Electric controlling of surface metal-insulator transition in the doped BaTiO3 film

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Wei Xun

2017-07-01

Full Text Available Based on first-principles calculations, the BaTiO3(BTO film with local La-doping is studied. For a selected concentration and position of doping, the surface metal-insulator transition occurs under the applied electric field, and the domain appears near the surface for both bipolar states. Furthermore, for the insulated surface state, i.e., the downward polarization state in the doped film, the gradient bandgap structure is achieved, which favors the absorption of solar energy. Our investigation can provide an alternative avenue in modification of surface property and surface screening effect in polar materials.

Electrical properties of (1 0 0)-predominant BaTiO3 films derived from alkoxide solutions of two concentrations

International Nuclear Information System (INIS)

Guo Yiping; Suzuki, Kazuyuki; Nishizawa, Kaori; Miki, Takeshi; Kato, Kazumi

2006-01-01

Lead-free piezoelectric films with thickness larger than 1 μm integrated on silicon substrates have been receiving considerable attention because of environmental concerns and their potential applications in microelectromechanical systems. We demonstrate that, by chemical solution deposition, it is possible to process (1 0 0)-predominant 1 μm BaTiO 3 films on LaNiO 3 /Pt/TiO x /SiO 2 /Si substrates using thinner high-crystallinity columnar BaTiO 3 films as buffer layers. We point out that this kind of buffer layer prepared with a lower concentration solution on the surface of an LaNiO 3 /Pt electrode is effective in enhancing the crystallinity and orientation degree of final BaTiO 3 films prepared with a higher concentration solution. The 1 μm BaTiO 3 films show good dielectric and insulating characteristics against an applied field, and the conduction current shows Schottky emission behavior at modest voltage and space-charge-limited behavior at higher voltage. We also demonstrate that the (1 0 0)-predominant 1 μm BaTiO 3 films have excellent piezoelectric properties: piezoelectric coefficients d 33 higher than 50 pm/V have been determined for the bare films using atomic force microscopy, which are comparable to those of Pb(Zr,Ti)O 3 films. These results indicate that the (1 0 0)-predominant BaTiO 3 films should be promising candidates for microelectromechanical systems applications

Synthesis and characterization of BaTiO3 ferroelectric material

International Nuclear Information System (INIS)

Osman, K.I.

2011-01-01

BaTiO 3 powder was prepared at low temperatures using the solid-state reaction, starting with two different precursors; the BaCO 3 /TiO 2 and the Ba(NO 3 ) 2 /TiO 2 powder mixtures. It was found that, a single phase BaTiO 3 was formed after calcination at 750 degree C for 10 h and at 600 degree C for 6 h for the first and second mixtures, respectively. Thermal and XRD analyses were used to study the formation kinetics of BaTiO 3 . Contracting volume reaction model was found to control both reactions. The SEM of the as milled powder, TMA, TG and thermodynamics analysis have been used to propose a realistic approach describing the reaction mechanism of BaTiO 3 . Characterization and the dielectric properties of the sintered BaTiO 3 were investigated. The relative permittivity and the dielectric loss measured at room temperature and at 1 khz were 2028.5 and 0.043 for BaTiO 3 prepared from BaCO 3 /TiO 2 , while they were 1805.33 and 0.41 for BaTiO 3 prepared from Ba(NO 3 ) 2 /TiO 2 .

Aggregate linear properties of ferroelectric ceramics and polycrystalline thin films: Calculation by the method of effective piezoelectric medium

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Pertsev, N. A.; Zembilgotov, A. G.; Waser, R.

1998-08-01

The effective dielectric, piezoelectric, and elastic constants of polycrystalline ferroelectric materials are calculated from single-crystal data by an advanced method of effective medium, which takes into account the piezoelectric interactions between grains in full measure. For bulk BaTiO3 and PbTiO3 polarized ceramics, the dependences of material constants on the remanent polarization are reported. Dielectric and elastic constants are computed also for unpolarized c- and a-textured ferroelectric thin films deposited on cubic or amorphous substrates. It is found that the dielectric properties of BaTiO3 and PbTiO3 polycrystalline thin films strongly depend on the type of crystal texture. The influence of two-dimensional clamping by the substrate on the dielectric and piezoelectric responses of polarized films is described quantitatively and shown to be especially important for the piezoelectric charge coefficient of BaTiO3 films.

Fabrication of BaTiO3/Ni composite particles and their electro-magneto responsive properties

International Nuclear Information System (INIS)

Lu, Yaping; Gao, Lingxiang; Wang, Lijuan; Xie, Zunyuan; Gao, Meixiang; Zhang, Weiqiang

2017-01-01

Graphical abstract: The spherical BaTiO 3 /Ni particles with excellent structure were made by one-step method through fixing the metal Ni(0) reduced by a specific reducing agent (N 2 H 4 ·H 2 O) on the surface of the BaTiO 3 particles with grain diameter of ∼500 nm. BaTiO 3 /Ni particle has double responses of electric and magnetic field simultaneously. Consequentially, coating magnetic metal on BT particle is proposed an effective method to prepare novel electro-magneto responsive particles and one basis of electro-magneto responsive elastomers. - Highlights: • The BaTiO 3 /Ni composite particles were fabricated. • The content of Ni(0) in nickel sheath is 70.2%. • The BaTiO 3 /Ni particles have double responses of electric and magnetic field. - Abstract: BaTiO 3 (BT)/Ni composite particles were made by one-step method through agglomerating the metal Ni(0) nanoparticles reduced by a specific reducing agent (N 2 H 4 ·H 2 O) on the surface of BT sphere with diameter of ∼500 nm. The BT/Ni composite particles were characterized by the means of scanning electron microscope (SEM), transmission electron microscopy (TEM), X-ray diffractometer (XRD) and X-ray photoelectron spectroscopy (XPS). In BT/Ni particles, pure BT spherical particle was coated with Ni nanoparticles agglomerated on its surface. The average thickness of the Ni sheath was ∼30 nm and the content of Ni(0) and Ni (II) in the sheath were 70.2% and 29.8%, respectively. The responsive effects of BT/Ni particles filled in hydrogel elastomer were investigated by the viscoelastic properties. The results indicate that the BT/Ni particles exhibit electro and magneto coordinated responsive properties (E = 1 kV/mm, H = 0.1 T/mm), which is superior to BT particles with individual electro response.

Crystal structure, dielectric, ferroelectric and energy storage properties of La-doped BaTiO3 semiconducting ceramics

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Venkata Sreenivas Puli

2015-09-01

Full Text Available Polycrystalline La-doped BaTiO3 (Ba(1-xLax\tTiO3 [x=0,0.0005,0.001,0.003] ceramics (denoted as BTO,BLT1,BLT2,BLT3 were synthesized by conventional solid-state reaction method and characterized by X-ray diffraction (XRD, scanning electron microscopy (SEM, and Raman spectroscopy. XRD and Raman spectra revealed single-phase tetragonal perovskite crystalline structure. Well-saturated polarization–electric field (P–E hysteresis loops were observed with the measurement frequency of 50 Hz at room temperature and confirmed ferroelectric nature of these ceramics and a high recoverable electrical energy storage density of 0.350 J/cm3 with energy efficiency (n∼9%, which is useful in energy storage capacitor applications. Dielectric studies revealed anomalies around 415–420 K and near the Curie temperature. The latter is attributed to the ferroelectric to paraelectric phase transition. Better dielectric performances were obtained for La-doped samples sintered at 1350°C for 4 h. Grain growth is inhibited with lanthanum (La incorporation into the BTO lattice. Room temperature semiconducting behavior with positive temperature coefficient of resistivity (PTCR behavior at TC is attributed to electron compensation mechanism.

Ab Initio Calculations for the BaTiO3 (001) Surface Structure

Institute of Scientific and Technical Information of China (English)

XUE Xu-Yan; WANG Chun-Lei; ZHONG Wei-Lie

2004-01-01

@@ The ab initio method within the local density approximation is applied to calculate cubic BaTiO3 (001) surface relaxation and rumpling for two different terminations (BaO and TiO2). Our calculations demonstrate that cubic perovskite BaTiO3 crystals possess surface polarization, accompanied by the presence of the relevant electric field.We analyse their electronic structures (band structure, density of states and the electronic density redistribution with emphasis on the covalency effects). The results are also compared with that of the previous ab initio calculations. Considerable increases of Ti-O chemical bond covalency nearby the surface have been observed.The band gap reduces especially for the TiO2 termination.

Síntesis de polvos de BaTiO3 por mecanoquímica

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Villaquirán Raigoza, C. F.

2002-02-01

Full Text Available The barium titanato, BaTiO3, is one of the electronic ceramics with more history of technological application in the industry of the ceramic capacitores. The actual technological demands, and the high quality required for the electronic devices, have driven to new alternatives of prosecution of these materials and to optimize the traditional techniques of raw materials synthesis it prevails. An alternative synthesis is to use the mechanical energy to modify the physiochemical properties of the dispersed system and to favor the obtaining of powders of BaTiO3. In this work the results are indicated obtained when using mechanical activation, physicochemistry, in the obtaining of the BaTiO3. It has been analyzed the effect of the time of mill and the nature of the precursor of the titanium on the transformation of phases in the samples during the thermal treatment to that are subjected. X-ray diffraction, DRX, was used to study the phases evolution and infrared spectroscopy, FTIR, to determine the functional groups present in the samples.El titanato de bario, BaTiO3, es uno de los cerámicos electrónicos con mayor historia de aplicación tecnológica en la industria de los capacitores cerámicos. Las demandas tecnológicas actuales, y la alta calidad requerida para los dispositivos electrónicos, han conducido a nuevas alternativas de procesamiento de estos materiales y a optimizar las técnicas tradicionales de síntesis de materia prima. Una alternativa de síntesis es utilizar la energía mecánica para modificar las propiedades fisicoquímicas del sistema disperso y favorecer la obtención de polvos de BaTiO3. En este trabajo se indican los resultados obtenidos al utilizar activación mecánica, mecanoquímica, en la obtención del BaTiO3. Se ha analizado el efecto del tiempo de molienda y la naturaleza del precursor del titanio sobre la transformación de fases que experimentan las muestras durante el tratamiento térmico a que son sometidas

Wet routes of high purity BaTiO3 nanopowders

International Nuclear Information System (INIS)

