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In this thesis,based on the DFT+NEGF first-principles method,we construct a lead-molecule-lead sandwich system with single benzene-based molecule to investigate the relationship between the structure and properties of the molecular devices and the factors that influence properties of the molecular devices.Our computational investigations on these molecular devices are primarily concentrated on the effect of contact geometry between molecules and electrodes,the effect of side groups,the effect of different torsion angle between two phenyl rings and the effect of external electric field.This thesis consists of five chapters:In Chapter one,we mainly introduce the research background and development of the molecular electronics,including the experimental fabrication of molecular electronic components and theoretical simulation methods.Afterwards we discuss the questions that need to be solved in this area.Finally,the main contents of this thesis are listed.In Chapter two,we introduce the theoretical methods used in this thesis, including the main first-principles calculation methods,i.e.,the Density-Functionmethod and nonequilibrium Green\'s function.

本论文拟采用密度泛函理论和非平衡格林函数相结合的第一性原理计算方法，选取苯基小分子作为研究对象，构建了金属电极/有机小分子/金属电极三明治结构体系，系统地研究了苯基分子器件结构的改变与分子电输运性质之间的关系以及影响分子器件电输运性质的相关因素，其中重点研究了分子与电极间可能的接触结构改变、官能团、分子间的扭转角以及外电场对苯基分子电输运性质的影响，本论文主要包括以下五个章节的内容：第一章为综述部分，主要介绍了分子电子学产生的背景、分子器件的研究意义、当前研究分子器件的实验和主要理论方法，以及目前在研究分子器件中存在的一些问题，最后给出了本论文的主要研究内容和技术路线。

With the electrical connections at the top and bottom side of the wafer-level IC packaging Lead-frame structure and composition of the surface-mount semiconductor package structure Multi-layer printed circuit board Antifuse and its formation method and with the anti-fuse non-volatile memory device unit cell Tandem electric signal processing circuit and electronic device Light-emitting diode packaging structure and encapsulation method Electronic Packaging Structure Flip-chip high-speed optoelectronic components and structure Pairs of piezoelectric friction side by side to promote the three-step device and scanning probe microscope Light-emitting diode and its manufacturing method, the production base of light-emitting diode method Three or four parallel advance of stepping piezoelectric device and scanning probe microscope lens body Silicon substrate and its manufacturing method Semiconductor device and voltage-divider A polysilicon layer and the microcrystalline silicon layer of the double-substrate active layer structure, methods and devices The edge of the thickness of silicon controlled Of a lateral semiconductor devices and high-voltage devices With a vertical-channel transistors semiconductor device Of a memory array and for the manufacture of a memory array method Read-only memory cell array structure Active-matrix substrate and display device High-voltage semiconductor integrated circuit devices, dielectric isolated type semiconductor device Image sensing devices Lens module and its manufacturing methods Solid-state imaging device and camera Injection angle for the trench isolation Organic Light-Emitting Display Device Organic light-emitting display device Bipolar transistor structure of the surface passivation Double-triggered silicon-controlled rectifier HFET Metal-oxide semiconductor transistors Self-aligned trench accumulation mode field effect transistor structure Thin-film transistors and Display Devices TFT Lead Diode Low-frequency, low noise, low-flashing diode Used for thin-film solar cells trap light structure Transparent sun solar cells Quaternary semiconductor heterojunction photovoltaic cells heat Si nano-pillar array heterojunction thin-film solar cells GaN-based micro-composite solar cells isotope Optical sensor Semiconductor by optical components Imaging Detector Transparent conductive oxide coating Silicon-based high-performance dual-junction solar cells Thin-film solar cells Alien LED Devices

