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Low-cost nebulizer spray deposited conduction mechanism of thin film ZnO nanoparticles 低成本喷雾沉积ZnO纳米薄膜的导电机理
IF 1 4区 材料科学 Pub Date : 2023-01-01 DOI: 10.15251/jor.2023.191.53
B. Amudhavalli, R. Mariappan, M. Prasath
The Zinc Oxide (ZnO) thin films have been deposited on glass substrate at different temperature from 300 to 500 o C by nebulizer spray pyrolysis technique. The prepared films were characterized by X-Ray diffraction (XRD), High resolution scanning electron microscope (HRSEM), Energy dispersive analysis by X-rays (EDAX), Photoluminescence (PL), UV-Vis-NIR spectrometer and impedance spectroscopy, respectively. The XRD confirms that the films are polycrystalline in nature with hexagonal wurtzite crystal structure with (002) plane as preferential orientation. The various parameters such as crystallite size, micro strain, and dislocation density were calculated from X-ray diffraction. HR-SEM images show smooth, tiny grains and dense morphology. The PL studies exhibits two emission peaks one at 389 nm corresponding to band gap excitonic emission and another located at 490 nm due to the presence of singly ionized oxygen vacancies. The UV-Vis-NIR spectrometer confirms the possibility of good transparent ZnO films with an average transmission of about ~85-95% in the visible region and optical band gap shifted from 3.37 eV to 3.2 eV with increase in temperature and which is supported by PL study. The semiconductor bahaviour and activation energy of these films have been confirmed by impedance spectroscopy measurements.
采用喷雾热解技术,在300~500℃的不同温度下,在玻璃衬底上沉积了氧化锌(ZnO)薄膜。分别用X射线衍射(XRD)、高分辨率扫描电子显微镜(HRSEM)、X射线能量色散分析(EDAX)、光致发光(PL)、紫外-可见-近红外光谱仪和阻抗谱对制备的薄膜进行了表征。XRD结果表明,该薄膜为多晶,具有以(002)面为优先取向的六方纤锌矿晶体结构。通过X射线衍射计算了晶粒尺寸、微应变和位错密度等各种参数。HR-SEM图像显示出光滑、微小的晶粒和致密的形态。PL研究显示出两个发射峰,一个在389 nm对应于带隙激子发射,另一个位于490 nm,这是由于存在单电离的氧空位。UV-Vis-NIR光谱仪证实了良好透明ZnO薄膜的可能性,其在可见光区域的平均透射率约为85-95%,并且随着温度的升高,光学带隙从3.37eV移动到3.2eV,这得到了PL研究的支持。这些薄膜的半导体特性和活化能已通过阻抗谱测量得到证实。
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引用次数: 1
Structure and opto-electronic properties of MgO nanocrystals calculated by GGA approximation 用GGA近似计算MgO纳米晶体的结构和光电性质
IF 1 4区 材料科学 Pub Date : 2023-01-01 DOI: 10.15251/jor.2023.193.265
M. Myvizhi, K. Satheesh kumar, P. Kavitha, P. Selvakumar
This study uses the CASTEP code and the density functional theory (DFT) to look into the structure, electrical properties, and optical properties of MgO. The generalised gradient approximation (GGA-PW91 approximation) was used to measure both the energy of the band gap and the energy of the exchange-correlation. This computation was done based on the cubic MgO crystal structure, which has a space group of Fm-3m and a 3x3x3 supercell. In structural optimization, the results that are expected for the lattice constant and the bulk modulus elastic constant are very close to known experiments and theories. The anticipated direct band gap of 4.283eV at the G point is in excellent agreement with the results of the tests. Also, the total (DOS) and partial (PDOS) densities of states have been measured, and the results of the absorption coefficient have been looked at in terms of the different energies of the phonons that hit the material.