Wang Liqiu; Liu Liang; Xue Dongfeng; Kang Hongmin; Liu Changhou

2007-01-01

High purity BaTiO 3 nanopowders were prepared in wet routes through stearic acid gel (SAG) and acetic acid gel (AAG) techniques, respectively. BaTiO 3 samples were characterized by X-ray diffraction, transmission electron microscope, Fourier transform infrared spectrometry, X-ray fluorescence spectrometry, and thermal gravimetric analysis. The present results indicate that both methods have a similar reaction process during calcination, while BaTiO 3 crystallites were initially formed at 550 deg. C by SAG and 800 deg. C by AAG. Both methods could produce BaTiO 3 powders with a cubic perovskite structure, while they had different grain size distributions within 25-50 nm for SAG and 50-80 nm for AAG. BaTiO 3 samples prepared by SAG had a lower agglomeration than those by AAG. SAG has shown many distinctive advantages in the preparation of high purity BaTiO 3 nanopowders, without Ba and Ti losses and hazardous wastes

Dielectric enhancement of BaTiO3/SrTiO3 superlattices with embedded Ni nanocrystals

International Nuclear Information System (INIS)

Xiong Zhengwei; Sun Weiguo; Wang Xuemin; Jiang Fan; Wu Weidong

2012-01-01

Highlights: ► The BaTiO 3 /SrTiO 3 superlattices with embedded Ni NCs were successfully fabricated by L-MBE. ► The influence with the various concentrations of Ni nanocrystals embedded in BaTiO 3 /SrTiO 3 superlattices was also discussed. ► The BaTiO 3 /SrTiO 3 superlattices with lower concentration of embedded Ni NCs had higher permittivity and dielectric loss compared with the pure BaTiO 3 /SrTiO 3 superlattices. ► The dielectric enhancement of BaTiO 3 /SrTiO 3 superlattices with embedded Ni NCs was proposed to explained by Drude quasi-free-electron theory. - Abstract: The self-organized Ni nanocrystals (NCs) were embedded in BaTiO 3 /SrTiO 3 superlattices using laser molecular beam epitaxy (L-MBE). The stress of the composite films was increased with the increasing concentration of embedded Ni NCs, as investigation in stress calculation. The influence with the various concentrations of Ni NCs embedded in BaTiO 3 /SrTiO 3 superlattices was also discussed. The internal stress of the films was too strong to epitaxial growth of BaTiO 3 /SrTiO 3 superlattices. Compared with the pure BaTiO 3 /SrTiO 3 superlattices, the BaTiO 3 /SrTiO 3 superlattices with lower concentration of embedded Ni NCs had higher permittivity and dielectric loss. Furthermore, the dielectric enhancement of BaTiO 3 /SrTiO 3 superlattices with embedded Ni NCs was proposed to explained by Drude quasi-free-electron theory.

Decorating TiO2 Nanowires with BaTiO3 Nanoparticles: A New Approach Leading to Substantially Enhanced Energy Storage Capability of High-k Polymer Nanocomposites.

Science.gov (United States)

Kang, Da; Wang, Guanyao; Huang, Yanhui; Jiang, Pingkai; Huang, Xingyi

2018-01-31

The urgent demand of high energy density and high power density devices has triggered significant interest in high dielectric constant (high-k) flexible nanocomposites comprising dielectric polymer and high-k inorganic nanofiller. However, the large electrical mismatch between polymer and nanofiller usually leads to earlier electric failure of the nanocomposites, resulting in an undesirable decrease of electrical energy storage capability. A few studies show that the introduction of moderate-k shell onto a high-k nanofiller surface can decrease the dielectric constant mismatch, and thus, the corresponding nanocomposites can withstand high electric field. Unfortunately, the low apparent dielectric enhancement of the nanocomposites and high electrical conductivity mismatch between matrix and nanofiller still result in low energy density and low efficiency. In this study, it is demonstrated that encapsulating moderate-k nanofiller with high-k but low electrical conductivity shell is effective to significantly enhance the energy storage capability of dielectric polymer nanocomposites. Specifically, using BaTiO 3 nanoparticles encapsulated TiO 2 (BaTiO 3 @TiO 2 ) core-shell nanowires as filler, the corresponding poly(vinylidene fluoride-co-hexafluoropylene) nanocomposites exhibit superior energy storage capability in comparison with the nanocomposites filled by either BaTiO 3 or TiO 2 nanowires. The nanocomposite film with 5 wt % BaTiO 3 @TiO 2 nanowires possesses an ultrahigh discharged energy density of 9.95 J cm -3 at 500 MV m -1 , much higher than that of commercial biaxial-oriented polypropylene (BOPP) (3.56 J cm -3 at 600 MV m -1 ). This new strategy and corresponding results presented here provide new insights into the design of dielectric polymer nanocomposites with high electrical energy storage capability.

Effects of vacancies on atom displacement threshold energy calculations through Molecular Dynamics Methods in BaTiO3

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Gonzalez Lazo, Eduardo; Cruz Inclán, Carlos M.; Rodríguez Rodríguez, Arturo; Guzmán Martínez, Fernando; Abreu Alfonso, Yamiel; Piñera Hernández, Ibrahin; Leyva Fabelo, Antonio

2017-09-01

A primary approach for evaluating the influence of point defects like vacancies on atom displacement threshold energies values Td in BaTiO3 is attempted. For this purpose Molecular Dynamics Methods, MD, were applied based on previous Td calculations on an ideal tetragonal crystalline structure. It is an important issue in achieving more realistic simulations of radiation damage effects in BaTiO3 ceramic materials. It also involves irradiated samples under severe radiation damage effects due to high fluency expositions. In addition to the above mentioned atom displacement events supported by a single primary knock-on atom, PKA, a new mechanism was introduced. It corresponds to the simultaneous excitation of two close primary knock-on atoms in BaTiO3, which might take place under a high flux irradiation. Therefore, two different BaTiO3 Td MD calculation trials were accomplished. Firstly, single PKA excitations in a defective BaTiO3 tetragonal crystalline structure, consisting in a 2×2×2 BaTiO3 perovskite like super cell, were considered. It contains vacancies on Ba and O atomic positions under the requirements of electrical charge balance. Alternatively, double PKA excitations in a perfect BaTiO3 tetragonal unit cell were also simulated. On this basis, the corresponding primary knock-on atom (PKA) defect formation probability functions were calculated at principal crystal directions, and compared with the previous one we calculated and reported at an ideal BaTiO3 tetrahedral crystal structure. As a general result, a diminution of Td values arises in present calculations in comparison with those calculated for single PKA excitation in an ideal BaTiO3 crystal structure.

Ajuste teórico de las curvas PTCR de BaTiO3 dopado con niobio

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Castro, M. S.

2002-02-01

Full Text Available In this work, a theoretical fitting to the experimental PTCR effect in slightly Nb-doped BaTiO3 from the Heywang-Jonker model is simulated. Besides, a qualitative approach was used to evaluate the GBBL characteristics of strongly Nb - doped BaTiO3. In both cases, a link between the electrical properties and the defect profile developed in these based - BaTiO3 ceramics was established. From the results, good agreement between experimental and calculated results was obtained for the PTCR ceramics. Asmall increment in Nb2O5 concentration leads to an increasing in the concentration of occupied acceptor states, the energy of the surface state and also the barrier height. In these cases, microstructural observations shown an important grain growth with average grain size between 10 and 100μm. EPR results clearly indicate low concentration of cationic vacancies for these materials. This phenomenon is associated to a charge-compensation mechanism in slightly-doped BaTiO3, that result in a semiconducting behaviour. On the other hand, the electrical behaviour of strongly–doped BaTiO3 moves away from the PTCR effect, and the material becomes insulating with noticeable GBBL characteristics. In this case, microstructural observations along defect structure analysis encourage the hypothesis in which barium vacancies act as acceptor at grain boundaries and play and important role in restricting grain growth of Nb2O5-BaTiO3 ceramics.En este trabajo se determinó la influencia de la concentración de Nb2O5 sobre el comportamiento PTCR de cerámicos basados en BaTiO3. Por otra parte, se estudió el impacto de una gran concentración del dopante sobre el comportamiento GBBL del BaTiO3. En ambos casos, se estableció una relación entre las propiedades eléctricas observadas y la estructura de defectos iónicos desarrollada. La aplicación del modelo de Heywang-Jonker permite el ajuste teórico de las curvas de resistividad – temperatura de los cerámicos PTCR

Enhancement of polarization property of silane-modified BaTiO3 nanoparticles and its effect in increasing dielectric property of epoxy/BaTiO3 nanocomposites

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Thi Tuyet Mai Phan

2016-03-01

Full Text Available The surface modification of synthesized nano-BaTiO3 particles was carried out using γ-aminopropyl trimethoxy silane (γ-APS in an ethanol/water solution. The modified particles were characterized by FTIR, TGA, surface charge analysis, and by dielectric constant measurement. The silane molecules were attached to the surface of BaTiO3 particles through SiOBaTiO3 bonds. The γ-APS grafted on BaTiO3 made the dielectric constant of the particles increase at frequencies ≥0.3 kHz in a wide range of temperature (25 °C–140 °C, due to the presence of NH2 groups. The dependence of the polarization vs. electrical field was measured in order to elucidate the dielectric behavior of the silane treated BaTiO3 in comparison to untreated BaTiO3. The nanocomposite based on epoxy resin containing BaTiO3 nanoparticles untreated and treated with γ-APS was also prepared and characterized. The results indicated that the γ-APS-modified BaTiO3 surfaces significantly enhanced the dielectric property of the nanocomposite.

Growth of BaTiO3-PVDF composite thick films by using aerosol deposition

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Cho, Sung Hwan; Yoon, Young Joon

2016-01-01

Barium titanate (BaTiO3)-polyvinylidene fluoride (PVDF) composite thick films were grown by using aerosol deposition at room temperature with BaTiO3 and PVDF powders. To produce a uniform composition in ceramic and polymer composite films, which show a substantial difference in specific gravity, we used PVDF-coated BaTiO3 powders as the starting materials. An examination of the microstructure confirmed that the BaTiO3 were well distributed in the PVDF matrix in the form of a 0 - 3 compound. The crystallite size in the BaTiO3-PVDF composite thick films was 5 ˜ 50 times higher than that in pure BaTiO3 thick films. PVDF plays a role in suppressing the fragmentation of BaTiO3 powder during the aerosol deposition process and in controlling the relative permittivity.

