三重晶格光子晶体方形点缺陷缺陷模特性研究

文中提出一种新型三重三角晶格光子晶体,应用平面波展开法( PWM )分析其带隙结构,应用时域有限差分法( FDTD)研究方形点缺陷的尺寸和旋转角度对缺陷模特性的影响。仿真结果表明,该光子晶体的光子禁带处于THz波段范围内,且禁带宽度很宽,达到0.19562。当方形点缺陷旋转角度为10毅时,改变点缺陷尺寸,此时缺陷模个数发生变化,并且随着点缺陷尺寸的增大,缺陷模波长往长波长方向移动;当方形点缺陷边长为22.5μm时,改变点缺陷旋转角度,此时缺陷模位置基本不变,但是缺陷模个数发生变化。     

求解周期结构中声波传播问题的一种边界元法

本文应用边界积分方程方法(边界元法)求解无限长周期结构中声波的传播问题,根据散射体的周期排布方式,将无限个散射体对应无限个边界积分方程的求解问题转化为在某一个单位块中有限个边界积分方程的求解,从而使得该问题的数值求解变得简单可行.然后将该方法应用于声子晶体能量禁带的预测中,通过对数值算例的求解以及与其他方法求解结果的比较,验证了本文所提出方法的可行性和准确性.     

连续切片三维立体重构的程序设计

该文实现了利用材料微观结构的系列二维截面图形数据，重构微结构立体图形的初级程序设计。使用连续切片和金相方法，得到材料微观组织结构的系列二维截面图，运用距离最小原则、均匀分配原则、图形拓扑相似性原则，逐层连接相邻切片二维截面，得到微观结构的立体图形，并通过消隐，使重构的材料微观结构立体结构符合正常的视觉效果。该程序能够按照任意角度旋转图形，从而可以了解微观组织结构不同视角的立体信息。     

异丙基水杨酰腙Schiff碱的合成、晶体结构及量子化学研究

用水杨酸甲酯和水合肼、丙酮在甲醇水混合溶液中合成了标题化合物C10H14N2O3,并测定了其晶体结构,该晶体属单斜晶系,空间群P2(1)/n,晶胞参数为:a=0．482 71(15)nm,b=1．560 5(5)nm,c=1．420 8(4)nm,β=90．899(6)°,V=1．070 1 (6)nm3,Dc=1．305g/cm3,Z=4,F(000)=448。最终偏离因子R1=0．047 2,wR2=0．104 3。依据晶体结构数据使用G03程序对化合物进行了量子化学计算,得到了其分子轨道能量和原子净电荷布居规律,分析了其活性原子,并预测了其稳定性,为研究标题化合物异丙基水杨酰腙的生物活性、配合物的合成提供理论指导。     

元素电离能与元素价电子组态的相关性研究

从结构与物性关系的角度,按元素的价电子组态、核电荷数Z及周期数E定义了价电子组态参数iVe=(bsnsrs bpnprp bdndrd bfnfrf)(z Σj=1i)a／Et(i=1-8)。元素的各级电离能(I1-I8)与其相应iVe值(I1对应于1Ve,I2对应于2Ve,…)通过模型Ii=fiiVewi gi(fi、gi、wi为常数)进行关联。结果表明,价电子组态参数iVe(i=1-8)能以简单的方式突出元素的结构特征,元素的各级电离能与iVe间呈现高度的相关性(r1=0．9858,r2=0．9940,r3=0．9940,r4=0．9917,r5=0．9900,r6=0．9900 r7=0．9900,r8=0．9902),从而揭示了元素的电离能对其价电子组态及核电荷数的依赖关系。     

基于L_2,_P稀疏子空间和局部结构保持降维

在无样本类别先验信息下,样本间的局部结构和全局结构信息在降维过程中成为重要的考虑因素。多数降维方法只考虑样本间的单一结构。在降维过程中考虑混合结构,提出基于L_2,_p稀疏子空间和局部结构保持降维方法,同时考虑样本间的全局子空间结构和局部几何结构,通过刻画局部相似性关系图,保持降维前后样本间局部流行结构一致;通过更一般化的L_2,_p(0 相似文献   