本研究使用CASTEP代码和密度泛函理论(DFT)研究了MgO的结构、电学性质和光学性质。采用广义梯度近似(GGA-PW91近似)测量带隙能量和交换相关能量。该计算是基于立方MgO晶体结构进行的,该结构具有Fm-3m空间群和3x3x3超级单体。在结构优化中,晶格常数和体模量弹性常数的预期结果与已知的实验和理论非常接近。预期的G点直接带隙为4.283eV,与测试结果非常吻合。此外,还测量了态的总密度(DOS)和部分密度(PDOS),并根据撞击材料的声子的不同能量来观察吸收系数的结果。
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引用次数: 0
Investigations on the synthesis and growth and structural, spectral, optical, mechanical and thermal properties of non-linear optical single crystals of Bis-L-Seriniumoxalate Dihydrate (BLSOD) 双-l -草酸丝氨酸二水合物(BLSOD)非线性光学单晶的合成、生长及结构、光谱、光学、力学和热性能研究
IF 1 4区 材料科学 Pub Date : 2023-01-01 DOI: 10.15251/jor.2023.191.43
A. M. Hidayathullah, R. S. Samuel, V. Chithambaram, Raja Raghavan, S. Janarthanan
From the raw materials L-Serine and oxalic acid, the product Bis-LSeriniumoxalatedehydrate(BLSOD) was created. By using a slow evaporation process, the individual BLSOD crystals were produced from aqueous solution. According to single crystal X-ray Diffraction investigations, the structure of the produced crystal is monoclinic. The existence of different functional groups and the chemical environment present in the synthesised material were qualitatively determined through the use of Fourier Transform Infra-Red (FTIR) and proton nuclear magnetic resonance (H1NMR) spectrum studies. The crystal's transparency in the visible and near-infra-red areas was confirmed by UV-Visible-Near infrared and photoluminescence spectrum tests, which also looked at the material's viability for device construction. To determine the crystal's machinability, the mechanical properties of the material were carefully examined using Vicker's hardness research. Thermal investigations such as Thermo gravimetric (TGA) and Differential thermal analysis (DTA) have shown the thermal stability of BLSOD and the phases of weight losses. As a function of frequency and temperature, the dielectric constant and dielectric loss of grown crystals were determined. The Kurtz-Perry powder test was used to check both the second harmonic generation (SHG) and then the NLO property of the material.
以l -丝氨酸和草酸为原料,制备了双- l -丝氨酸-草酸脱水剂(BLSOD)。通过缓慢的蒸发过程,从水溶液中产生单个BLSOD晶体。根据单晶x射线衍射研究,所得晶体为单斜晶结构。通过使用傅里叶变换红外(FTIR)和质子核磁共振(H1NMR)光谱研究,定性地确定了合成材料中不同官能团的存在和化学环境。该晶体在可见光和近红外区域的透明度通过紫外-可见-近红外和光致发光光谱测试得到证实,该测试还考察了该材料在器件构建中的可行性。为了确定晶体的可加工性,使用维氏硬度研究仔细检查了材料的机械性能。热重分析(TGA)和差热分析(DTA)等热研究表明了BLSOD的热稳定性和失重阶段。作为频率和温度的函数,测定了生长晶体的介电常数和介电损耗。采用Kurtz-Perry粉末试验对材料的二次谐波产生(SHG)和NLO性能进行了检测。
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引用次数: 0
Preparation and characterization of ferrous manganese thin films for magnetic storage devices 磁存储器件用锰铁薄膜的制备与表征
IF 1 4区 材料科学 Pub Date : 2023-01-01 DOI: 10.15251/jor.2023.191.73
A. Poongodi, N. Thangaraj, M. Sudha
The nanocrystalline nature of Ferrous Manganese (Fe-Mn) thin film coatings was obtained from sulphate baths at different current densities on the copper substrate. The effects of current density on structure, surface morphology, elemental composition, magnetic properties, and mechanical properties of electrodeposited Fe-Mn magnetic films were studied. The structural and surface properties of Fe-Mn thin films were studied using an Xray Diffractometer (XRD) and Scanning Electron Microscopy (SEM). The chemical compositions of the deposited films were investigated using Energy Dispersive X-ray Spectroscopy (EDAX). The magnetic properties of the thin films were studied with the aid of a Vibrating Sample Magnetometer (VSM). The electrodeposited Fe-Mn films were found to be nanocrystalline in nature due to the increase in current density. The deposits of Fe-Mn thin films were found to have a crack-free and smooth surface at low current densities. The films have good adherence to the copper substrate.
