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Enhancement Design and Quasi‐Static Crushing Response of Novel Star‐Rhombus Honeycombs 新型星形蜂窝的增强设计及准静态破碎响应
Pub Date : 2023-07-21 DOI: 10.1002/pssb.202300231
Shun Wang, Hai Liu
To enhance the load‐bearing capacity and energy absorption capacity of the honeycomb, three kinds of star‐rhombus honeycombs (SRHs) are proposed by adding rhombic parts to the traditional star‐shaped honeycomb (TSH). The quasi‐static crushing responses of SRHs, including deformation mechanism, crushing stress, specific energy absorption (SEA), and Poisson's ratio, are studied based on the finite‐element (FE) method. The introduction of rhombic parts increases the number of plastic hinges, resulting in significantly higher crushing stress and SEA of the SRHs than that of the TSH. Among the SRHs, SRH‐A has the largest energy absorption, and the SEA value of SRH‐A is 98.2% higher than TSH. Then, parametric studies including wall thickness, cell wall angle, and spacing length between the vertices of the star‐shaped part and the rhombic part are carried out. The wall thickness and cell wall angle have the greatest influence on the crushing response of SRHs. Crushing stress and Poisson's ratio of SRHs can be adjusted by changing the wall thickness of the rhombic part. The configurations and geometric parameters of the rhombic part determine the Poisson's ratio of SRHs. This study provides effective guidance for designing star‐shaped honeycombs with enhanced load‐bearing capacity and energy absorption capacity.
为了提高蜂窝的承载能力和吸能能力,在传统的星形蜂窝(TSH)的基础上增加了菱形部件,提出了三种星形蜂窝(SRHs)。基于有限元(FE)方法研究了SRHs的准静态破碎响应,包括变形机制、破碎应力、比能吸收(SEA)和泊松比。菱形部件的引入增加了塑料铰链的数量,导致srh的破碎应力和SEA明显高于TSH。其中SRH‐A的能量吸收最大,其SEA值比TSH高98.2%。然后,进行了包括壁厚、细胞壁角、星形部分和菱形部分顶点间距长度等参数化研究。壁厚和细胞壁角对SRHs的破碎响应影响最大。通过改变菱形部分的壁厚,可以调节SRHs的破碎应力和泊松比。菱形部分的构型和几何参数决定了SRHs的泊松比。该研究为设计具有增强承载能力和能量吸收能力的星形蜂窝提供了有效的指导。
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引用次数: 0
Tuning of Electronic and Optical Properties of PtS2 Monolayer Using Stacking Engineering 利用堆叠技术调谐PtS2单层材料的电子学和光学性质
Pub Date : 2023-07-20 DOI: 10.1002/pssb.202300132
Priyanka Priyanka, Ramesh Kumar, F. Chand
The present study investigates the influence of layer thickness and stacking engineering on the electronic, structural, and optical properties of monolayer PtS2 using the density functional theory calculations. The monolayer PtS2 (m‐PtS2) is found to possess an indirect bandgap, 1.73 eV, which reduces to 0.67 eV for bilayer PtS2 (b‐PtS2). Impact of stacking engineering on the electronic and optical properties is explored through six different stacking patterns and the AA1 configuration is found to be most stable displaying the highest reflectance and refractive index values. Moreover, this PtS2 bilayer structure demonstrates promising light absorption capability over a wide range (2–12 eV) with the position of absorption edge showing a redshift as the layers number increases. These computed electronic and optical properties of monolayer PtS2 validate it as a prospective material for future optoelectronic devices.