基于椭圆傅里叶描述子的形状表示的研究

形状表示是模式识别和计算机视觉中最重要的研究内容之一。针对传统形状表示算法对形状的整体特征和细节信息不能同时描述、通用性不高的问题,提出了一种基于高斯多尺度分析下的椭圆傅里叶描述算子。提出的算法利用高斯函数与目标形状的复坐标函数进行卷积,通过选择高斯曲线的参数,将形状的边界信息呈现到不同的尺度空间之中;利用椭圆傅里叶变换将其展开得到表示该形状的特征向量。实验结果表明,该方法的优点在于描述同类形状时,特征向量之间的相关系数高,具有很好的平移、旋转以及尺度不变性;在描述不同类形状时,相关系数低,有很强的形状区分能力。该方法在形状分类实验中也有较高的检索准确率。     

卤素取代基对二氯-4,5-二氮芴-9-酮合钯(Ⅱ)的能带影响

二氯-4,5-二氮芴-9-酮作为1,10-邻二氮杂菲的衍生物,能与Pd(Ⅱ)等金属离子形成配合物,研究表明,其具有丰富的二维或三维的空间结构特点,在共轭环间的π-π堆积下其有序的堆积结构可能产生具半导体性质,但对它及它的取代衍生物的导电性研究还未有相关报道.采用Materials Studio4.0软件中的CASTEP软件的LDA/CA-PZ法,计算二氯-4,5-二氮芴-9-酮合钯(Ⅱ)及其卤素取代衍生物的晶体优化构型、能带结构和态密度,结果表明,卤素原子较趋于取代分子γ位的氢原子.PddafoCl2及其卤素取代衍生物晶体的禁带宽度在(1.1691～1.5221)eV间,显示该系列物质均具有半导体属性.引入卤素取代基显然降低了体系的禁带宽度,同时提高了态密度,增强导电性质.其中以碘原子α取代衍生物的禁带最窄,态密度最大.引入不同的卤索取代基,配合物呈现不同的导电性,导电性的改变对于非线形光学材料及磁性材料方面等有很重要的研究意义,二氯-4.5-二氨芴-9-酮合钯(Ⅱ)及它的卤素取代衍生物将在不同的领域获得广泛的应用.     

基于变形雅可比(p=4,q=3)-傅立叶矩的形状识别研究

在理论上从广义傅立叶-梅林矩人手对变形雅可比(p=4,q=3)-傅立叶矩进行了归一化,得到了平移、灰度、尺度、旋转等多畸变不变矩,同时用实验数据证明了该矩具有较理想的多畸变不变性.用类六边形抽样算法来提高变形雅可比(p=4,q=3)-傅立叶矩的图像数字化质量,减少量化误差.用加权最小平均距离规则,在34维特征空间中进行四类物体的平移、旋转、灰度以及缩放变化后的16个变形体进行了形状识别实验,实验结果表明误判率为零.     

化合物C36 H24 O6的合成、晶体结构及量子化学研究

在甲苯溶剂中以蒽和顺丁烯二酸酐为原料合成了标题化合物C36H24O6,并测定了化合物的晶体结构,该晶体属单斜晶系,空间群P2(1)／c,晶胞参数为:a=1．1255(3)nm,b=0．9482(2)nm,c=1．2894(3)nm,β=103．563(4)°,V=1．3376(5) nm3,Dc=1．372 g/cm3,Z=2,F(000)=576。最终偏离因子R1=0．0436,wR2=0．0886。依据晶体结构数据使用G03程序对化合物进行了量子化学计算,探讨化合物的稳定性、分子轨道能量、原子净电荷布居规律。     

二维分布式陀螺结构带隙特性研究

本文研究了一种二维分布式陀螺结构的扭转振动的能带结构特性.该结构原胞由陀螺、外框架、扭转弹簧组成,通过角动量定理得到动力学方程,再由Bloch定理得到色散关系并分析其能带结构特性.在理论上研究了三个重要的结构参数：角动量、转动惯量、扭转刚度对能带结构的影响,同时通过数值方法对带隙特性进行分析,所得数值结果与理论结果吻合较好,证明了结构中带隙的存在.     