THE APPLICATION OF STEREOLOGY METHOD FOR ESTIMATING THE NUMBER OF 3D BaTiO3 – CERAMIC GRAINS CONTACT SURFACES

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Vojislav V Mitić

2011-05-01

Full Text Available Methods of stereological study are of great importance for structural research of electronic ceramic materials including BaTiO3-ceramic materials. The broad application of ceramics, based on barium-titanate, in advanced electronics nowadays demands a constant research of its structure, that through the correlation structureproperties, a fundamental in the basic materials properties prognosis triad (technology-structure-properties, leads to further prognosis and properties design of these ceramics. Microstructure properties of BaTiO3- ceramic material, expressed in grains' boundary contact, are of basic importance for electric properties of this material, particularly the capacity. In this paper, a significant step towards establishing control under capacitive properties of BaTiO3-ceramics is being done by estimating the number of grains contact surfaces. Defining an efficient stereology method for estimating the number of BaTiO3-ceramic grains contact surfaces, we have started from a mathematical model of mutual grains distribution in the prescribed volume of BaTiO3-ceramic sample. Since the real microstructure morphology of BaTiO3-ceramics is in some way disordered, spherical shaped grains, using computer-modelling methods, are approximated by polyhedra with a great number of small convex polygons. By dividing the volume of BaTiO3-ceramic sample with the definite number of parallel planes, according to a given pace, into the intersection plane a certain number of grains contact surfaces are identified. According to quantitative estimation of 2D stereological parameters the modelled 3D internal microstructure is obtained. Experiments were made by using the scanning electronic microscopy (SEM method with the ceramic samples prepared under pressing pressures up to 150 MPa and sintering temperature up to 1370°C while the obtained microphotographs were used as a base of confirming the validity of presented stereology method. This paper, by applying

Microstructural properties of BaTiO3 ceramics and thin films

International Nuclear Information System (INIS)

Fundora C, A.; Portelles, J.J.; Siqueiros, J.M.

2000-01-01

A microstructural study of BaTiO 3 ceramics obtained by the conventional ceramic method is presented. Targets were produced to grow BaTiO 3 thin films by pulsed laser deposition on Pt/Ti/Si (100) substrates. X-ray diffraction, Auger Electron Spectroscopy, X-ray Photon Spectroscopy and Scanning Electron Microscopy were used to study the properties of the BaTiO 3 ceramic samples and thin films, as deposited and after an annealing process. (Author)

Magnetostriction in composites of LiFe5O8-BaTiO3

International Nuclear Information System (INIS)

Sarah, P.; Suryanarayana, S.V.

2003-01-01

Polycrystalline lithium ferrite, LiFe 5 O 8 was prepared by adopting two preparation techniques, the solid-state double sintering method and the sol-gel method. This ferrite powder was thoroughly mixed with barium titanate, BaTiO 3 for preparation of di-phasic composites of lithium ferrite and barium titanate. X-ray diffraction study of these composites revealed the presence of both the phases. Magnetostriction of these composites was measured in varying magnetic fields. The value of magnetostriction for the composites prepared by the sol-gel method was found to be higher than the values obtained in case of composites prepared by the solid-state method. Magnetostriction was found to decrease with increasing content of barium titanate. The saturation field was found to increase with the introduction of barium titanate

Improvement of β-phase crystal formation in a BaTiO3-modified PVDF membrane

Science.gov (United States)

Lin, SHEN; Lei, GONG; Shuhua, CHEN; Shiping, ZHAN; Cheng, ZHANG; Tao, SHAO

2018-04-01

In this paper, low temperature plasma is used to modify the surface of barium titanate (BaTiO3) nanoparticles in order to enhance the interfacial compatibility between ferroelectric poly(vinylidene fluoride) (PVDF) and BaTiO3 nanoparticles. The results demonstrate that oxygenic groups are successfully attached to the BaTiO3 surface, and the quantity of the functional groups increases with the treatment voltage. Furthermore, the effect of modified BaTiO3 nanoparticles on the morphology and crystal structure of the PVDF/BaTiO3 membrane is investigated. The results reveal that the dispersion of BaTiO3 nanoparticles in the PVDF matrix was greatly improved due to the modification of the BaTiO3 nanoparticles by air plasma. It is worth noting that the formation of a β-phase in a PVDF/modified BaTiO3 membrane is observably promoted, which results from the strong interaction between PVDF chains and oxygenic groups fixed on the BaTiO3 surface and the better dispersion of BaTiO3 nanoparticles in the PVDF matrix. Besides, the PVDF/modified BaTiO3 membrane at the treatment voltage of 24 kV exhibits a lower water contact angle (≈68.4°) compared with the unmodified one (≈86.7°). Meanwhile, the dielectric constant of PVDF/BaTiO3 nanocomposites increases with the increase of working voltage.

Lateral electric-field control of giant magnetoresistance in Co/Cu/Fe/BaTiO3 multiferroic heterostructure

International Nuclear Information System (INIS)

Savitha Pillai, S.; Kojima, H.; Itoh, M.; Taniyama, T.

2015-01-01

We report lateral electric-field-driven sizable changes in the magnetoresistance of Co/Cu/Fe tri-layered wires on BaTiO 3 single crystal. While the observed change is marginal in the tetragonal phase of BaTiO 3 , it reaches over 40% in the orthorhombic and rhombohedral phases with an electric field of 66 kV/cm. We attribute it to possible electric-field-induced variations of the spin-dependent electronic structures, i.e., spin polarization, of the Fe via interfacial strain transfer from BaTiO 3 . The contrasting results for the different phases of BaTiO 3 are discussed, associated with the distinct aspects of the ferroelectric polarization switching processes in each phase

Lateral electric-field control of giant magnetoresistance in Co/Cu/Fe/BaTiO3 multiferroic heterostructure

Science.gov (United States)

Savitha Pillai, S.; Kojima, H.; Itoh, M.; Taniyama, T.

2015-08-01

We report lateral electric-field-driven sizable changes in the magnetoresistance of Co/Cu/Fe tri-layered wires on BaTiO3 single crystal. While the observed change is marginal in the tetragonal phase of BaTiO3, it reaches over 40% in the orthorhombic and rhombohedral phases with an electric field of 66 kV/cm. We attribute it to possible electric-field-induced variations of the spin-dependent electronic structures, i.e., spin polarization, of the Fe via interfacial strain transfer from BaTiO3. The contrasting results for the different phases of BaTiO3 are discussed, associated with the distinct aspects of the ferroelectric polarization switching processes in each phase.

Structure and properties of plasma sprayed BaTiO3 coatings after thermal posttreatment

Czech Academy of Sciences Publication Activity Database

Ctibor, Pavel; Sedláček, J.; Pala, Zdeněk

2015-01-01

Roč. 41, č. 6 (2015), s. 7453-7460 ISSN 0272-8842 Institutional support: RVO:61389021 Keywords : Electrical properties * BaTiO3 * Plasma spraying * Annealing * Microstructure Subject RIV: JH - Ceramics, Fire-Resistant Materials and Glass Impact factor: 2.758, year: 2015 http://dx.doi.org/10.1016/j.ceramint.2015.02.065

Preparation and characterization of self-assembled percolative BaTiO3–CoFe2O4 nanocomposites via magnetron co-sputtering

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Qian Yang

2014-04-01

Full Text Available BaTiO3–CoFe2O4 composite films were prepared on (100 SrTiO3 substrates by using a radio-frequency magnetron co-sputtering method at 750 °C. These films contained highly (001-oriented crystalline phases of perovskite BaTiO3 and spinel CoFe2O4, which can form a self-assembled nanostructure with BaTiO3 well-dispersed into CoFe2O4 under optimized sputtering conditions. A prominent dielectric percolation behavior was observed in the self-assembled nanocomposite. Compared with pure BaTiO3 films sputtered under similar conditions, the nanocomposite film showed higher dielectric constants and lower dielectric losses together with a dramatically suppressed frequency dispersion. This dielectric percolation phenomenon can be explained by the 'micro-capacitor' model, which was supported by measurement results of the electric polarization and leakage current.

Self-Organized Ni Nanocrystal Embedded in BaTiO3 Epitaxial Film

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Ge FF

2010-01-01

Full Text Available Abstract Ni nanocrystals (NCs were embedded in BaTiO3 epitaxial films using the laser molecular beam epitaxy. The processes involving the self-organization of Ni NCs and the epitaxial growth of BaTiO3 were discussed. With the in situ monitoring of reflection high-energy electron diffraction, the nanocomposite films were engineered controllably by the fine alternation of the self-organization of Ni NCs and the epitaxial growth of BaTiO3. The transmission electron microscopy and the X-ray diffraction characterization confirmed that the composite film consists of the Ni NCs layers alternating with the (001/(100-oriented epitaxial BaTiO3 separation layers.

Multiphase nanodomains in a strained BaTiO3 film on a GdScO3 substrate

Science.gov (United States)

Kobayashi, Shunsuke; Inoue, Kazutoshi; Kato, Takeharu; Ikuhara, Yuichi; Yamamoto, Takahisa

2018-02-01

Controlling the crystal structure of ferroelectric materials via epitaxial strain, which is a well-known technique in strain engineering, can lead to the formation of unique domain structures generating non-intrinsic phenomena such as electronic conductivity, photovoltages, and enhanced piezoelectric characteristics. Strained BaTiO3 films are promising ferroelectric materials as theoretical modeling predicts that different domain morphologies can introduce additional properties not observed in conventional BaTiO3 ceramics. To rationally design materials for practical application, a thorough understanding of the formation mechanisms and stabilities of different domain structures in strained BaTiO3 films is required. However, there have been very few experimental reports on this topic, and details about the domain structures in strained BaTiO3 films are currently lacking. In this paper, we report multiphase nanodomains in a strained BaTiO3 film deposited on an orthorhombic GdScO3 substrate. The phase-transition behavior of the strained BaTiO3 film reveals that it contains multiple phases at room temperature; the film first undergoes a phase-transition upon heating at around 550 K, and then a paraelectric phase forms at temperatures above 690 K. A picometer-scale analysis of the Ti ion displacements, using an advanced scanning transmission electron microscopy technique, is used to characterize the complex multiphase nanodomains, providing useful insights into the control of domain structures in BaTiO3 films by applying epitaxial strain.

Local geometric and electronic structures and origin of magnetism in Co-doped BaTiO3 multiferroics

Science.gov (United States)

Phan, The-Long; Thang, P. D.; Ho, T. A.; Manh, T. V.; Thanh, Tran Dang; Lam, V. D.; Dang, N. T.; Yu, S. C.