本研究利用密度泛函理论计算研究了层厚和堆叠工程对单层PtS2电子、结构和光学性质的影响。发现单层PtS2 (m‐PtS2)具有1.73 eV的间接带隙,而双层PtS2 (b‐PtS2)具有0.67 eV的间接带隙。通过六种不同的堆叠方式探讨了堆叠工程对电子和光学性能的影响,发现AA1结构最稳定,反射率和折射率值最高。此外,PtS2双层结构在2-12 eV的宽范围内具有良好的光吸收能力,并且随着层数的增加,吸收边缘的位置呈现红移。这些计算得到的单层PtS2的电子和光学特性验证了它作为未来光电器件的一种有前景的材料。
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引用次数: 0
The Role of Concentration, Site, and O Vacancy on Magnetic and Optical Properties of Cu‐Doped Anatase TiO2 浓度、位置和O空位对Cu掺杂锐钛矿TiO2磁性和光学性能的影响
Pub Date : 2023-07-19 DOI: 10.1002/pssb.202300157
Yao Yang, Yibin Hu, Yan Huang, Xiaofang Wang, Xiaoshuang Chen
Cu‐doped TiO2$left(text{TiO}right)_{2}$ is a dilute magnetic semiconductor with excellent electrical, magnetic, and optical properties. Herein, first‐principles methods are employed to investigate its electronic structure, magnetic properties, and optical behavior. The results demonstrate that Cu‐doped TiO2$left(text{TiO}right)_{2}$ exhibits intrinsic ferromagnetism. The presence of O vacancies facilitates the ferromagnetic exchange between Cu ions by forming bound magnetic polarons (BMPs). This finding validates the BMPs model and explains for the decrease in magnetic properties during annealing under O2 conditions. As the concentration of Cu increases, the system undergoes a transition from a semiconductor to a metal. Cu ions exhibit a preference for a compact configuration and display either paramagnetism or antiferromagnetism. The spin polarization can be effectively controlled from 0% to 100% by adjusting the concentration and site of Cu. Additionally, Cu doping leads to a reduction in the bandgap and an extension of the absorption range into the infrared region. The absorption intensity is positively correlated with the concentration. The presence of a spin‐polarized intermediate band indicates a correlation between the spin of the excited electron and the energy of the absorbed photon. Overall, Cu‐doped TiO2$left(text{TiO}right)_{2}$ shows significant potential for applications in spintronics and spin‐related optics, including photospintronics and spin photocatalysis.
Cu掺杂TiO2$left(text{TiO}right)_{2}$是一种稀磁性半导体,具有优异的电学、磁学和光学性能。本文采用第一性原理方法研究了其电子结构、磁性和光学特性。结果表明,Cu掺杂TiO2$left(text{TiO}right)_{2}$具有本征铁磁性。O空位的存在通过形成束缚极化子(BMPs)促进了Cu离子之间的铁磁交换。这一发现验证了BMPs模型,并解释了在O2条件下退火过程中磁性能下降的原因。随着Cu浓度的增加,体系经历了从半导体到金属的转变。铜离子表现出致密结构的偏好,并显示顺磁性或反铁磁性。通过调整Cu的浓度和位置,可以有效地控制自旋极化从0%到100%。此外,Cu掺杂导致带隙减小,吸收范围扩展到红外区域。吸收强度与浓度呈正相关。自旋极化中间带的存在表明受激电子的自旋与吸收光子的能量之间存在相关性。总的来说,Cu掺杂TiO2$left(text{TiO}right)_{2}$在自旋电子学和自旋相关光学领域显示出巨大的应用潜力,包括光自旋电子学和自旋光催化。
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引用次数: 0
A Novel Single‐Phase White Phosphor Gd7O6(BO3)(PO4)2:Dy3+ 新型单相白色荧光粉Gd7O6(BO3)(PO4)2:Dy3+
Pub Date : 2023-07-18 DOI: 10.1002/pssb.202300193
Rongli Zhao, Xiang Guo, Yi Ling, Ruirui Cui
A series of Gd7O6(BO3)(PO4)2:xDy3+ phosphors are synthesized using high‐temperature solid‐phase method. The phase and spectral characteristics of phosphors are analyzed using X‐ray diffraction and spectrometer. It is found that the ratio of the light intensity corresponding to the electric dipole and magnetic dipole can regulate the color of the photoluminescence, and the optimal concentration x = 0.05 reaches 1.0834, which is very close to white light. This phenomenon is related to the symmetry of the lattice. Simultaneously, it is observed that the fluorescence decay lifetime decreases with increasing concentration. The Commission Internationale de l'Eclairage coordinates obtained from the measured color of the sample are also very close to the standard white light coordinates (0.3333, 0.3333). The results presented above suggest that Gd7O6(BO3)(PO4)2:xDy3+ is a promising candidate for the next generation of white light‐emitting diodes.