基于声子晶体的层叠式方柱型减振结构设计

基于声子晶体特性提出一种层叠式方柱型声子晶体单胞结构,通过冲击响应谱分析和随机振动分析考察其周期性结构减振特性,并与相应非周期结构对比.计算结果表明该声子晶体周期性结构对于冲击载荷和随机振动载荷均有较好的减振特性.在三组分材料参数中影响单胞带隙特性的主要因素是外层材料密度和中间层材料弹性模量.声子晶体结构的减振效果随周期数的增加而愈加明显.组分材料力学性能参数和周期型结构周期数是声子晶体结构减振设计的主要因素.     

二维三角陀螺声子晶体的波调控研究

本文研究了一种二维三角陀螺声子晶体,采用拉格朗日方程对结构进行建模,推导出动力学方程.通过调节陀螺转速,可以控制结构的色散关系,并获得较大的带隙,从而可以将其用来进行振动控制和噪声抑制.从色散曲面等频截线发现波在结构中的传播方向会随频率变化,在低频时各向同等传播,高频时则出现六个集中的传播方向.通过数值计算验证了理论获得的带隙的准确性.     

恒频声学二极管的设计及特性研究

声学二极管能控制声波仅在一个方向有效传输在反方向无法传播,在通信技术中具有广泛的应用,然而目前大多数的声学二极管设计是基于非线性效应使系统只通过新的高次频率并阻止原频率的传输.本文利用不对称结构与弱非线性声子晶体的组合,提出了一种一维声二极管模型,实现弹性波的不对称传输,并保持频率不变.该模型由左端的变幅杆和右端的非线性弹簧质量链组成,理论分析表明,该声学二极管具有与电子二极管相同的正向和反向特性,并通过有限元仿真验证了该模型的有效性.     

单面柱声子晶体板低频带隙特性与机理分析

基于有限元法计算分析散射体材料属性和散射体形状对单面柱板结构局域共振型声子晶体带隙特性的影响,并通过计算单胞位移特征模式解释声子晶体带隙特性变化的物理机理.结果表明：散射体的密度和弹性模量以及散射体形状通过改变声子晶体单胞局域状态,对声子晶体带隙特性产生很大影响.总结声子晶体板结构低频带隙特性变化规律,为工程减振降噪提供参考.     

Study on relationships of electromagnetic band structures and left/right handed structures

Two types of dual periodic circuits are introduced. The distributions of passbands and stopbands are generated from their dispersion relationships. Based on the study, Brillouin diagrams of three representative special cases are drawn; S parameters of these three cases are simulated by Aglient ADS; the S parameters of one of the three cases are verified by an experiment. The phase characteristics are compared with those generated from the dispersion relationship. The theoretical analysis and the experimental verification show that both types of the periodic structures can behave as electromagnetic band gap (EBG) structures, right-handed structures (RHS), and left-handed structures (LHS), when they operate at different frequency ranges. Thus, the possibility of a physical structure showing these three different characteristics at different frequency ranges is proven.     

Study on relationships of electromagnetic band gap structures and left/right handed structures

Two types of dual periodic circuits are introduced. The distributions of passbands and stopbands are generated from their dispersion relationships. Based on the study, Brillouin diagrams of three representative special cases are drawn; S parameters of these three cases are simulated by Aglient ADS; the S parameters of one of the three cases are verified by an experiment. The phase characteristics are compared with those generated from the dispersion relationship. The theoretical analysis and the experimental verification show that both types of the periodic structures can behave as electromagnetic band gap (EBG) structures, right-handed structures (RHS), and left-handed structures (LHS), when they operate at different frequency ranges. Thus, the possibility of a physical structure showing these three different characteristics at different frequency ranges is proven.     