2015-05-01

We have prepared polycrystalline samples BaTi1-xCoxO3 (x = 0-0.1) by solid-state reaction. X-ray diffraction and Raman-scattering studies reveal the phase separation in crystal structure as changing Co-doping content (x). The samples with x = 0-0.01 are single phase in a tetragonal structure. At higher doping contents (x > 0.01), there is the formation and development of a secondary hexagonal phase. Magnetization measurements at room temperature indicate a coexistence of paramagnetic and weak-ferromagnetic behaviors in BaTi1-xCoxO3 samples with x > 0, while pure BaTiO3 is diamagnetic. Both these properties increase with increasing x. Analyses of X-ray absorption spectra recorded from BaTi1-xCoxO3 for the Co and Ti K-edges indicate the presence of Co2+ and Co3+ ions. They locate in the Ti4+ site of the tetragonal and hexagonal BaTiO3 structures. Particularly, there is a shift of oxidation state from Co2+ to Co3+ when Co-doping content increases. We believe that the paramagnetic nature in BaTi1-xCoxO3 samples is due to isolated Co2+ and Co3+ centers. The addition of Co3+ ions enhances the paramagnetic behavior. Meanwhile, the origin of ferromagnetism is due to lattice defects, which is less influenced by the changes caused by the variation in concentration of Co2+ and Co3+ ions.

Two steps hydrothermal growth and characterisations of BaTiO3 films composed of nanowires

Science.gov (United States)

Zawawi, Che Zaheerah Najeehah Che Mohd; Salleh, Shahril; Oon Jew, Lee; Tufail Chaudhary, Kashif; Helmi, Mohamad; Safwan Aziz, Muhammad; Haider, Zuhaib; Ali, Jalil

2018-05-01

Barium titanate (BaTiO3) films composed of nanowires have gained considerable research interest due to their lead-free composition and strong energy conversion efficiency. BaTiO3 films can be developed with a simple two steps hydrothermal reactions, which are low cost effective. In this research, BaTiO3 films were fabricated on titanium foil through two steps hydrothermal method namely, the growth of TiO2 and followed by BaTiO3 films. The structural evolutions and the dielectric properties of the films were investigated as well. The structural evolutions of titanium dioxide (TiO2) and BaTiO3 nanowires were characterized using X-ray diffraction and scanning electron microscopy. First step of hydrothermal reaction, TiO2 nanowires were prepared in varied temperatures of 160 °C, 200 °C and 250 °C respectively. Second step of hydrothermal reaction was performed to produce a layer of BaTiO3 films.

Solution based approaches for the morphology control of BaTiO3 particulates

Directory of Open Access Journals (Sweden)

Florentina Maxim

2010-09-01

Full Text Available Within the action COST 539 - ELENA our contribution was aimed at studying solution based approaches for the morphology control of BaTiO3 particulates. Initially, our kinetic analysis and systematic structural and morphological studies, demonstrated that during hydrothermal synthesis from layered titanate nanotubes (TiNTS, BaTiO3 forms via two mechanisms depending on the temperature and time. At low temperatures (90°C, “wild” type BaTiO3 dendritic particles with cubic structure were formed through a phase boundary topotactic reaction. At higher temperatures and/or for longer times time, the reaction is controlled by a dissolution precipitation mechanism and “seaweed” type BaTiO3 dendrites are formed. Our results unambiguously elucidated why TiNTs do not routinely act as templates for the formation of 1D BaTiO3.In our subsequent investigations, the effect of additives on the aqueous and hydrothermal synthesis of BaTiO3 was assessed. We reported that although the tested additives influenced the growth of BaTiO3, their behaviour varied; poly(acrylic acid (PAA adsorbed on specific crystallographic faces changing the growth kinetics and inducing the oriented attachment of the particles; poly(vinyl pyrrolidone (PVP, sodium dodecylsulfate (SDS and hydroxypropylmethylcellulose (HPMC act as growth inhibitors rather than crystal habit modifiers; and DFructose appeared to increase the activation energy for nucleation, resulting in small crystals (26 nm. Our work clearly indicates that the synthesis of 1D nanostructures of complex oxides by chemical methods is non trivial.

La-doped BaTiO3 heterostructures: Compensating the polarization discontinuity

Directory of Open Access Journals (Sweden)

D. P. Kumah

2013-12-01

Full Text Available We demonstrate a route to manipulate the polarization and internal electric field of a complex oxide heterostructure using a layering sequence based on the LaAlO3-SrTiO3 interface. By combining sensitive atomic-level mapping of the structure using direct x-ray phase-retrieval methods with theoretical modeling of the electrostatic charge and polarization, we have devised a novel single-domain polar heterostructure. We find that ionic rearrangement results in strain and free energy minimization, and eliminates the polarization discontinuity leading to a two-fold increase of the spontaneous polarization towards the surface of an ultra-thin single-domain BaTiO3 film.

Orthorhombic strontium titanate in BaTiO sub 3 -SrTiO sub 3 superlattices

CERN Document Server

Rios, S; Jiang, A Q; Scott, J F; Lü, H; Chen, Z

2003-01-01

It has been suggested by several authors that SrTiO sub 3 layers in SrTiO sub 3 -BaTiO sub 3 superlattices should be tetragonal and ferroelectric at ambient temperatures, like the BaTiO sub 3 layers, rather than cubic, as in bulk SrTiO sub 3 , and that free-energy minimization requires continuity of the polarization direction. A recent ab initio calculation constrained solutions to this structure. Surprisingly, our x-ray study shows that the SrTiO sub 3 layers are orthorhombic with 0.03% in-plane strain, with the BaTiO sub 3 c-axis matching the SrTiO sub 3 a- and b-axis better than the c-axis; strain energy overcomes the cost in electrostatic energy. (letter to the editor)

First-principles calculations on the four phases of BaTiO3.

Science.gov (United States)

Evarestov, Robert A; Bandura, Andrei V

2012-04-30

The calculations based on linear combination of atomic orbitals basis functions as implemented in CRYSTAL09 computer code have been performed for cubic, tetragonal, orthorhombic, and rhombohedral modifications of BaTiO(3) crystal. Structural and electronic properties as well as phonon frequencies were obtained using local density approximation, generalized gradient approximation, and hybrid exchange-correlation density functional theory (DFT) functionals for four stable phases of BaTiO(3). A comparison was made between the results of different DFT techniques. It is concluded that the hybrid PBE0 [J. P. Perdew, K. Burke, M. Ernzerhof, J. Chem. Phys. 1996, 105, 9982.] functional is able to predict correctly the structural stability and phonon properties both for cubic and ferroelectric phases of BaTiO(3). The comparative phonon symmetry analysis in BaTiO(3) four phases has been made basing on the site symmetry and irreducible representation indexes for the first time. Copyright © 2012 Wiley Periodicals, Inc.

Enhanced actuation performance of piezoelectric fiber composites induced by incorporated BaTiO3 nanoparticles in epoxy resin

International Nuclear Information System (INIS)

Wu, Mingliang; Yuan, Xi; Luo, Hang; Chen, Haiyan; Chen, Chao; Zhou, Kechao; Zhang, Dou

2017-01-01

Piezoelectric fiber composites (PFCs) have attracted much interest owing to their flexibility and toughness compared with conventional monolithic piezoceramic wafers. The free strain values and actuation property of PFCs strongly depend on the active electric field applied in Pb(Zr 1−x Ti x )O 3 (PZT) fibers. Reducing the dielectric constant mismatch between PZT fiber and the assembling epoxy resin would greatly increase the active electric field in PZT fiber. Therefore, BaTiO 3 (BT) nanoparticles were introduced into the epoxy resin to enhance the dielectric constant. Homogeneous dispersion of BT nanoparticles and tight adhesion with the epoxy resin were achieved through a surface modification by dopamine. The maximum dielectric constant of dopamine modified BT/epoxy (BT@Dop/epoxy) nanocomposites was 10.38 with 12 wt% BT@Dop content at 1 kHz. The maximum free strain of PFCs reached 1820 ppm with 6 wt% BT@Dop content, while PFCs assembled by pure epoxy showed 790 ppm at the same processing condition. The tip displacement of cantilever beam actuated by PFCs reached the peak of 19 mm at the resonance frequency with 6 wt% BT@Dop, which was improved by 90% comparing to PFCs with pure epoxy. - Highlights: • The effect of dielectric mismatch on effective electric field in piezoceramic fibers was explained by a model. • The dispersibility and adhesion of BaTiO 3 nanoparticles in epoxy was improved by the dopamine modification. • The actuation performance increased firstly and then decreased with adding BaTiO 3 nanoparticles. • The maximum free strain and displacement of cantilever beam were up to 1820 ppm and 19 mm, respectively.

Synthesis and luminescence properties of BaTiO3:RE (RE = Gd , Dy ...

Indian Academy of Sciences (India)

thermoluminescence (TL) properties of BaTiO3 samples doped with Gd3+, Dy3+, Tb3+ and Lu3+ were investigated. ... electron microscope using an accelerating voltage of 20 kV. .... doping of 1% mole Gd3+ ion into the BaTiO3 compound.

Electrical properties of grain boundaries in polycrystalline materials under intrinsic or low doping

International Nuclear Information System (INIS)

Chowdhury, M H; Kabir, M Z

2011-01-01

An analytical model is developed to study the electrical properties (electric field and potential distributions, potential energy barrier height and polarization phenomenon) of polycrystalline materials at intrinsic or low doping for detector and solar cell applications by considering an arbitrary amount of grain boundary charge and a finite width of grain boundary region. The general grain boundary model is also applicable to highly doped polycrystalline materials. The electric field and potential distributions are obtained by solving Poisson's equation in both depleted grains and grain boundary regions. The electric field and potential distributions across the detector are analysed under various doping, trapping and applied biases. The electric field collapses, i.e. a nearly zero-average electric field region exists in some part of the biased detector at high trapped charge densities at the grain boundaries. The model explains the conditions of existence of a zero-average field region, i.e. the polarization mechanisms in polycrystalline materials. The potential energy barrier at the grain boundary exists if the electric field changes its sign at the opposite side of the grain boundary. The energy barrier does not exist in all grain boundaries in the low-doped polycrystalline detector and it never exists in intrinsic polycrystalline detectors under applied bias condition provided that there is no charge trapping in the grain.

Synthesis of BaTiO3 powder from barium titanyl oxalate (BTO ...