采用不同电流密度的硫酸盐浴在铜基体上制备了锰铁(Fe-Mn)薄膜涂层。研究了电流密度对电沉积铁锰磁性薄膜的结构、表面形貌、元素组成、磁性能和力学性能的影响。利用x射线衍射仪(XRD)和扫描电子显微镜(SEM)研究了Fe-Mn薄膜的结构和表面性能。利用能量色散x射线光谱(EDAX)研究了沉积膜的化学成分。利用振动样品磁强计(VSM)研究了薄膜的磁性能。随着电流密度的增大,电沉积的Fe-Mn薄膜呈纳米晶状。在低电流密度下,Fe-Mn薄膜具有光滑无裂纹的表面。薄膜与铜衬底有良好的附着力。
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引用次数: 0
Mechanical, structural and optical properties of pristine and PVA capped zinc oxide nanocomposites 原始和PVA包覆的氧化锌纳米复合材料的机械、结构和光学性能
IF 1 4区 材料科学 Pub Date : 2023-01-01 DOI: 10.15251/jor.2023.191.23
P. Gopinath, P. Suresh, V. Jeevanantham
Zinc oxide (ZnO) and Poly vinyl alcohol capped zinc oxide (PVA-ZnO) of different concentrations were synthesized by precipitation method. PVA capped ZnO nanoparticles were examined to study the influence of ZnO nanoparticles on PVA as it possesses various properties such as mechanical, structural and optical. The synthesized nanoparticles were analyzed using XRD, FTIR, UV-Vis, SEM EDAX techniques. In the FTIR spectrum, the peak observed at 559 cm−1 indicates M–O stretching in the samples which specifies the interaction of ZnO with PVA matrix. The XRD patterns confirmed the presence of ZnO nanoparticles and the size of the ZnO nanoparticles and PVA- ZnO NPs were 76 nm and 61 nm. The uniform dispersion of ZnO nanoparticles as well as the interaction of nanoparticles with the PVA matrix were also observed in SEM analysis and the purity of NPs was determined from EDS analysis. The UV-vis spectra show the light absorption behavior of the ZnO NPs and ZnO-PVA nanocomposites and they exhibited high absorption in the UV region. The mechanical properties such as tensile strength and elongation were also analyzed for the synthesized samples.
采用沉淀法合成了不同浓度的氧化锌(ZnO)和聚乙烯醇包覆氧化锌(PVA-ZnO)。由于ZnO纳米粒子具有力学、结构和光学等多种性能,因此研究了ZnO纳米粒子对PVA的影响。采用XRD、FTIR、UV-Vis、SEM、EDAX等技术对合成的纳米颗粒进行了分析。在FTIR光谱中,在559 cm−1处观察到的峰表示样品中的M-O拉伸,这表明ZnO与PVA基体的相互作用。XRD谱图证实了ZnO纳米粒子的存在,ZnO纳米粒子和PVA- ZnO纳米粒子的尺寸分别为76 nm和61 nm。SEM分析观察到ZnO纳米粒子的均匀分散以及纳米粒子与PVA基体的相互作用,EDS分析确定了纳米粒子的纯度。紫外-可见光谱显示ZnO NPs和ZnO- pva纳米复合材料的光吸收行为,在紫外区表现出较高的吸收。对合成样品的抗拉强度和伸长率等力学性能进行了分析。
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引用次数: 1
Effect of thickness on the physical characterization of sprayed ZnO thin films 厚度对喷涂ZnO薄膜物理特性的影响
IF 1 4区 材料科学 Pub Date : 2023-01-01 DOI: 10.15251/jor.2023.193.275
H. Saleh, J. M. Hussein, D. E. Alkateb, N. Habubi, F. S. Ahmed, S. Chiad
ZnO thin films having different thicknesses (300, 400 and 500) nm were deposited by spray pyrolysis method (SPM). XRD analysis indicate that the deposited films have hexagonal wurtzite structure and display a strong peak at (002) plane. The effects of thicknesses on crystallite size, stress and strain are investigated. The thicknesses effect on film surface topography parameters such as roughness, particle size and Root mean square of grains are calculated. Atomic Force Microscopy (AFM) confirm that the distribution grains size appears nanostructure and homogeneous in all films. RMS increases from 1.54 nm to 3.98 nm with thicknesses 500 nm. The surface roughness increases from 1.33 nm to 3.30 nm. Transmittance was detecting to be atop 80% in visible region. The bandgap energy increased from 2.83 eV to 3.75 eV with thickness elevation.
