytic reaction on a 2×2 lattice

We study a model proposed by Fichthorn, Gulari and Ziff for the kinetics of a generic heterogeneous catalytic reaction, A+B→AB. This reaction includes the steps of adsorption and desorption of reactants A and B, surface reaction through the Langmuir–Hinshelwood mechanism, and desorption of product AB. We solve the model exactly and without any restriction on a 2×2 lattice.

Despite the reduced number of sites employed, the solution shows some of the general features observed by simulating the mechanism on a large N×N lattice.

The rate of reaction depends on the rate of desorption of reactants with a maximum at a value similar to those found by performing heavy simulations. Also, on a 2×2 lattice, we have coverage of fluctuations of reactants as a function of their rate of desorption, as found on large N×N lattices.     

单空位缺陷诱导的扶手椅型石墨烯纳米带电学性能的转变

本文基于密度泛函理论的第一性原理计算了单空位缺陷对 扶手椅型石墨烯纳米带电学特性的影响. 计算结果表明: 当单空位位于纳米带边缘位置时, 系统结构最稳定. 不同位置上单空位缺陷的引入都会使得原本为半导体的本征 扶手椅型石墨烯纳米带变成金属性; 随着单空位浓度的减小, 其对纳米带能带结构的影响逐渐减弱; 随着纳米带宽度的增大, 表征其金属性的特征值表现出震荡性的减弱. 单空位缺陷诱导的扶手椅型纳米带的半导体特性到金属特性的转变为石墨烯在 电子器件中的应用提供了理论指导. 关键词： 扶手椅型石墨烯纳米带 单空位缺陷 电学性能     

Effects of random subject rotation on optimised diffusion gradient sampling schemes in diffusion tensor MRI

The choice of the number (N) and orientation of diffusion sampling gradients required to measure accurately the water diffusion tensor remains contentious. Monte Carlo studies have suggested that between 20 and 30 uniformly distributed sampling orientations are required to provide robust estimates of water diffusions parameters. These simulations have not, however, taken into account what effect random subject motion, specifically rotation, might have on optimised gradient schemes, a problem which is especially relevant to clinical diffusion tensor MRI (DT-MRI). Here this question is investigated using Monte Carlo simulations of icosahedral sampling schemes and in vivo data. These polyhedra-based schemes, which have the advantage that large N can be created from optimised subsets of smaller N, appear to be ideal for the study of restless subjects since if scanning needs to be prematurely terminated it should be possible to identify a subset of images that have been acquired with a near optimised sampling scheme. The simulations and in vivo data show that as N increases, the rotational variance of fractional anisotropy (FA) estimates becomes progressively less dependent on the magnitude of subject rotation (), while higher FA values are progressively underestimated as increases. These data indicate that for large subject rotations the B-matrix should be recalculated to provide accurate diffusion anisotropy information.     

Effect of triangular vacancy defect on thermal conductivity and thermal rectification in graphene nanoribbons

We investigate the thermal transport properties of armchair graphene nanoribbons (AGNRs) possessing various sizes of triangular vacancy defect within a temperature range of 200–600 K by using classical molecular dynamics simulation. The results show that the thermal conductivities of the graphene nanoribbons decrease with increasing sizes of triangular vacancy defects in both directions across the whole temperature range tested, and the presence of the defect can decrease the thermal conductivity by more than 40% as the number of removed cluster atoms is increased to 25 (1.56% for vacancy concentration) owing to the effect of phonon–defect scattering. In the meantime, we find the thermal conductivity of defective graphene nanoribbons is insensitive to the temperature change at higher vacancy concentrations. Furthermore, the dependence of temperatures and various sizes of triangular vacancy defect for the thermal rectification ration are also detected. This work implies a possible route to achieve thermal rectifier for 2D materials by defect engineering.     

New non-Abelian effects on D-branes

We extend the Myers dielectric effect to configurations with angular momentum. The resulting time-dependent N D0 brane bound states can be interpreted as describing rotating fuzzy ellipsoids. A similar solution exists also in the presence of a RR magnetic field, that we study in detail. We show that, for any finite N, above a certain critical angular momentum is energetically more favorable for the bound state system to dissociate into an Abelian configuration of N D0 branes moving independently. We have investigated this problem in the low-energy expansion of the non-Abelian D brane action for generic N. In the case N=2 we find explicit solutions of the full non-Abelian Born–Infeld D brane dynamics, which remarkably have the same structure and confirm the features of the low-energy approximation. We further study D string configurations representing fuzzy funnels deformed by the magnetic field and by the rotational motion.