Indian Academy of Sciences (India)

Unknown

the synthesis of BaTiO3 from the mixture of barium car- bonate and titanium dioxide employing microwave heat- ing. They observed that hypostoichiometric TiO2 (TiO2–x) reacted with BaCO3 in the presence of microwave field at temperature as low as 350°C to give the mixture of hexa- gonal and tetragonal forms of BaTiO3 ...

Excimer laser assisted re-oxidation of BaTiO3 thin films on Ni metal foils

International Nuclear Information System (INIS)

Bharadwaja, S. S. N.; Ko, S. W.; Qu, W.; Clark, T.; Rajashekhar, A.; Motyka, M.; Podraza, N.; Randall, C. A.; Trolier-McKinstry, S.

2016-01-01

Excimer laser assisted re-oxidation for reduced, crystallized BaTiO 3 thin films on Ni-foils was investigated. It was found that the BaTiO 3 can be re-oxidized at an oxygen partial pressure of ∼50 mTorr and substrate temperature of 350 °C without forming a NiO x interface layer between the film and base metal foil. The dielectric permittivity of re-oxidized films was >1000 with loss tangent values <2% at 100 Hz, 30 mV rms excitation signal. Electron Energy Loss Spectroscopy indicated that BaTiO 3 thin films can be re-oxidized to an oxygen stoichiometry close to ∼3 (e.g., stoichiometric). High resolution cross sectional transmission electron microscopy showed no evidence of NiO x formation between the BaTiO 3 and the Ni foil upon excimer laser re-oxidation. Spectroscopic ellipsometry studies on laser re-oxidized [001] C and [111] C BaTiO 3 single crystals indicate that the re-oxidation of BaTiO 3 single crystals is augmented by photo-excitation of the ozone, as well as laser pulse induced temperature and local stress gradients

Substantial enhancement of energy storage capability in polymer nanocomposites by encapsulation of BaTiO3 NWs with variable shell thickness.

Science.gov (United States)

Wang, Guanyao; Huang, Yanhui; Wang, Yuxin; Jiang, Pingkai; Huang, Xingyi

2017-08-09

Dielectric polymer nanocomposites have received keen interest due to their potential application in energy storage. Nevertheless, the large contrast in dielectric constant between the polymer and nanofillers usually results in a significant decrease of breakdown strength of the nanocomposites, which is unfavorable for enhancing energy storage capability. Herein, BaTiO 3 nanowires (NWs) encapsulated by TiO 2 shells of variable thickness were utilized to fabricate dielectric polymer nanocomposites. Compared with nanocomposites with bare BaTiO 3 NWs, significantly enhanced energy storage capability was achieved for nanocomposites with TiO 2 encapsulated BaTiO 3 NWs. For instance, an ultrahigh energy density of 9.53 J cm -3 at 440 MV m -1 could be obtained for nanocomposites comprising core-shell structured nanowires, much higher than that of nanocomposites with 5 wt% raw ones (5.60 J cm -3 at 360 MV m -1 ). The discharged energy density of the proposed nanocomposites with 5 wt% mTiO 2 @BaTiO 3 -1 NWs at 440 MV m -1 seems to rival or exceed those of some previously reported nanocomposites (mostly comprising core-shell structured nanofillers). More notably, this study revealed that the energy storage capability of the nanocomposites can be tailored by the TiO 2 shell thickness. Finite element simulations were employed to analyze the electric field distribution in the nanocomposites. The enhanced energy storage capability should be mainly attributed to the smoother gradient of dielectric constant between the nanofillers and polymer matrix, which alleviated the electric field concentration and leakage current in the polymer matrix. The methods and results herein offer a feasible approach to construct high-energy-density polymer nanocomposites with core-shell structured nanowires.

Effects of thermal and electrical histories on structure and dielectric behaviors of (Li0.5Nd0.52+-modified (Bi0.5Na0.5TiO3-BaTiO3 ceramics

Directory of Open Access Journals (Sweden)

Jiwen Xu

2017-06-01

Full Text Available The effect of thermal and electrical histories on structure and dielectric behaviors is studied using 0.95(Bi0.5Na0.50.97(Li0.5Nd0.50.03TiO3-0.05BaTiO3 (abbreviated as BNTLN0.03-BT5 ceramic as a selected system. Subtle structure change caused by annealing treatment, and pronounced phase transition and domain switching by electrical poling, are observed to occur, respectively. The dielectric constant and its strong frequency dispersion in unpoled samples decrease evidently by electrical poling due to electric field-induced ordered domain. The high temperature Maxwell-Wagner relaxor behavior vanishes by annealing treatment due to the loss of electrical inhomogeneity with interface charging effects. Piezoelectric properties are improved evidently by annealing treatment at 900 °C, implying a new appropriate method to improve piezoelectric properties.

Positron annihilation lifetime study of positive temperature coefficient BaTiO3 samples

International Nuclear Information System (INIS)

Ling Chen; Mingkang Teng; Guanghou Wang; Xiaoyun Li; Tianchang Lu

1989-01-01

In order to investigate the doped vacancies in BaTiO 3 samples as well as their influence on the positive temperature coefficient (PTC) the positron annihilation lifetime spectroscopy was applied. Two groups of BaTiO 3 samples with BaO excess were prepared by doping different concentrations of La 2 O 3 and Nb 2 O 5 , respectively in the range from 0.1 to 3 at%. A third group of samples of two Sb-doped PTC BaTiO 3 semiconductors with excess BaO or TiO 2 were studied by the aid of positron technique before and after being reduced. It is shown that the positron lifetime parameters are sensitive to changes in the vacancy concentration in BaTiO 3 ceramics near the 0.1 mol% region. But they are almost unchanged during reduction processing; the resistivity of samples changed by one to two orders of magnitude through the reduction. It can be concluded that the PTC effect is due to oxygen on the grain boundary rather than vacancies, and that the Heywang-Jonker model is more reasonable

Reduced energy loss in poly(vinylidene fluoride) nanocomposites by filling with a small loading of core-shell structured BaTiO3/SiO2 nanofibers

Science.gov (United States)

Liu, Shaohui; Xue, Shuangxi; Shen, Bo; Zhai, Jiwei

2015-07-01

Homogeneous ceramic-polymer nanocomposites consisting of core-shell structured BaTiO3/SiO2 nanofibers and a p oly(vinylidene fluoride) (PVDF) polymer matrix have been prepared. The correlation between the energy discharged density and interfacial polarization is studied in PVDF nanocomposites by the measurements of the discharge performance and impedance spectroscopy. According to the results of dielectric constant, breakdown strength, and complex impedance analysis, coating SiO2 layers on the surface of BaTiO3 nanofibers can block the movement of charge carriers through the nanocomposites by playing a shielding role on the charge-rich inter layer, which resulted in weak Maxwell-Wagner-Sillars interfacial polarization and thus reduces the energy loss and improved the energy discharged density of the nanocomposites. The energy discharged density in the nanocomposite with 2.5 vol. % BaTiO3/SiO2 core-shell nanofibers is 6.28 J/cm3 at 3.3 MV/cm, which is over 11.94% higher than that of nanocomposite with BaTiO3 nanofibers at the same electric field.

Software optimization for electrical conductivity imaging in polycrystalline diamond cutters

Energy Technology Data Exchange (ETDEWEB)

Bogdanov, G.; Ludwig, R. [Department of Electrical and Computer Engineering, Worcester Polytechnic Institute, 100 Institute Rd, Worcester, MA 01609 (United States); Wiggins, J.; Bertagnolli, K. [US Synthetic, 1260 South 1600 West, Orem, UT 84058 (United States)

2014-02-18

We previously reported on an electrical conductivity imaging instrument developed for measurements on polycrystalline diamond cutters. These cylindrical cutters for oil and gas drilling feature a thick polycrystalline diamond layer on a tungsten carbide substrate. The instrument uses electrical impedance tomography to profile the conductivity in the diamond table. Conductivity images must be acquired quickly, on the order of 5 sec per cutter, to be useful in the manufacturing process. This paper reports on successful efforts to optimize the conductivity reconstruction routine, porting major portions of it to NVIDIA GPUs, including a custom CUDA kernel for Jacobian computation.

Complementary resistive switching in BaTiO3/NiO bilayer with opposite switching polarities

Science.gov (United States)

Li, Shuo; Wei, Xianhua; Lei, Yao; Yuan, Xincai; Zeng, Huizhong

2016-12-01

Resistive switching behaviors have been investigated in the Au/BaTiO3/NiO/Pt structure by stacking the two elements with different switching types. The conducting atomic force microscope measurements on BaTiO3 thin films and NiO thin films suggest that with the same active resistive switching region, the switching polarities in the two semiconductors are opposite to each other. It is in agreement with the bipolar hysteresis I-V curves with opposite switching polarities for single-layer devices. The bilayer devices show complementary resistive switching (CRS) without electroforming and unipolar resistive switching (URS) after electroforming. The coexistence of CRS and URS is mainly ascribed to the co-effect of electric field and Joule heating mechanisms, indicating that changeable of resistance in this device is dominated by the redistribution of oxygen vacancies in BaTiO3 and the formation, disruption, restoration of conducting filaments in NiO. CRS in bilayer with opposite switching polarities is effective to solve the sneak current without the introduction of any selector elements or an additional metal electrode.

Caracterización eléctrica y microestructural de cerámicas densificadas de BaTiO3 obtenido por pechini

Directory of Open Access Journals (Sweden)

Rivera, E.

2010-12-01

Full Text Available The barium titanate BaTiO3 is a material of great technological interest due to their dielectric properties. The functionality of this mixed oxide is mainly determined by its structure. Different synthesis methods have been used to improve the electrical response of BaTiO3. In this work BaTiO3 powders were synthesized using the polymeric precursor method, Pechini, obtaining the compound at 650 ° C, with uniform nanometric particle size (~ 20nm. The nature of the synthesized powders was analyzed using X-ray diffraction (XRD and differential scanning calorimetry (DSC. The results indicate that the crystalline phase present in the sample treated at 650 ° C is cubic and at 1100 ° C is tetragonal, with a relation c/a ≈ 1.007. The samples sinterized at 1100 ° C showed a ferroelectric-paraelectric transition at a temperature of T . 123ºC. The ceramic powders of barium titanate tetragonal, pressed and densified, was electrical characterizing with curves current-voltage (I-V at different temperatures. Additionally, we measured the change in electrical resistance versus temperature (R-T and we tested the behavior thermistor (PTCR of the material for different pressures. Also the electric response of the material with the variation of the frequency, for different temperatures, was measured.El titanato de bario BaTiO3 es un compuesto de gran interés tecnológico debido a sus propiedades dieléctricas. La funcionalidad de este oxido mixto está determinada, principalmente, por su estructura. Diferentes métodos de síntesis se han utilizado para mejorar la respuesta eléctrica del BaTiO3. En el presente trabajo se sintetizaron polvos de BaTiO3 utilizando el método de precursor polimérico, Pechini, obteniéndose el compuesto a una temperatura de 650 °C, con un tamaño de partícula nanométrico (~20nm y uniforme. La naturaleza de los polvos sintetizados se analizo utilizando difracción de rayos X (DRX y calorimetría diferencial de barrido (DSC

Dynamic Displacement Disorder of Cubic BaTiO3

Science.gov (United States)

Paściak, M.; Welberry, T. R.; Kulda, J.; Leoni, S.; Hlinka, J.