非专业，不在行，求高手帮忙。谢谢！具有顶部及底部侧电连接的晶片级集成电路封装导线架结构及其构成的表面黏着型半导体封装结构多层印刷电路板反熔丝及其形成方法和具有该反熔丝的非易失性存储器件的单位单元串联用电式信号处理电路及电子装置发光二极管的封装结构及其封装方法电子封装结构高速光电组件及其芯片倒装结构双压电体并排推动的三摩擦力步进器与扫描探针显微镜发光二极管及其制作方法、发光二极管的底座的制作方法三或四压电体并行推进的步进器及其扫描探针显微镜镜体硅衬底及其制造方法半导体装置与分压电路具多晶硅层及微晶硅层的双底材主动层结构、方法及装置硅晶片的受控边缘厚度一种半导体横向器件和高压器件具有垂直沟道晶体管的半导体器件一种记忆体阵列及其用于制造一记忆体阵列的方法只读内存单元阵列结构有源矩阵基板和显示装置高耐压半导体集成电路装置、电介质分离型半导体装置图像感测装置透镜模块及其制造方法固态成像装置和照相机用于沟道隔离的斜角注入有机电致发光显示装置有机发光显示装置双极晶体管的表面钝化结构双触发型可控硅整流器异质结场效应晶体管金属氧化物半导体晶体管自对准沟槽累加模式场效应晶体管结构薄膜晶体管及显示器件薄膜晶体管无铅二极管低频、低噪音、低闪烁的二极管用于薄膜太阳电池的陷光结构透明遮阳太阳能电池片四元半导体的异质结热光伏电池硅基纳米柱阵列异质结薄膜太阳能电池氮化镓太阳能同位素复合型微电池光学传感器半导体受光元件成像探测器透明导电氧化物涂层硅基高效双结太阳能电池薄膜太阳能电池异形LED器件

It is able to initialize parameters; design and save test plan; input, save, reedit and activate test object info; real-time display of mechanics parameters and curves; programming test steps; management and report print of database.

论文以电液比例控制液压万能试验机为具体对象，在详细分析其工艺工况的基础上，给出了系统的物理和数学模型；着重就惯性负载、弹性负载不同的负载特性工况，对位置、变形、试验力控制系统进行了建模，并分析了它们的动静特性，指出影响系统精确性、快速性、稳定性的因素，并提出相应的解决办法；然后，论文推出了以工控机为控制核心的电液比例试验机控制系统；编写了电液比例控制液压万能试验机的部分工业控制软件，通过所编软件可实现：参数的初始化设置，试验材料测试方案的设计与保存，试样信息的录入、保存、修改和激活，力学性能参数和材料特性曲线的实时显示，自动程控方式下的编程，数据库管理和报表打印等功能；整个软件方案设计具有界面友好、操作方便、功能齐全等特点。

Three kinds of BCRC No.51534, 10322 and 10675 would be selected and acted as an experimental sample of Escherichia coli. Results shows that Escherichia coli of No.51534 will appear better performance because the maximum of open circuit voltage, closed current and power density are 1.01V, 22mA and 1342mW/m2, respectively. Concerning the effect of culture time with respect to different phase type on the electricity performance of MFCs, the time points on the intersection between lag phase and logarithmic phase, the middle of point of stationary phase for growth curve of Escherichia coli would appear a good performance of MFCs. In addition, the BCRC No. 51534 Escherichia coli possessing a better performance of MFCs than others would be suggested and applied to further studying. Comparison with the performance of MFCs with respect to electron mediator under different mole number, result shows that electron mediator of methylene blue with 4.63mM would appear a better electricity performance of MFCs than others. Concerning the different material of proton exchange membrane with PTFE-Nafion, Nafion 211, 212 and 117 with respect to the performance of MFCs, result shows that the Nafion 117 applied in MFCs will have a better performance of MFCs than other cases. Finally, the effect of molar concentration on the performance of MFCs would be expected at the studied cases of 0.4M, 0.2M, 0.1M and 0.05M respectively for cathode oxidant, result shows that a good performance of MFCs will happen at the condition of 0.2M. Those observations will be useful to improvement of MFCs in the further study.

於上述电池系统条件下，进行大肠杆菌生长曲线、电子传递介质、质子交换膜、电极与阴极氧化剂对电池电性效能分析；选择编号10322、10675与51534之大肠杆菌为实验菌株，依定量培养之生长曲线取出代表不同时生长特性时期的培养时间，利用亚甲基蓝作为电子传递介质进行实验分析从所测得的电量进行分析，以编号51534之大肠杆菌的微生物燃料电池有最大的开路电压为1.01V及最大闭路电流为22mA；当极化曲线中电压为0.47V、电流为11.4 mA时有最大的功率密度为1342 mW/m2；加以负载有平均工作功率密度294 mW/m2；从生长曲线与电性效能来分析，得知生长曲线的迟滞期与对数期的转变点与静止期的中间点有最佳电性效能表现；对於加入不同莫耳数之电子传递介质methylene blue、neutral red与thionine之电池效能表现，则以加入4.63mM methylene blue电子传递介质的电池有较佳平均功率密度230 mW/m2；另对於质子交换膜PTFE-Nafion、Nafion 211、Nafion 212与Nafion 117之电池效能表现，以Nafion 117质子交换膜的电池有较佳平均功率密度340 mW/m2；对於分析加入不同莫耳数浓度0.4M、0.2M、0.1M与0.05M的阴极氧化剂之电池效能，则以0.2M的阴极氧化剂的电池可得到较佳平均功率密度429 mW/m2。