采用高温固相法合成了一系列Gd7O6(BO3)(PO4)2:xDy3+荧光粉。用X射线衍射仪和光谱仪分析了荧光粉的相位和光谱特性。发现电偶极子与磁偶极子对应的光强之比可以调节光致发光的颜色,最优浓度x = 0.05达到1.0834,非常接近白光。这种现象与晶格的对称性有关。同时,观察到荧光衰减寿命随浓度的增加而减小。从样品的测量颜色得到的国际发光委员会坐标也非常接近标准白光坐标(0.3333,0.3333)。上述结果表明,Gd7O6(BO3)(PO4)2:xDy3+是下一代白光发光二极管的理想候选材料。
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引用次数: 0
Superconducting Complementary Metamaterial‐Based Switchable Device for Terahertz Wave Manipulation 基于超导互补超材料的太赫兹波操纵开关器件
Pub Date : 2023-07-18 DOI: 10.1002/pssb.202300203
Chun Li, Yan Teng, Hao-Chung Chen, R. Su, Hancong Sun, Ling Jiang
Herein, a tunable superconducting switch that can modulate terahertz waves is designed and experimentally demonstrated. The switchable device consists of two symmetrical split ring resonator antistructures made from niobium nitride film in one unit cell. The relatively high modulation depths of 88.5% can be obtained at resonance peaks of 0.328 THz by applying a very low bias voltage of 0.8 V. Due to the presence of higher‐order resonance modes, the superconducting device also demonstrates a multiband tuning ability at 1.03 and 1.16 THz. To further analyze the modulation mechanism of the superconducting device, the temperature dependence of the switchable device is also measured. The trends of conductivity change are calculated based on the Bardeen–Cooper–Schrieffer theory and the simulations agree well with the experimental results. During the experiment, this device not only owns a good switching capability but also shows significant frequency selective bandpass characteristics. This study delivers a promising approach for designing active and miniaturized devices, especially for applications in THz cryogenic systems.
本文设计了一种可调谐的超导开关,并进行了实验验证。该开关装置由两个对称的分裂环谐振器反结构组成,该结构由氮化铌薄膜制成。在0.328 THz的谐振峰处,施加0.8 V的极低偏置电压,可以获得88.5%的调制深度。由于高阶共振模式的存在,超导器件在1.03和1.16太赫兹也表现出多波段调谐能力。为了进一步分析超导器件的调制机制,还测量了可开关器件的温度依赖性。基于Bardeen-Cooper-Schrieffer理论计算了电导率的变化趋势,模拟结果与实验结果吻合较好。在实验中,该器件不仅具有良好的开关性能,而且具有显著的频率选择性带通特性。这项研究为设计有源和小型化器件提供了一种有前途的方法,特别是在太赫兹低温系统中的应用。
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引用次数: 0
In‐Plane Crushing Behaviors of Hexagonal Honeycombs with Hollow‐Circle Joint under Different Compressive Velocities 不同压缩速度下空心圆接头六角形蜂窝的平面内破碎行为
Pub Date : 2023-07-13 DOI: 10.1002/pssb.202300127
Y. Chen, Wenjun Zhao, Peijun Gao
The in‐plane crushing behaviors of hierarchical hexagonal honeycombs, structured by replacing every three‐wall vertex of both the conventional and reentrant hexagonal honeycombs with a small hollow‐circle, are investigated herein. The finite element (FE) models are first verified by an empirical formula from the literature and then further used to simulate the in‐plane crushing behaviors of the honeycombs under different compressive velocities. The deformation mode, plateau stress, and specific energy absorption (SEA) are studied based on the FE simulations. With respect to the conventional hierarchical honeycombs, the reentrant hierarchical honeycombs, in most instances, are found to exhibit higher plateau stress but lower SEA. It is remarkable that the hierarchical hexagonal honeycombs exhibit higher plateau stress and SEA than the basic hexagonal ones, which indicates that the hierarchical design is effective in improving both the impact resistance and energy absorption capabilities of the honeycombs.