2018-04-01

The three-dimensional distribution of the x-ray diffuse scattering intensity of BaTiO3 has been recorded in a synchrotron experiment and simultaneously computed using molecular dynamics simulations of a shell model. Together, these have allowed the details of the disorder in paraelectric BaTiO3 to be clarified. The narrow sheets of diffuse scattering, related to the famous anisotropic longitudinal correlations of Ti ions, are shown to be caused by the overdamped anharmonic soft phonon branch. This finding demonstrates that the occurrence of narrow sheets of diffuse scattering agrees with a displacive picture of the cubic phase of this textbook ferroelectric material. The presented methodology allows one to go beyond the harmonic approximation in the analysis of phonons and phonon-related scattering.

Syntheses of nanocrystalline BaTiO3 and their optical properties

Science.gov (United States)

Yu, J.; Chu, J.; Zhang, M.

Stoichiometric and titanium-excess nanocrystalline barium titanates were synthesized using a hydrothermal process at various hydrothermal temperatures and with further heat treatment at 500 °C and 900 °C. Owing to the different process conditions, the excess titanium exists in different states and configurations within the nanocrystalline BaTiO3 matrix; this was demonstrated by X-ray diffraction, Raman scattering, and photoluminescence. In these nanocrystalline BaTiO3, the 590, 571, 543 and 694 nm light emission bands were observed; mechanisms leading to such emissions were also discussed.

Synthesis and electrical properties of BaBiO3 and high resistivity BaTiO3–BaBiO3 ceramics

Directory of Open Access Journals (Sweden)

Nitish Kumar

2016-12-01

Full Text Available Ceramics of the composition BaBiO3 (BB were sintered in oxygen to obtain a single phase with monoclinic I2/m symmetry as suggested by high-resolution X-ray diffraction. X-ray photoelectron spectroscopy confirmed the presence of bismuth in two valence states — 3+ and 5+. Optical spectroscopy showed presence of a direct bandgap at ∼ 2.2eV and a possible indirect bandgap at ∼ 0.9eV. This combined with determination of the activation energy for conduction of 0.25eV, as obtained from ac impedance spectroscopy, suggested that a polaron-mediated conduction mechanism was prevalent in BB. The BB ceramics were crushed, mixed with BaTiO3 (BT, and sintered to obtain BT–BB solid solutions. All the ceramics had tetragonal symmetry and exhibited a normal ferroelectric-like dielectric response. Using ac impedance and optical spectroscopy, it was shown that resistivity values of BT–BB were orders of magnitude higher than BT or BB alone, indicating a change in the fundamental defect equilibrium conditions. A shift in the site occupancy of Bi to the A-site is proposed to be the mechanism for the increased electrical resistivity.

Nucleation control and inhibition of BaTiO3 films using hydrothermal-electrochemical method

International Nuclear Information System (INIS)

Escobar, Ivan; Silva, Carmen; Silva, Eric; Vargas, Tomas; Fuenzalida, Victor

1999-01-01

The microstructure of BaTiO 3 films on titanium by the hydrothermal-electrochemical method was investigated using a three electrode high pressure electrochemical cell in a 0.2 M Ba(OH) 2 electrolyte at 150 0 C. The spontaneous initial linked to pure hydrothermal BaTiO 3 formation can be inhibited by cathodically protecting titanium electrode since its immersion in the electrolyte. The application of initial nucleation pulses of varying the cathodic potentials affected the grain size of the deposit. It is suggested that the formation of a titanium oxide layers is a necessary step previous to the nucleation of BaTiO 3

Anelastic anomalies and negative Poisson's ratio in tetragonal BaTiO3 ceramics

International Nuclear Information System (INIS)

Dong Liang; Stone, Donald S.; Lakes, Roderic S.

2010-01-01

Anelastic anomalies (sharp variations in modulus and damping with temperature) were observed in tetragonal BaTiO 3 via broadband viscoelastic spectroscopy after aging at 50 deg. C for 15 h. The effect was most pronounced under electrical short circuit condition, at low frequency and under small excitation strain (10 -6 ). Softening in bulk modulus and negative Poisson's ratio were observed near 60 deg. C. Effects are attributed to an oxygen vacancy mechanism. A relaxational model cannot account for sharp response at smaller strains. Heterogeneity of negative stiffness is considered as a cause.

Spin-Coating and Characterization of Multiferroic MFe2O4 (M=Co, Ni) / BaTiO3 Bilayers

Science.gov (United States)

Quandt, Norman; Roth, Robert; Syrowatka, Frank; Steimecke, Matthias; Ebbinghaus, Stefan G.

2016-01-01

Bilayer films of MFe2O4 (M=Co, Ni) and BaTiO3 were prepared by spin coating of N,N-dimethylformamide/acetic acid solutions on platinum coated silicon wafers. Five coating steps were applied to get the desired thickness of 150 nm for both the ferrite and perovskite layer. XRD, IR and Raman spectroscopy revealed the formation of phase-pure ferrite spinels and BaTiO3. Smooth surfaces with roughnesses in the order of 3 to 5 nm were found in AFM investigations. Saturation magnetization of 347 emu cm-3 for the CoFe2O4/BaTiO3 and 188 emu cm-3 for the NiFe2O4/BaTiO3 bilayer, respectively were found. For the CoFe2O4/BaTiO3 bilayer a strong magnetic anisotropy was observed with coercivity fields of 5.1 kOe and 3.3 kOe (applied magnetic field perpendicular and parallel to film surface), while for the NiFe2O4/BaTiO3 bilayer this effect is less pronounced. Saturated polarization hysteresis loops prove the presence of ferroelectricity in both systems.

Study of radiation damage in BaTiO3, using Molecular-dynamics simulations

International Nuclear Information System (INIS)

Gonzalez, E.; Abreu, Y.; Cruz, C. M.; Pinnera, I.; Leyva, A.

2015-01-01

Molecular-dynamics (MD) simulations were used to calculate atomic displacement probability curves along main crystallographic directions in BaTiO 3 perovskite. A primary knock-on atom (PKA) with a energy range between 10 to 300 eV in principal crystallographic directions at 300 K was introduced. For each sublattice, the simulation was repeated from different initial conditions to estimate the variation in the defect formation process. The formation of Frenkel pairs vary considerably with crystallographic direction and sublattice. Major quantity oxygen defects were found for all the simulated crystallographic directions. Threshold displacement energies are calculated for each atomic specie in the BaTiO 3 material. Also simulations with SRIM code, modeling + Mn implantation in a BaTiO 3 target, at 250 keV were made. (Author)

Characterization and dielectric properties of BaTiO3 prepared from Ba(NO3)2-TiO2 mixture

International Nuclear Information System (INIS)

Othman, K.I.; Hassan, A.A.; Ali, M.E.; Abdelal, O.A.; Salah El Dien, F.E.; El-Raghy, S.M.; Abdel-Karim, R.

2012-01-01

BaTiO 3 powder was prepared through a solid-state reaction between the Ba(NO 3 ) 2 and TiO 2 . The thermal analysis and XRD techniques were used to study its formation. A single phase BaTiO 3 was formed after calcination at 600 degree C for 6 hrs. The dielectric properties of the sintered BaTiO 3 were determined in the temperature range from room temperature to 20 degree C at a frequency ranging from 500 Hz to 100 khz. The relative permittivity and the dielectric loss of the sintered pellets at 1 khz, measured at room temperature,were 1805 and 0.419 respectively.

Influence of Impurities on the Luminescence of Er3+ Doped BaTiO3 Nanophosphors

Directory of Open Access Journals (Sweden)

G. D. Webler

2014-01-01

Full Text Available The influence of the presence of barium carbonate (BaCO3 phase on the luminescence properties of barium titanate nanocrystals (BaTiO3 powders was investigated. Structural and optical characterizations of erbium (Er3+ doped BaTiO3 synthesized by the sol-emulsion-gel were performed. Using Fourier transform infrared spectroscopy and X-ray powder diffraction, we identified the presence of impurities related to BaCO3 and quantified its fraction. It was observed that the presence of BaCO3 phase, even at low levels, depletes significantly the infrared-to-visible upconverted luminescence efficiency of the produced nanopowders.

Estudio del perfil de defectos y de las propiedades eléctricas de BaTiO3 dopado con Nb y La

Directory of Open Access Journals (Sweden)

Castro, M. S.

2002-02-01

Full Text Available The aim of this work is to study the impact of two different and typical donor –dopants; Nb2O5 and La2O3, on the electrical properties of BaTiO3. Besides, the influence of Nb5+ and La3+ on the charge compensation mechanism was evaluated. On this way, it was determined that, the defect structure is not only affected by the dopant ion but also by its concentration. Amount of dopant also affects the electrical properties of BaTiO3 ceramics. In fact, for low Nb2O5 or La2O3 concentration, electronic compensation prevails, leading to a low – resistive material with an important PTCR effect. By EPR an increases in the oxygen vacancies with a low lanthanum addition was determined. This phenomenon could be associated to the lanthanum acceptor behavior. On the other hand, high dopant concentration leads to a high – resistive material showing GBBL characteristics. In this case, a high content of double – ionized barium vacancies able to trap electrons, and a thin glassy – phase film covering the BaTiO3 grains lead to a high – resistive material. This phenomenon encourages the hypothesis in which barium vacancies act as acceptor centers at the grain boundaries in BaTiO3 ceramics.En este trabajo, se estudia el impacto de la adición de Nb2O5 o La2O3 sobre las propiedades eléctricas de cerámicos basados en BaTiO3. Asimismo, se estudia la influencia de estos dos típicos dopantes en los mecanismos de compensación de cargas. En este sentido, se ha determinado que la estructura de defectos en el BaTiO3 no sólo se encuentra afectada por el tipo de dopante sino tambien por su concentración. En efecto, para bajas concentraciones de Nb2O5 o La2O3, predomina un mecanismo de compensación de cargas por generación de electrones. Sin embargo, los resultados de EPR muestran que la adición de una pequeña cantidad de La2O3 produce un notable incremento en la concentración de vacantes de oxígeno respecto del BaTiO3 sin dopar. Este fenómeno podr

Highly piezoelectric BaTiO3 nanorod bundle arrays using epitaxially grown TiO2 nanomaterials.

