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Octahedra tilt influencing physical properties of polycrystalline Bi0.9Co0.1FeO3 ceramics 八面体倾斜对Bi0.9Co0.1FeO3多晶陶瓷物理性能的影响
IF 1.6 4区 材料科学 Q3 CRYSTALLOGRAPHY Pub Date : 2023-06-06 DOI: 10.1080/01411594.2023.2218005
R. Raman, G. Venkatesan, P. Sakthivel, I. B. Shameem Banu
ABSTRACT Recently, multiferroic materials such as BiFeO3 have fascinated researchers for their potential application in memory storage devices. However, high leakage, weak magnetism and magnetoelectric coupling in this system restrict its practical applications. To solve this, the octahedra tilt influencing electrical, magnetic and thermal properties of polycrystalline Bi0.9Co0.1FeO3 ceramics via solid state route is studied here. Cobalt doped BiFeO3 affect the structural arrangement and tunes the crystal engineering of BiFeO3. In particular, the temperature-dependent dielectric behaviour of Bi0.9Co0.1FeO3 shows a significant dielectric anomaly corresponding to the magnetoelectric coupling in this sample. Further, the maximum magnetization of Bi0.9Co0.1FeO3 is 8.70 emu/ g which is two orders higher in magnitude compared to pristine BiFeO3.
最近,像BiFeO3这样的多铁材料因其在存储设备中的潜在应用而引起了研究人员的兴趣。但该系统的高漏、弱磁和磁电耦合等缺点限制了其实际应用。为了解决这一问题,本文研究了八面体倾斜对多晶Bi0.9Co0.1FeO3陶瓷的电、磁、热性能的影响。钴掺杂影响了BiFeO3的结构排列,调整了BiFeO3的晶体工程。特别是,Bi0.9Co0.1FeO3的介电行为随温度的变化表现出明显的介电异常,对应于该样品的磁电耦合。此外,Bi0.9Co0.1FeO3的最大磁化强度为8.70 emu/ g,与原始BiFeO3相比提高了两个数量级。
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引用次数: 0
Impact of Ti doping and annealing temperature on structural and opto-magnetic properties of tungsten oxide (WO3) Ti掺杂和退火温度对氧化钨(WO3)结构和光磁性能的影响
IF 1.6 4区 材料科学 Q3 CRYSTALLOGRAPHY Pub Date : 2023-06-03 DOI: 10.1080/01411594.2023.2214666
Surbhi Chalotra, Simranpreet Kaur, Kriti, P. Kaur, P. Kaur, Parminder Kaur, D. Singh
ABSTRACT Pure and Ti-doped WO3 nano systems synthesized by the solid state reaction method and annealed at different temperatures, were studied for changes in structural, optical and magnetic properties. X-ray diffraction, Raman, UV–Vis, photoluminescence spectroscopy, vibrating sample magnetometer (VSM) techniques were employed for structural, optical and magnetic characterization to study the modification of the electronic structure and disorder developed in the samples. Inclusion of Ti ions leads to degradation in the crystallinity of the monoclinic single phase system with an increase in the content of the dopant ions, whereas increased annealing temperature enhances crystallinity. A red shift in the optical band gap indicates the production of defect states. As the annealing temperature is raised, the amount of visible photoluminescence (PL) emissions caused by oxygen vacancies decreases. Magnetic experiments demonstrate the ferromagnetic properties of the prepared samples, which exhibit a decrease with Ti doping and an increase in annealing temperature.