本文研究了分层六边形蜂窝的平面内破碎行为,该分层六边形蜂窝的结构是用一个小空心圆代替常规六边形蜂巢和可重入六边形蜂巢的每个三壁顶点。首先用文献中的经验公式对有限元模型进行了验证,然后进一步模拟了不同压缩速度下蜂窝的平面内破碎行为。在有限元模拟的基础上,研究了变形模式、高原应力和比能量吸收。与传统的分层蜂巢相比,在大多数情况下,重入分层蜂巢表现出更高的高原应力,但SEA较低。与基本六边形蜂窝相比,分层六边形蜂窝具有更高的平台应力和SEA,这表明分层设计在提高蜂窝的抗冲击能力和吸能能力方面是有效的。
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引用次数: 0
Electronic structure and optical spectra of halide perovskites A2BCl6 (A= Cs; B= Se, Sn, Te, Ti, Zr) and (A=K; B= Pd, Pt, Sn) for photovoltaic and optoelectronic applications 卤化物钙钛矿A2BCl6 (A= Cs)的电子结构和光谱B= Se, Sn, Te, Ti, Zr)和(A=K;B= Pd, Pt, Sn)用于光伏和光电子应用
Pub Date : 2023-07-13 DOI: 10.1002/pssb.202300280
Saadi Berri, N. Bouarissa
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引用次数: 0
Temperature‐Adaptive Modulation of Transverse Magnetic Intrinsic Graphene Plasmons 横向磁性本征石墨烯等离子体的温度自适应调制
Pub Date : 2023-07-12 DOI: 10.1002/pssb.202300256
Dong Sun, X. Hua, Lijun Wang, Daqing Liu, N. Ma
A method for modulating transverse magnetic intrinsic graphene plasmons by temperature is proposed. In contrast to existing 2D or 3D infinite graphene structures, an intrinsic graphene 3D finite structure with periodicity in all three directions is designed. At the matching point, where the dispersion curve of the intrinsic graphene plasmons intersects with that of electromagnetic radiation, the intrinsic graphene plasmons and electromagnetic radiation can be excited by each other; in other words, the plasmon can be excited by light without additional mechanisms. Furthermore, the influence of environment temperature on the matching point is shown. The study reveals that the plasmon modulation is adaptive to the temperature. These results are beneficial for the design of compact graphene‐based optoelectronic devices.
提出了一种利用温度调制横向磁性石墨烯等离激子的方法。与现有的二维或三维无限石墨烯结构相比,设计了具有三个方向周期性的本征石墨烯三维有限结构。在本征石墨烯等离子体色散曲线与电磁辐射色散曲线相交的匹配点,本征石墨烯等离子体与电磁辐射可以相互激发;换句话说,等离子体激元可以被光激发而不需要额外的机制。进一步分析了环境温度对匹配点的影响。研究表明,等离子体激元调制对温度有一定的适应性。这些结果有助于设计紧凑的基于石墨烯的光电器件。
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引用次数: 0
Calibration of Low‐Temperature Photoluminescence of Boron‐Doped Silicon with Increased Temperature Precision 提高温度精度的硼掺杂硅低温光致发光校准
Pub Date : 2023-07-11 DOI: 10.1002/pssb.202300300
Katharina Peh, Aaron Flötotto, K. Lauer, D. Schulze, Dominik Bratek, S. Krischok
Low‐temperature photoluminescence spectroscopy enables the determination of the dopant concentration of shallow impurities in silicon. This measurement method is therefore well suited for identifying and analyzing dopants (intentional impurities in silicon). A method is presented which allows the determination of the boron concentration in silicon in a range from 2.2⋅1012$2.2 cdot left(10right)^{12}$ to 2.2⋅1016 cm−3$2.2 cdot left(10right)^{16} left(text{cm}right)^{- 3}$ at temperatures from 4.2 to 20 K with increased temperature accuracy. This method requires only one calibration function for the photoluminescence intensity ratio of the boron‐bound exciton IBTO(BE)$I_{left(text{B}right)_{text{TO}} left(right. text{BE} left.right)}$ and the free exciton IITO(FE)$I_{I_{text{TO}} left(right. text{FE} left.right)}$ . The measurement temperature is obtained from the intrinsic silicon photoluminescence line of free excitons ( ITO(FE)$I_{text{TO}} left(right. text{FE} left.right) left.right)$ ) using a fitting method, which distinguishes the TO $text{TO }$ and LO$text{LO}$ components of the free exciton peak. The determined calibration function is IBTO(BE)/IITO(FE)=(5.8±0.1)⋅10−18 cm3⋅cboron⋅e(56.7±0.7)KT$left(I_{B_{text{TO}} left(right. text{BE} left.right)}right)/left(I_{I_{text{TO}} left(right. text{FE} left.right)}right) = left(right. 5.8 pm 0.1 left.right) cdot left(10right)^{- 18} left(text{cm}right)^{3} cdot c_{text{boron}} cdot left(text{e}right)^{frac{left(right. 56.7 pm 0.7 left.right) text{K}}{T}}$ . The obtained exciton binding energy to boron, Eb=4.9±0.1 meV$E_{text{b}} = 4.9 pm 0.1 text{meV}$ , agrees well with literature data.