The FEM, whose process is very *** and is fit to deal with complex boundary condition, is used to simulate the frequency-domain IP. Studying the characters and laws of IP\'parameters under different measuring devices and undulate topography will provide scientific references and basis and reduce the multiplicities of interpretation. It is will be an attempt and exploration.Because of the frequency of the exciting currents is usually between 10-2～102 Hz, the vector A can be seen is not change with the time and the EM effect can be ignored in the low frequency.

双频以及伪随机三频激电法以它特有的轻便、快捷、高效率等特点在有色金属矿躲勘探领域里获得了广泛的应用，运用有限单元法的推导过程简单、适合处理复杂几何外形等特点来对双频以及伪随机三频激电法进行正演数值模拟，分析和研究了激电参数在不同丈量装置、模型参数和起伏地形情况下的特点和规律，为后续的资料解释提供科学的依据和参考，为减少地球物理中的多解性做一些有益的探索和尝试。

No US-pin plastic treatment therapy, a comprehensive alternative to traditional plastic injection of the United States (with the needle and micro-needle) is efficient, non-invasive and safe,"mesoderm into beauty therapy" is the latest technology of water use and water channel protein electrophoresis principle of development Note the infiltration hole electric technology to non-needle injection principle, the use of "point to a plane," AMD permeation technology in skin electroporation Act under the influence of pulsed current stimulation, so that pores have a physical reaction to the rapid spread in two seconds 650-800 of fine pores, forming an instant electronic delivery channels of nutrition, nutrition Note dialysis therapy immediately with electrophoresis, soft laser stimulation and ice, etc., in the most secure and fast, the skin will be required for nutritional products , 99% transmitted to the basal cells, and can be stored as long as 72 hours, the skin smooth and more compact, creating a perfect Beautiful Skin.

B。电穿孔技术：直接作用于皮肤，瞬间增强皮肤组织的可渗透性。在电击的作用下，细胞的脂质二重层上形成电击孔。在电击孔形成的同时，使得原先无法被细胞吸收的亲水性分子能够穿透并进入细胞内部。电击孔一旦形成，则根据电击的长度，在数秒种至数分钟之内保持打开状态。C。电渗透技术：电渗主要作用于将要分散的物质分子，帮助其顺利穿透并进入肌肤内部，性质相同的电荷相互排斥，因此对正极的营养分子施加正电流，可将营养分子推入皮肤组织。此时，中性分子也一道穿透并进入肌肤内部。

We can produce any different pitch blade according to customer needs, the classic value of the pitch: A, 10 degree, suitable brush motor FP helichoper, let lower speeds rotor greater lift; B, 8 degree, suitable brushless motor FP helichoper, can make the main rotor get a higher speed; C, 6.5 degrees, suitable some DIY FP helichoper, can make the helicopter have better lock tail performance with a small diameter and high-speed tail rotor.

桨距可以根据客户需要进行定制，经典的桨距值为：A、10度，适合有刷马达的FP电直，能够在较低的转速下取得更大的升力；B、8度，适合无刷马达的FP电直，能够使主桨获得更高的转速；C、6.5度，适合玩家DIY的FP电直，配合小直径高转速的尾桨，能够获得更好的锁尾表现。

As a special micro-power source, thermoelectric micro-generator is of interest for its applications in Micro-Electro-Mechanical Systems. Electrochemical deposition method took the advantage at the fabrication of thermoelectric material in micrometer scale. In this paper, the detailed reduction processes of Bi~(3+) and HTeO~(2+) were studied for the first time. And thermoelectric nanowires were also prepared by electrochemical deposition. On the basic study of thermoelectric material, detailed exploration was made to the design and fabrication process of thermoelectric micro-generator.