摘要采用固相反应法制备了纯WO3和掺钛WO3纳米体系,并在不同温度下退火,研究了其结构、光学和磁学性能的变化。采用X射线衍射、拉曼光谱、紫外-可见光谱、光致发光光谱、振动样品磁强计(VSM)技术进行结构、光学和磁性表征,研究样品中电子结构和无序的修饰。随着掺杂剂离子含量的增加,Ti离子的加入导致单斜单相体系的结晶度下降,而退火温度的升高则增强了结晶度。光学带隙中的红移指示缺陷状态的产生。随着退火温度的升高,由氧空位引起的可见光致发光(PL)发射量减少。磁性实验表明,所制备的样品的铁磁性能随着Ti掺杂和退火温度的升高而降低。
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引用次数: 0
Investigation of local structure and phase transformation in Ce-doped barium titanate and correlation with electrical properties Ce掺杂钛酸钡的局域结构和相变及其与电学性能的相关性研究
IF 1.6 4区 材料科学 Q3 CRYSTALLOGRAPHY Pub Date : 2023-06-03 DOI: 10.1080/01411594.2023.2218004
Md Sahanoor Islam, J. Ghosh
ABSTRACT BaTiO3-based materials are used as the replacement for lead-based perovskite materials for its wide dielectric applications. But the substitution of different doping elements in pure BaTiO3 drastically affects the microstructure, phase transition behavior and electrical properties. In the present work, local structure, phase transformation and dielectric behavior of BaCexTi1-xO3 (BCT) ceramics were studied for compositions x = 0.02, 0.05 and 0.1. A diffuse phase transition from orthorhombic to cubic via tetragonal in BCT with increasing Ce content was observed. An increase in particle size with Ce doping concentration was observed in FESEM images. Spherical and cuboid-shaped particle in the order of 80–150 nm was observed in transmission electron microscopic (TEM) images. RAMAN spectra confirm the tetragonal to cubic phase transition. Local structural and phase transformation behavior was obtained from laboratory-based PDF and XRD, respectively. Change in PDF was observed due to an increase in Ce doping. Dielectric properties decreased for Ce mole fraction of x = 0.1.
batio3基材料因其广泛的介电应用而被用作铅基钙钛矿材料的替代品。但不同掺杂元素的取代对纯BaTiO3的微观结构、相变行为和电学性能有显著影响。在本工作中,研究了成分x = 0.02、0.05和0.1时BaCexTi1-xO3 (BCT)陶瓷的局部结构、相变和介电行为。随着Ce含量的增加,BCT中出现了由正交晶向立方晶经四方晶的扩散相变。在FESEM图像中观察到,随着Ce掺杂浓度的增加,颗粒尺寸增大。透射电子显微镜(TEM)观察到80 ~ 150 nm量级的球形和长方体颗粒。拉曼光谱证实了四方向立方相变。通过室内PDF和XRD分别获得了材料的局部结构和相变行为。由于Ce掺杂的增加,观察到PDF的变化。当Ce摩尔分数x = 0.1时,介电性能下降。
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引用次数: 0
Cerium-modified single perovskite CaMnO3: structural, dielectric, and transport properties 铈修饰单钙钛矿CaMnO3:结构、介电和输运性质
IF 1.6 4区 材料科学 Q3 CRYSTALLOGRAPHY Pub Date : 2023-05-24 DOI: 10.1080/01411594.2023.2214665
R. Meher, Rajib Padhee, Sunena Parida
ABSTRACT In this communication, the synthesis (solid-state reaction) and characterization (structural, dielectric, and transport) of the CaMn0.9Ce0.1O3 ceramic (named, CMCO) are discussed. The CMCO has an orthorhombic crystal symmetry with an average crystallite size of 108.7 nm and lattice strain of 0.00375 respectively. The grains are distributed uniformly in a very compact manner so that highly dense material is formed and the ratio of average grain size to average crystallite size is about 21, which may be a possible reason for a better dielectric and conductivity mechanism. Raman's study confirms the presence of all constituent elements. The analysis of the dielectric properties suggests the presence of the Maxwell-Wagner type of dispersion. The study of impedance spectroscopy reveals how grains and grain boundaries play an important role to define conductivity mechanism and hence prove a non-Debye type of relaxation. The analysis of the resistance versus temperature plots supports NTC thermistor character.