低温光致发光光谱法可以测定硅中浅层杂质的掺杂浓度。因此,这种测量方法非常适合于识别和分析掺杂剂(硅中的故意杂质)。提出了一种方法,可以在4.2至20 K的温度范围内,在2.2⋅1012 $2.2 cdot left(10right)^{12}$至2.2⋅1016 cm−3 $2.2 cdot left(10right)^{16} left(text{cm}right)^{- 3}$范围内测定硅中的硼浓度,并提高了温度精度。该方法对硼结合激子IBTO(BE) $I_{left(text{B}right)_{text{TO}} left(right. text{BE} left.right)}$与自由激子ito (FE) $I_{I_{text{TO}} left(right. text{FE} left.right)}$的光致发光强度比只需要一个标定函数。利用拟合方法从自由激子(ITO(FE) $I_{text{TO}} left(right. text{FE} left.right) left.right)$)的本征硅光致发光谱线得到测量温度,区分了自由激子峰的TO $text{TO }$和LO $text{LO}$分量。确定的校准函数为IBTO(BE)/ ito (FE)=(5.8±0.1)⋅10−18 cm3⋅c硼⋅e(56.7±0.7)KT $left(I_{B_{text{TO}} left(right. text{BE} left.right)}right)/left(I_{I_{text{TO}} left(right. text{FE} left.right)}right) = left(right. 5.8 pm 0.1 left.right) cdot left(10right)^{- 18} left(text{cm}right)^{3} cdot c_{text{boron}} cdot left(text{e}right)^{frac{left(right. 56.7 pm 0.7 left.right) text{K}}{T}}$。得到的激子与硼的结合能Eb=4.9±0.1 meV $E_{text{b}} = 4.9 pm 0.1 text{meV}$,与文献数据吻合较好。
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引用次数: 0
Single‐Ion Anisotropy Effect on the Critical and Hysteresis Behaviors of a Mixed‐Spin (1, 3/2) Square Ising Nanowire 单离子各向异性对混合自旋(1,3 /2)方形Ising纳米线临界和迟滞行为的影响
Pub Date : 2023-07-09 DOI: 10.1002/pssb.202300180
E. M. Jalal, H. Saadi, A. Hasnaoui, Ouafa Hachem, A. Lafhal, M. Madani, M. El Bouziani
The effect of single‐ion anisotropy is investigated on a mixed‐spin (1, 3/2) square Ising nanowire with square ferromagnetic shell and negative core–shell exchange coupling using Monte Carlo simulation. Depending on the Hamiltonian parameters, three different topologies of the phase diagram in the (anisotropy, temperature) plane are found. The tricritical point appears for D/JC$D / J_{text{C}}$ and DC/JC$D_{text{C}} / J_{text{C}}$ effects. For influence of DS/JC$D_{text{S}} / J_{text{C}}$ , there is no tricritical point in the phase diagram. The first‐order lines and critical endpoints are also obtained. Some important phenomena such as compensation behavior and rich variety of hysteresis loops are found. The results can be compared with other works, in particular on the nanowire with core–shell structure.
利用蒙特卡罗模拟研究了单离子各向异性对具有方形铁磁壳和负核壳交换耦合的混合自旋(1,3 /2)方形Ising纳米线的影响。根据哈密顿参数,在(各向异性,温度)平面上发现了三种不同的相图拓扑。临界点出现在D/JC$D / J_{text{C}}$和DC/JC$D_{text{C}} / J_{text{C}}$效果中。对于DS/JC$D_{text{S}} / J_{text{C}}$的影响,相图中不存在三临界点。得到了一阶线和临界端点。发现了一些重要的现象,如补偿行为和丰富的迟滞回路。所得结果可与其他研究成果进行比较,特别是与核壳结构纳米线的研究成果进行比较。
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引用次数: 0
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