Science.gov (United States)

Jang, Seon-Min; Yang, Su Chul

2018-06-08

Low-dimensional piezoelectric nanostructures such as nanoparticles, nanotubes, nanowires, nanoribbons and nanosheets have been developed for potential applications as energy harvesters, tunable sensors, functional transducers and low-power actuators. In this study, lead-free BaTiO 3 nanorod bundle arrays (NBA) with highly piezoelectric properties were successfully synthesized on fluorine-doped tin oxide (FTO) substrate via a two-step process consisting of TiO 2 epitaxial growth and BaTiO 3 conversion. Through the TiO 2 epitaxial growth on FTO substrate, (001) oriented TiO 2 nanostructures formed vertically-aligned NBA with a bundle diameter of 80 nm and an aspect ratio of six. In particular, chemical etching of the TiO 2 NBA was conducted to enlarge the surface area for effective Ba 2+ ion diffusion during the perovskite conversion process from TiO 2 to BaTiO 3 . The final structure of perovskite BaTiO 3 NBA was found to exhibit a feasible piezoelectric response of 3.56 nm with a clear phase change of 180° from the single BaTiO 3 bundle, by point piezoelectric forced microscopy (PFM) analysis. Consequently, highly piezoelectric NBA could be a promising nanostructure for various nanoscale electronic devices.

Highly piezoelectric BaTiO3 nanorod bundle arrays using epitaxially grown TiO2 nanomaterials

Science.gov (United States)

Jang, Seon-Min; Yang, Su Chul

2018-06-01

Low-dimensional piezoelectric nanostructures such as nanoparticles, nanotubes, nanowires, nanoribbons and nanosheets have been developed for potential applications as energy harvesters, tunable sensors, functional transducers and low-power actuators. In this study, lead-free BaTiO 3 nanorod bundle arrays (NBA) with highly piezoelectric properties were successfully synthesized on fluorine-doped tin oxide (FTO) substrate via a two-step process consisting of TiO2 epitaxial growth and BaTiO3 conversion. Through the TiO2 epitaxial growth on FTO substrate, (001) oriented TiO2 nanostructures formed vertically-aligned NBA with a bundle diameter of 80 nm and an aspect ratio of six. In particular, chemical etching of the TiO2 NBA was conducted to enlarge the surface area for effective Ba2+ ion diffusion during the perovskite conversion process from TiO2 to BaTiO3. The final structure of perovskite BaTiO3 NBA was found to exhibit a feasible piezoelectric response of 3.56 nm with a clear phase change of 180° from the single BaTiO3 bundle, by point piezoelectric forced microscopy (PFM) analysis. Consequently, highly piezoelectric NBA could be a promising nanostructure for various nanoscale electronic devices.

Synthesis of BaTiO3 nanoparticles from TiO2-coated BaCO3 particles derived using a wet-chemical method

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Yuuki Mochizuki

2014-03-01

Full Text Available BaCO3 particles coated with amorphous TiO2 precursor are prepared by a wet chemical method to produce BaTiO3 nanoparticles at low temperatures. Subsequently, we investigate the formation behavior of BaTiO3 particles and the particle growth behavior when the precursor is subjected to heat treatment. The state of the amorphous TiO2 coating on the surface of BaCO3 particles depends on the concentration of NH4HCO3, and the optimum concentration is found to be in the range 0.5–1.0 M. Thermogravimetric curves of the BaCO3 particles coated with the TiO2 precursor, prepared from BaCO3 particles of various sizes, show BaTiO3 formation occurring mainly at 550–650 °C in the case of fine BaCO3 particles. However, as evidenced from the curves, the temperature of formation of BaTiO3 shifts to higher values with an increase in the size of the BaCO3 particles. The average particle size of single phase BaTiO3 at heat-treatment temperature of 650–900 °C is observed to be in the range 60–250 nm.

Factors influencing formation of highly dispersed BaTiO3 nanospheres with uniform sizes in static hydrothermal synthesis

International Nuclear Information System (INIS)

Gao, Jiabing; Shi, Haiyue; Dong, Huina; Zhang, Rui; Chen, Deliang

2015-01-01

Highly dispersed BaTiO 3 nanospheres with uniform sizes have important applications in micro/nanoscale functional devices. To achieve well-dispersed spherical BaTiO 3 nanocrystals, we carried out as reported in this paper the systematic investigation on the factors that influence the formation of BaTiO 3 nanospheres by the static hydrothermal process, including the NaOH concentrations [NaOH], molar Ba/Ti ratios (R Ba/Ti ), hydrothermal temperatures, and durations, with an emphasis on understanding the related mechanisms. Barium nitrate and TiO 2 sols derived from tetrabutyl titanate were used as the starting materials. The as-synthesized BaTiO 3 samples were characterized by X-ray diffraction, scanning electron microscopy, energy-dispersive X-ray analysis, thermogravimetry, differential thermal analysis, and FT-IR spectra. The highly dispersed BaTiO 3 nanospheres (76 ± 13 nm) were achieved under the optimum hydrothermal conditions at 200 °C for 10 h: [NaOH] = 2.0 mol L −1 and R Ba/Ti  = 1.5. Higher NaOH concentrations, higher Ba/Ti ratios, higher hydrothermal temperatures, and longer hydrothermal durations are favorable in forming BaTiO 3 nanospheres with larger fractions of tetragonal phase and higher yields; but too long hydrothermal durations resulted in abnormal growth and reduced the uniformity in particle sizes. The possible formation mechanisms for BaTiO 3 nanocrystals under the static hydrothermal conditions were investigated

Thickness dependent charge transport in ferroelectric BaTiO3 heterojunctions

Science.gov (United States)

Singh, Pooja; Rout, P. K.; Singh, Manju; Rakshit, R. K.; Dogra, Anjana

2015-09-01

We have investigated the effect of ferroelectric barium titanate (BaTiO3) film thickness on the charge transport mechanism in pulsed laser deposited epitaxial metal-ferroelectric semiconductor junctions. The current (I)-voltage (V) measurements across the junctions comprising of 20-500 nm thick BaTiO3 and conducting bottom electrode (Nb: SrTiO3 substrate or La2/3Ca1/3MnO3 buffer layer) demonstrate the space charge limited conduction. Further analysis indicates a reduction in the ratio of free to trapped carriers with increasing thickness in spite of decreasing trap density. Such behaviour arises the deepening of the shallow trap levels (I-V curves implies a bipolar resistive switching behaviour, which can be explained in terms of charge trapping and de-trapping process.

Critical behavior of the spontaneous polarization and the dielectric susceptibility close to the cubic-tetragonal transition in BaTiO3

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H. Yurtseven

2015-09-01

Full Text Available Using Landau mean field model, the spontaneous polarization and the dielectric susceptibility are analyzed as functions of temperature and pressure close to the cubic–tetragonal (ferroelectric–paraelectric transition in BaTiO3. From the analysis of the dielectric susceptibility and the spontaneous polarization, the critical exponents are deduced in the classical and quantum limits for BaTiO3. From the critical behavior of the dielectric susceptibility, the spontaneous polarization can be described for the ferroelectric–paraelectric (cubic to tetragonal transition between 4 and 8 GPa at constant temperatures of 0 to 200 K in BaTiO3 within the Landau mean field model given here.

Simulation of iron impurity in BaTiO3 crystals

International Nuclear Information System (INIS)

Stashans, Arvids; Castillo, Darwin

2009-01-01

Iron-doped barium titanate (BaTiO 3 ) has been simulated taking into account cubic and tetragonal crystallographic lattices of the crystal. A quantum-chemical method based on the Hartree-Fock formalism has been used throughout the study. The calculated equilibrium structures of Fe-doped crystals reveal the defect-inward displacements of the Ti and O atoms whereas the shifts for the Ba atoms are encountered to be away with respect to the Fe impurity. According to the analysis of electron density population and electron band structure it is found that some unusual chemical bonding might take place between the Fe atom and its six adjacent O atoms. The role of Fe impurity in the ferroelectric polarization of the tetragonal BaTiO 3 crystal has been discussed too.

An electrical conductivity inspection methodology of polycrystalline diamond cutters

Science.gov (United States)

Bogdanov, G.; Wiggins, J.; Bertagnolli, K.; Ludwig, R.

2012-05-01

The polycrystalline diamond cutter (PDC) is widely used in oil and gas drilling operations. It is manufactured by sintering diamond powder onto a tungsten carbide substrate at 6 GPa and 1500 C. During sintering, molten cobalt from the substrate infiltrates the diamond table. The residual metal content correlates with cutter performance. We present an instrument that employs electrical impedance tomography capable of imaging the 3D metal content distribution in the diamond table. These images can be used to predict cutter performance as well as detect flaws.

Nanocomposites of ferroelectric polymers with surface-hydroxylated BaTiO 3 nanoparticles for energy storage applications

KAUST Repository

Almadhoun, Mahmoud Nassar Mahmoud

2012-01-01

A facile surface hydroxylation treatment using hydrogen peroxide to modify the surface of BaTiO 3 nanofillers dispersed in a ferroelectric copolymer host has been investigated. We demonstrate that the surface functionalization of the BaTiO 3 nanofillers (<100 nm) with hydroxyl groups results in as much as two orders of magnitude reduction in the leakage current of nanocomposite thin-film capacitors. This reduction is observed concurrently with the enhancement of the effective permittivity and breakdown strength of the thin-film nanocomposites. Surface modified BaTiO 3 particles display better dispersion within the polymer matrix, resulting in enhanced relative permittivity and reduced dielectric loss. The dielectric behavior of the nanocomposite films containing up to 30 vol.% BaTiO 3 agreed well with the Bruggeman model. These results demonstrate the potential of facile surface hydroxylation of nanoparticles towards the fabrication of higher energy-density nanocomposites. © 2012 The Royal Society of Chemistry.