Compact dual‐band ring dielectric resonator antenna with moon‐shaped defected ground structure for WiMAX/WLAN applications

In this article, compact ring‐shaped dielectric resonator antenna (DRA) along with moon‐shaped defected ground structure (DGS) was studied. The proposed antenna was fed by microstrip line shifted from center position, which excited TE_01δ mode in ring DRA. Moon‐shaped DGS was acting as a radiator and also reduced the size of proposed antenna by an amount of 14.87% (lower frequency band) and 48.77% (upper frequency band). The proposed antenna was designed to resonate at two different frequencies namely 2.24 and 5.82 GHz with a fractional bandwidth of 30.17% and 22.14%, respectively. Based on optimized design parameters, archetype of antenna structure has been constructed and measured successfully, which shows good agreement with simulated ones. The proposed antenna design was suitable for WLAN (2.4/5.2/5.8 GHz); WiMAX (2.5/5.5 GHz); AMSAT (5.6/5.8 GHz); and WAVE (5.9 GHz) bands. © 2016 Wiley Periodicals, Inc. Int J RF and Microwave CAE 26:503–511, 2016.     

A compact dual‐band superconducting filter with fine‐tuning coupling structure

A novel dual‐mode optimized patch capacitor loaded T‐type resonator is proposed for the design of a dual‐band filter (DBF). The resonator has its lowest even‐ and odd‐mode at the two expected passband frequencies and the first spurious mode far away from the passbands. For tuning of the two sets of coupling strengths for both passbands, open/shorted secondary coupling structures are introduced as a fine‐tuning coupling structure to increase/decrease the primary coupling strength. A four‐pole DBF with passbands centered at 2450 and 3500 MHz, respectively, is proposed and fabricated using the HTS material. The measured results of the filter indicate superior performance and good fitting with the simulation results. The return losses of both passbands and the insertion losses obtained by measurements are greater than 14 dB and less than 0.3 dB, respectively. The stopband rejection exceeds 50 dB up to 8.0 GHz.     

First-principles study of ground-state properties and phase stability of vanadium nitrides

Using a series of density functional electronic structure total energy calculations, we have systematically studied the ground-state properties and phase stability of vanadium nitrides. Comparison of enthalpy of formation shows that V ₂N is equally stable (polymorphic) in , and Fe₂C phases within a few meV. Formation enthalpy of the various phases considered for perfect stoichiometric V N_1.0 shows that it has enhanced stability in hexagonal WC and NiAs structures in relation to NaCl-type δ-phase. The TiAs phase of VN has nearly same energy as NaCl structure. Comparison of energetics of -type , for x=0 and 0.3333 and of , for x=0, 0.0625, 0.125 and 0.25 shows that vacancies on the nitrogen sublattice lowers the formation enthalpy in relation to respective stoichiometric phases which is in agreement with experiments, as bulk vanadium nitrides are known to be generally non-stoichiometric. The calculated dilute heat of solution for the interstitial nitrogen is found to be in good agreement with experimental values and shows that nitrogen prefers to occupy the octahedral sites in bcc vanadium. The α^′-FeN and martensite structures, considered for the metastable phases of vanadium nitrides, have higher formation enthalpy in relation to equilibrium phases. Analysis of electronic density of states of V ₂N shows that the low energy , and Fe₂C phases are characterized by broad V 3d-N 2p and V 3d bonding bands. Density of states of VN shows that in the low energy WC and NiAs phases some of the antibonding states are made empty, leading to a minimum near the Fermi level. For and , density of states shows that vacancies on the nitrogen sublattice introduce additional filled states in the 3d band below Fermi level enabling enhanced bonding. Comparison between bulk moduli and atomic volumes for the various phases of vanadium nitrides shows that higher bulk moduli are dominated by increased V–N bonds combined with low atomic volumes.