作为一种特殊的微动力能源，微型温差发电器在微机电系统中的应用前景引起了人们极大的兴趣，电化学沉积方法在制备微米级尺寸的温差电材料方面具有显著的优势，本文对Bi~(3+)和HTeO~(2+)离子的电化学还原过程展开了详细的研究，并尝试了利用电化学沉积方法制备Bi_2Te_3纳米线材料，在温差电材料研究的基础上，对微型温差发电器的结构设计和制造过程进行了详细的探讨。

In this thesis, the radiation principle and the structure of slot antenna are studied and the impacts on its performance of every structure parameter in a slot antenna design are analyzed. On this foundation, a design plan of planar slot array antennas is proposed. The design has some structural feature as follows:(1) with different dielectric layers and microstrip line structure to guide the electromagnetic wave effectively;(2) the feeding network formed of microstrip line can match with the radiating slots expediently;(3) in order to increase the bandwidth of the antenna, the wider slot and branched feeding microstrip line are adopted to form a double resonance.

本文对缝隙辐射的原理、缝隙天线的结构作了探讨，分析了缝隙天线设计中各结构参数对其性能的影响，并在此基础上提出一种平面型缝隙天线的设计方案，它具有以下的特点：(1)采用分层结构，以不同的介电系数和微带线结构形成对电磁波的有效引导；(2)利用微带线构成馈电网络可以方便地与辐射缝隙进行匹配；(3)增大缝隙的宽度，并利用馈电微带线的枝节形成双谐振，以增加天线的带宽。

A process for making an electronic device which comprises applying a nonaqueous plate-resistant ink by ink jet printing to selected areas of a dielectric substrate, optionally laminated with an electrically conductive metal, exposing the plate resistant ink to actinic and/or particle beam radiation to effect polymerisation, adding one or more metal layers by electrolytic or electroless deposition, the upper layer of which is an etchresistant metal, removing the polymerised plate-resistant ink with alkali and finally removing the electrically conductive metal which are optionally directly laminated to the dielectric substrate and not protected by an upper layer of etch-resistant metal by chemical etching wherein the plate-resistant ink is substantially solvent-free and comprises: A 30 to 90 parts acrylate functional monomers free from acid groups comprising mono- or higher functionality wherein 5 to 95% by weight are mono-functional monomers; B 1 to 30 parts acrylate functional monomer containing one or more acid groups; C 0 to 20 parts polymer or prepolymer; D 0 to 20 parts radical initiator; E 0 to 5 parts colorant; F 0 to 5 parts surfactant; and where the ink has a viscosity of not greater than 30 cPs at 40 DEG C and all parts are by weight.

一种制备电子装置的方法，所述方法包括以下步骤：通过喷墨印刷在任选层压了一种或多种导电金属的介电底材的选定区域涂覆非水的阻沉积油墨，将所述阻沉积油墨暴露在光化辐射和/或微粒束辐射中以完成聚合，通过电解沉积或无电沉积增加一层或多层金属层，其中最上层的金属层为一种或多种阻蚀刻金属，用碱除去聚合的阻沉积油墨，最后通过化学蚀刻将任选直接层压在所述介电底材上并且不被一种或多种阻蚀刻金属的上层保护的导电金属除去，其中所述阻沉积油墨基本不含溶剂，并且包含以下组分：A30-90份不含酸基团的丙烯酸酯功能性单体，所述单体包括单官能或多官能单体，其中5-95％重量为单官能单体；B1-30份包含一个或多个酸基团的丙烯酸酯功能性单体；C0-20份聚合物或预聚物；D0-20份自由基引发剂；E0-5份着色剂；和F0-5份表面活性剂；其中所述油墨的粘度在40℃下不高于30cPs，并且所有的份数以重量计。

With Death guitarist Schuldiner adopting vocal duties, the band made a major impact on the scene.

随着死亡的吉他手Schuldiner接受主唱的职务，乐队在现实中树立了重要的影响。

But he could still end up breakfasting on Swiss-government issue muesli because all six are accused of nicking around 45 million pounds they should have paid to FIFA.

不过他最后仍有可能沦为瑞士政府&议事餐桌&上的一道早餐，因为这所有六个人都被指控把本应支付给国际足联的大约4500万英镑骗了个精光。