摘要在这篇通讯中,讨论了CaMn0.9Ce0.1O3陶瓷(命名为CMCO)的合成(固态反应)和表征(结构、介电和传输)。CMCO具有正交晶体对称性,平均晶粒尺寸分别为108.7nm和0.00375的晶格应变。晶粒以非常紧凑的方式均匀分布,从而形成高度致密的材料,并且平均晶粒尺寸与平均微晶尺寸的比率约为21,这可能是具有更好的介电和导电机制的原因。拉曼的研究证实了所有组成元素的存在。对介电性质的分析表明存在Maxwell-Wagner型色散。阻抗谱的研究揭示了晶粒和晶界如何在定义导电机制方面发挥重要作用,从而证明了非德拜型弛豫。电阻与温度曲线的分析支持NTC热敏电阻的特性。
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引用次数: 0
Effect of surface treatment on the dynamics of relaxation processes in confinement: ferroelectric liquid crystal in porous Anopore membrane 表面处理对约束下铁电液晶弛豫过程动力学的影响
IF 1.6 4区 材料科学 Q3 CRYSTALLOGRAPHY Pub Date : 2023-05-19 DOI: 10.1080/01411594.2023.2212104
S. Różański
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引用次数: 0
Temperature dependent phase transition and negative thermal expansion of Hg2Cl2 compound: insights from first-principle DFT and Born-Oppenheimer on the fly molecular dynamics calculations Hg2Cl2化合物的温度相关相变和负热膨胀:第一性原理DFT和Born-Oppenheimer动态分子动力学计算的启示
IF 1.6 4区 材料科学 Q3 CRYSTALLOGRAPHY Pub Date : 2023-05-12 DOI: 10.1080/01411594.2023.2209258
S. Ghosh, Joydeep Chowdhury
ABSTRACT The paper is aimed to understand the key phonon modes that are responsible for the temperature dependent structural phase transition and negative thermal expansion of Hg2Cl2 compound for the first time with the aid of density functional theory and Born-Oppenheimer on the fly molecular dynamics calculations. The phonon dispersion spectra, phonon density of states and Grüneisen parameters for the body-centered tetragonal and base-centered orthorhombic phases of the compound have been explored in detail. The order parameter associated with the phase transition and its nature has also been reported herewith. We believe that the present study will not only help for futuristic designs of improved functionalized systems with Hg2Cl2 compound but also can augment their applications in thermoelectric conversion systems, fibre-optic communications, thermal expansion compensators and in fuel cells.
摘要本文旨在借助密度泛函理论和Born-Oppenheimer动态分子动力学计算,首次了解Hg2Cl2化合物温度相关结构相变和负热膨胀的关键声子模式。详细研究了该化合物的体心四方相和基心正交相的声子色散谱、声子态密度和Grüneisen参数。本文还报道了与相变相关的有序参数及其性质。我们相信,本研究不仅有助于Hg2Cl2化合物的改进功能化系统的未来设计,而且可以扩大其在热电转换系统、光纤通信、热膨胀补偿器和燃料电池中的应用。
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引用次数: 0
Measurement of the dynamic temperature response of electrocaloric effect in solid ferroelectric materials via thermoreflectance 用热反射法测量固体铁电材料中电热效应的动态温度响应
IF 1.6 4区 材料科学 Q3 CRYSTALLOGRAPHY Pub Date : 2023-05-06 DOI: 10.1080/01411594.2023.2206028
Layla Farhat, M. Bardoux, S. Longuemart, B. Duponchel, Ziad Herro, A. Hadj Sahraoui
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引用次数: 0
A study on Sm2O3-doped Ba(Zr0.02Ti0.98)O3 ceramics for sensor applications sm2o3掺杂Ba(Zr0.02Ti0.98)O3传感器陶瓷的研究
IF 1.6 4区 材料科学 Q3 CRYSTALLOGRAPHY Pub Date : 2023-05-04 DOI: 10.1080/01411594.2023.2205591
T. S. Thejas, B. Sahoo, P. Panda
ABSTRACT Ba(Zr0.02Ti0.98)O3 (BZT) samples with various weight percentages of Sm2O3 (0.02–0.06) were synthesized and calcined at 1100°C for 4 h. Circular pellets were prepared using calcined powders and sintered at 1450°C for 2 h. The sintered and poled samples were used for the measurement of various electrical properties. Maximum piezoelectric charge constant (d 33) of 372 pC/N obtained for 0.02 wt.% Sm2O3-doped BZT. Dielectric constant (K = 15,855) at 100 Hz was found maximum for this composition at Curie temperature (T c) of 125°C. Scanning electron microscopy (SEM) study revealed a decrease in grain size with an increase in Sm2O3 content. Largely, a lower concentration of Sm2O3-doped BZT compositions with higher d 33 could be suitable for vibration sensor and accelerometer applications.