采用喷雾热解法(SPM)制备了不同厚度(300、400和500)nm的ZnO薄膜。XRD分析表明,沉积膜具有六方纤锌矿结构,在(002)面有一个强峰。研究了厚度对晶粒尺寸、应力和应变的影响。计算了厚度对薄膜表面形貌参数粗糙度、晶粒尺寸和晶粒均方根的影响。原子力显微镜(AFM)证实,所有薄膜的晶粒尺寸均呈纳米结构和均匀分布。厚度为500 nm时,RMS从1.54 nm增加到3.98 nm。表面粗糙度由1.33 nm增加到3.30 nm。可见光区透光率达80%以上。随着厚度的增加,带隙能量从2.83 eV增加到3.75 eV。
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引用次数: 0
Magento optical properties and structure of tellurite glasses modified by alkaline ions 碱性离子改性碲酸盐玻璃的Magento光学性质和结构
IF 1 4区 材料科学 Pub Date : 2022-12-20 DOI: 10.15251/jor.2022.186.805
A. M. Al-Syadi, M. Alfarh, H. Algarni, M. Alqahtani, M. Reben, H. Afifi, E. Yousef
In this paper we prepared glasses with composition (75-x)TeO2–5Nb2O5–20ZnO–xNa2O mol%, (x = 7, 10, 15, and 18) were synthesized by using the conventional quench-melting method. The Faraday effect has been investigated as well as the structure of these glasses was analyzed by Raman spectroscopy. It can observe that when the Na2O concentration increased from 7 to 18 mol%, the value of the Verdet constant decreased from 0.113 to 0.071 min/G.cm. This result can be interpreted as the following: when adding Na2O into the glass matrix, leads to the attendance of non-bridging oxygens (NBO). The peak (d) in the range of 717–721 cm−1 is related to the stretching vibrations of Te˗O˗ and Te=O bonds containing nonbridging oxygen in TeO3 (tp) phase.
在本文中,我们制备了成分为(75-x)TeO2–5Nb2O5–20ZnO–xNa2O mol%(x=7、10、15和18)的玻璃。研究了法拉第效应,并用拉曼光谱分析了这些玻璃的结构。可以观察到,当Na2O浓度从7mol%增加到18mol%时,Verdet常数的值从0.113min/G.cm降低到0.071min/G.cm。这一结果可以解释为:当向玻璃基质中添加Na2O时,导致非桥接氧(NBO)的存在。717–721 cm−1范围内的峰值(d)与TeO3(tp)相中含有非桥氧的Te-O键和Te=O键的拉伸振动有关。
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引用次数: 0
A first-principles investigation into the electronic characteristics of phase changes in ZnO at high pressures ZnO高压相变电子特性的第一性原理研究
IF 1 4区 材料科学 Pub Date : 2022-12-20 DOI: 10.15251/jor.2022.186.797
Y. Benkrima, M. E. Soudani, D. Belfennache, H. Bouguettaia, A. Souigat
The current study focuses on the effect of pressure on zinc oxide, ZnO, which is considered an essential element in several fields. In this research, the method of calculation has been used from the commencement to find the ZnO compound's structural and electrical characteristics at various pressure levels. It is found that the obtained results related to the crystal structure of the compound with phase (B4) Wurtzite agree well with previous theoretical and experimental findings. In addition, the electronic properties showed that ZnO has a direct gap of 0.68 eV, and the density of states showed that the3d position of the zinc atom significantly contributed to building the density of the electronic states of the compound, followed by the P-terminal of the oxygen atom. As it became clear to us that changing the pressure applied to the oxide ZnO increases the value of its energy gap, while the pressure value of 13.38 GPa is the crystal transition point from phase (B4) to (B1).
目前的研究重点是压力对氧化锌(ZnO)的影响,氧化锌被认为是许多领域的必需元素。在本研究中,我们从一开始就采用计算的方法来计算ZnO化合物在不同压力水平下的结构和电学特性。结果表明,所得的有关(B4)纤锌矿相化合物晶体结构的结果与前人的理论和实验结果吻合较好。此外,电子性质表明ZnO的直接间隙为0.68 eV,态密度表明锌原子的三维位置对化合物电子态密度的建立有显著的贡献,其次是氧原子的p端。我们发现,施加在氧化锌上的压力增加了氧化锌的能隙值,而13.38 GPa的压力值是晶体从(B4)相到(B1)相的转变点。
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引用次数: 0
Electrical characteristics and conductive mechanisms of AlN-based memristive devices AlN基忆阻器件的电学特性和导电机理
IF 1 4区 材料科学 Pub Date : 2022-12-20 DOI: 10.15251/jor.2022.186.815
J. Wen, W. Hua, Q. Gong, B. Wang
Aluminum nitride (AlN) memristive devices have attracted a great deal of attention because of their compatibility with the CMOS fabrication technology, and more likely to be extended to power electronic devices. However, the conductive mechanism and the variability of resistance switching (RS) parameters are major issues for commercial applications. In this paper, we have obtained electrical characteristics of the Al/AlN/Pt memristors under the current compliance limits of 1 𝜇𝜇𝜇𝜇 and 10 𝜇𝜇𝜇𝜇, respectively. Furthermore, the statistics of switching parameters has been done in the Set and Reset processes. Finally, a quantum point contact model has been developed to account for conducting mechanisms and shows the evolution of the conductive filament during RS transitions.