摘要:合成了Sm2O3(0.02 ~ 0.06)质量分数不同的Ba(Zr0.02Ti0.98)O3 (BZT)样品,并在1100℃下煅烧4 h。将煅烧的粉末制成圆形球团,在1450℃下烧结2h。烧结和极化后的样品用于各种电性能的测量。对于0.02 wt.% sm2o3掺杂的BZT,获得了372 pC/N的最大压电电荷常数(d33)。在居里温度(T c)为125℃时,该成分在100 Hz时的介电常数(K = 15,855)最大。扫描电镜(SEM)研究表明,随着Sm2O3含量的增加,晶粒尺寸减小。在很大程度上,较低浓度的sm2o3掺杂BZT组合物具有较高的d33可以适用于振动传感器和加速度计的应用。
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引用次数: 0
Tricritical behavior of the smectic-hexatic phase transitions in binary mixtures using the landau mean field theory 用landau平均场理论研究二元混合物中近晶六方相变的三临界行为
IF 1.6 4区 材料科学 Q3 CRYSTALLOGRAPHY Pub Date : 2023-04-28 DOI: 10.1080/01411594.2023.2203395
H. Yurtseven, E. Kilit Dogan
ABSTRACT The smectic-hexatic phase transitions are studied by the Landau mean field theory in binary mixtures, particularly, THI-14 + MPR-6 liquid crystalline system. By considering the phase lines of SmA-Hex B, SmC-SmF (Hex F) and SmF-Hex B as the first order; SmA-SmC and SmC-SmF as the second order, in the presence of the two tricritical points (C-F-B and A-C-B), we calculate the T-X phase diagram of the binary mixture studied. The phase line equations obtained from the free energies of the smectic and hexatic phases, are fitted to the experimental data given in the literature. We find that the Landau mean field theory explains satisfactorily the observed T-X phase diagram for the smectic-hexatic transitions in the binary mixture of THI-14 + MPR-6.
用朗道平均场理论研究了二元混合物,特别是ti -14 + MPR-6液晶体系的近六相相变。通过考虑SmA-Hex B、SmC-SmF (Hex F)和SmF-Hex B的一阶相线;在两个三临界点(C-F-B和A-C-B)存在的情况下,我们计算了所研究二元混合物的T-X相图。由近晶相和六晶相的自由能得到的相线方程与文献中给出的实验数据拟合。我们发现朗道平均场理论很好地解释了ti -14 + MPR-6二元混合物中近六态转变的T-X相图。
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引用次数: 0
Detection of two magnetocaloric consecutive peaks in HoCo2 HoCo2中两个磁热连续峰的检测
IF 1.6 4区 材料科学 Q3 CRYSTALLOGRAPHY Pub Date : 2023-04-28 DOI: 10.1080/01411594.2023.2203394
M. A. Hamad, H. Alamri, S. M. Elghnam, S. Badawy
ABSTRACT To simulate the magnetocaloric effect (MCE) of a HoCo2 sample, a phenomenological model (PM) is used. MCE parameters are inferred from PM as the result of modelling for magnetization vs. temperature in 0.5 T. The HoCo2 exhibits two consecutive conventional MCEs with cooling via adiabatic demagnetization. HoCo2 exhibits double peak MCE behaviour. It is recommended that HoCo2 use it as a useful MR material over a temperature range spanning a significant temperature range of 0–140 K. Consequently, HoCo2 is appealing for MR because its MCE spans a wide temperature range, particularly liquefaction of nitrogen and hydrogen.
摘要为了模拟HoCo2样品的磁热效应,使用了一个唯象模型(PM)。MCE参数是从PM中推断出来的,作为0.5中磁化强度与温度的建模结果 T.HoCo2表现出两个连续的传统MCE,通过绝热消磁进行冷却。HoCo2表现出双峰MCE行为。建议HoCo2在0–140的显著温度范围内将其用作有用的MR材料 K.因此,HoCo2对MR很有吸引力,因为它的MCE跨越宽的温度范围,特别是氮和氢的液化。
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引用次数: 0
期刊
Phase Transitions
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