氮化铝(AlN)忆阻器件因其与CMOS制造技术的兼容性而备受关注,更有可能扩展到电力电子器件中。然而,导电机制和电阻开关(RS)参数的可变性是商业应用的主要问题。在这篇文章中,我们已获得Al / AlN / Pt记忆电阻器的电特性在当前合规限制1𝜇𝜇𝜇𝜇和10𝜇𝜇𝜇𝜇,分别。在此基础上,对Set和Reset过程中的开关参数进行了统计。最后,开发了一个量子点接触模型来解释导电机制,并显示了导电丝在RS过渡期间的演变。
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引用次数: 0
Structural, elastic, optical and thermodynamic properties of CdGeP2 from theoretical prediction 理论预测CdGeP2的结构、弹性、光学和热力学性质
IF 1 4区 材料科学 Pub Date : 2022-12-20 DOI: 10.15251/jor.2022.186.781
S. R. Zhang, Z. Zhu, H. Hou, L. Xie
We have studied the structural, elastic anisotropy, electronic properties and optical properties of CdGeP2 crystal by using first-principles method. The effect of pressure on the elastic constants of CdGeP2 was explored. The changes in the anisotropy of the CdGeP2 at different pressures were analyzed in detail by three-dimensional (3D) and 2D projections of bulk modulus and Young's modulus. The electronic properties, including the band structure, density of states, were investigated, and it turned out that CdGeP2 is a semiconductor. Furthermore, we analyze the dielectric function, refractive index, extinction coefficient, absorption coefficient, and electrical conductivity of CdGeP2 in detail. Finally, the influence laws of temperature and pressure on Debye temperature, heat capacity and Grüneisen parameter are obtained, respectively
用第一性原理方法研究了CdGeP2晶体的结构、弹性各向异性、电子性质和光学性质。探讨了压力对CdGeP2弹性常数的影响。通过体模量和杨氏模量的三维和二维投影,详细分析了不同压力下CdGeP2各向异性的变化。研究了CdGeP2的电子特性,包括能带结构、态密度,结果表明CdGeP2是半导体。此外,我们还详细分析了CdGeP2的介电函数、折射率、消光系数、吸收系数和电导率。最后,得到了温度和压力分别对德拜温度、热容和格力尼森参数的影响规律
{"title":"Structural, elastic, optical and thermodynamic properties of CdGeP2 from theoretical prediction","authors":"S. R. Zhang, Z. Zhu, H. Hou, L. Xie","doi":"10.15251/jor.2022.186.781","DOIUrl":"https://doi.org/10.15251/jor.2022.186.781","url":null,"abstract":"We have studied the structural, elastic anisotropy, electronic properties and optical properties of CdGeP2 crystal by using first-principles method. The effect of pressure on the elastic constants of CdGeP2 was explored. The changes in the anisotropy of the CdGeP2 at different pressures were analyzed in detail by three-dimensional (3D) and 2D projections of bulk modulus and Young's modulus. The electronic properties, including the band structure, density of states, were investigated, and it turned out that CdGeP2 is a semiconductor. Furthermore, we analyze the dielectric function, refractive index, extinction coefficient, absorption coefficient, and electrical conductivity of CdGeP2 in detail. Finally, the influence laws of temperature and pressure on Debye temperature, heat capacity and Grüneisen parameter are obtained, respectively","PeriodicalId":54394,"journal":{"name":"Journal of Ovonic Research","volume":" ","pages":""},"PeriodicalIF":1.0,"publicationDate":"2022-12-20","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"47273735","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
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Journal of Ovonic Research
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