Synthesis of flower-like BaTiO3/Fe3O4 hierarchically structured particles and their electrorheological and magnetic properties.

Science.gov (United States)

Wang, Baoxiang; Yin, Yichao; Liu, Chenjie; Yu, Shoushan; Chen, Kezheng

2013-07-21

Flower-like BaTiO3/Fe3O4 hierarchically structured particles composed of nano-scale structures on micro-scale materials were synthesized by a simple solvothermal approach and characterized by the means of X-ray powder diffraction (XRD), scanning electron microscopy (SEM), transmission electron microscopy (TEM), magnetic testing and rotary viscometer. The influences on the morphology and structure of solvothermal times, type and amount of surfactant, EG : H2O ratio, etc. were studied. Magnetic testing results show that the samples have strong magnetism and they exhibit superparamagnetic behavior, as evidenced by no coercivity and the remanence at room temperature, due to their very small sizes, observed on the M-H loop. The saturation magnetization (M(s)) value can achieve 18.3 emu g(-1). The electrorheological (ER) effect was investigated using a suspension of the flower-like BaTiO3/Fe3O4 hierarchically structured particles dispersed in silicone oil. We can observe a slight shear-thinning behavior of shear viscosity at a low shear rate region even at zero applied electric field and a Newtonian fluid behavior at high shear rate regions.

Hybrid chitosan–Pluronic F-127 films with BaTiO3:Co nanoparticles: Synthesis and properties

International Nuclear Information System (INIS)

Fuentes, S.; Dubo, J.; Barraza, N.; González, R.; Veloso, E.

2015-01-01

In this study, magnetic BaTiO 3 :Co (BT:Co) nanoparticles prepared using a combined sol–gel–hydrothermal technique were dispersed in a chitosan/Pluronic F-127 solution (QO/Pl) to obtain a nanocomposite hybrid films. Nanoparticles and hybrid films were characterized by X-ray powder diffraction, Fourier transform infrared (FTIR) spectroscopy, scanning electron microscopy (SEM) and alternating gradient magnetometry (AGM). Experimental results indicated that the BT:Co nanoparticles were encapsulated in the QO/Pl hybrid films and that the magnetic properties of the QO/Pl/BT:Co nanocomposites are similar to the naked BT:Co nanoparticles. Results indicate that Co doping produces an enhancement in the ferromagnetic behavior of the BT nanoparticle. The coating restricts this enhancement only to low-fields, leaving the diamagnetic behavior of BT at high-fields. Magnetically stable sizes (PSD) were obtained at 3% Co doping for both naked nanoparticles and hybrid films. These show an increased magnetic memory capacity and a softer magnetic hardness with respect to non-doped BT nanoparticles. - Highlights: • We described the synthesis of magnetic BaTiO 3 :Co dispersed in chitosan (QO)/Pluronic F-127 (Pl) solution by sonication to obtain nanocomposite hybrid films. • We describe the physical and magnetic properties of BaTiO 3 :Co nanoparticles and QO/Pl/BT:Co hybrid films. • The magnetic properties are defines by the presence of magnetic domains. These magnetic domains are close related with the amount of Co in the host lattice. • The prepared phases could be considered as multifunctional materials, with magnetic and ferri-electrical properties, with potential uses in the design of devices

Ferroelectric properties of BaTiO3/PbZr0.2Ti.08O3 bilayer thin film

Science.gov (United States)

Salev, Pavel; Yang, Chun; Grigoriev, Alexei

2014-03-01

The thin film ferroelectric BaTiO3/PbZr0.2Ti0.8O3 bilayer was epitaxially grown on SrRuO3/SrTiO3 substrate by RF sputtering. Electrical measurements of polarization switching revealed two different switching regimes - a small ferroelectric hysteresis loop at low applied voltage and a larger loop at a high voltage. The measured dielectric permittivity corresponds to weak electrostatic coupling between two layers according to Landau-Ginsburg-Devonshire theory. This weak coupling may allow for independent polarization states to exist in individual layers. This can lead to stable head-to-head and tail-to-tail polarization domain configurations, which would explain the two switching regimes observed in electrical measurements. The compensation of polarization gradient across the interface can be explained by the enhancement of interface charge carrier density due to strong bending of electron energy bands. This work was supported by NSF award DMR-1057159.

Flow method for rapid production of Batio3 nanoparticles in supercritical water

International Nuclear Information System (INIS)

Atashfaraz, M.; Shariati-Niassar, M.; Ohara, Satoshi; Takami, S.; Umetsu, M.; Naka, T.; Adschiri, T.

2006-01-01

Fine BaTiO 3 nanoparticles were obtained by hydrothermal synthesis under supercritical conditions with batch and flow type experimental methods. Mixture of barium hydroxide and titanium oxide starting solution was treated in the supercritical wafer at 400 d eg C and 30 MPa. The size of nanoparticles synthesized in the flow type experiment was smaller than that in the batch type. Rapid heating in a flow, reactor is effective to synthesize smaller size and narrower particle size distribution for the BaTiO 3 , nanoparticles. The mechanism for this result was discussed based on the solubility of titanium oxide

Deposition barium titanate (BaTiO3) doped lanthanum with chemical solution deposition

International Nuclear Information System (INIS)

Iriani, Y.; Nurhadi, N.; Jamaludin, A.

2016-01-01

Deposition of Barium Titanate (BaTiO 3 ) thin films used Chemical Solution Deposition (CSD) method and prepared with spin coater. BaTiO 3 is doped with lanthanum, 1%, 2%, and 3%. The thermal process use annealing temperature 900°C and holding time for 3 hours. The result of characterization with x-ray diffraction (XRD) equipment show that the addition of La 3+ doped on Barium Titanate caused the change of angle diffraction.The result of refine with GSAS software shows that lanthanum have been included in the structure of BaTiO 3 . Increasing mol dopant La 3+ cause lattice parameter and crystal volume become smaller. Characterization result using Scanning Electron Microscopy (SEM) equipment show that grain size (grain size) become smaller with increasing mole dopant (x) La 3+ . The result of characterization using Sawyer Tower methods show that all the samples (Barium Titanante and Barium Titanate doped lanthanum) are ferroelectric material. Increasing of mole dopant La 3+ cause smaller coercive field and remanent polarization increases. (paper)

Band-offsets at BaTiO3/Cu2O heterojunction and enhanced photoelectrochemical response: theory and experiment(Conference Presentation)

Science.gov (United States)

Sharma, Dipika; Satsangi, Vibha R.; Dass Kaura, Sahab; Shrivastav, Rohit; Waghmare, Umesh V.

2016-10-01

Band-offsets at BaTiO3/Cu2O heterojunction and enhanced photoelectrochemical response: theory and experiment Dipika Sharmaa, Vibha R. Satsangib, Rohit Shrivastava, Umesh V. Waghmarec, Sahab Dassa aDepartment of Chemistry, Dayalbagh Educational Institute, Agra-282 110 (India) bDepartment of Physics and Computer Sciences, Dayalbagh Educational Institute, Agra-282 110 (India) cTheoretical Sciences Unit, Jawaharlal Nehru Centre for Advanced Scientific Research, Jakkur, Bangalore-560 064 (India) * Phone: +91-9219695960. Fax: +91-562-2801226. E-mail: drsahabdas@gmail.com. Study on photoelectrochemical activity of pristine BaTiO3, Cu2O and BaTiO3/Cu2O heterojunction has been carried out using DFT based band offsets and charge carriers effective mass calculations and their experimental verification. The results of DFT calculations show that BaTiO3 and Cu2O have staggered type band alignment after the heterojunction formation and high mobility of electrons in Cu2O as compared to the electrons in BaTiO3. Staggered type band edges alignment and high mobility of electrons and holes improved the separation of photo-generated charge carriers in BaTiO3/Cu2O heterojunction. To validate the theoretical results experiments were carried out on pristine BaTiO3, Cu2O and BaTiO3/Cu2O heterojunction with varying thickness of Cu2O. All samples were characterized by X- Ray Diffractometer, SEM and UV-Vis spectrometry. Nanostructured thin films of pristine BaTiO3, Cu2O and BaTiO3/Cu2O heterojunction were used as photoelectrode in the photoelectrochemical cell for water splitting reaction. Maximum photocurrent density of 1.44 mA/cm2 at 0.90 V/SCE was exhibited by 442 nm thick BaTiO3/Cu2O heterojunction photoelectrode Increased photocurrent density and enhanced photoconversion efficiency, exhibited by the heterojunction may be attributed to improved conductivity and enhanced separation of the photogenerated carriers at the BaTiO3/Cu2O interface. The experimental results and first

Evolución Microestructural de Materiales Cerámicos de BaTiO3 Dopados con Antimonio

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Villegas, M.

1999-10-01

Full Text Available Ceramic materials based on BaTiO3 modified with small amounts of antimony show interesting electric properties which make them valuable for electronic industry. These properties depend on the microestructure of the material, which is controlled by both the dopant concentration and the doping process. The aim of the present work is to study the microstructure development of Sb-doped BaTiO3 materials for concentrations ranging from 0.05 to 0.6 mol%. Doping was carried out following two different methods, the traditional mixing of oxides and surface doping starting from Sb(O(CH3CH33. Materials sintered between 1300-1400ºC show quite different microstructure. For surface doped materials, a Sb2O3 concentration of 0.05 mol % leads to well densified matrials with homogeneous fine-grained microstructure. On the other hand, the traditional oxide doped materials show exaggerated grain growth.Los materiales cerámicos basados en titanato de bario con pequeñas cantidades de antimonio, exhiben interesantes propiedades que hacen posible su aplicación en la fabricación de dispositivos electrónicos. Estas propiedades dependen de la microestructura final del material, que está a su vez condicionada por la concentración de dopante y la vía utilizada para su incorporación. En este trabajo se estudia la evolución microestructural de materiales de BaTiO3 dopados con Sb en concentraciones entre 0.05 y 0.60 % mol. El dopado se ha realizado por la vía clásica a partir de Sb2O3 y mediante el proceso de dopado en superficie a partir de Sb(O(CH3CH33. Los materiales sinterizados en el intervalo de temperaturas comprendido entre 1300 y 1400ºC, muestran una microestructura bien diferenciada. Para los materiales dopados en superficie, una concentración equivalente de 0.05 % mol de Sb2O3 permite obtener materiales con elevada densidad y microestructura homogénea con tamaño de grano controlado. En el caso del material dopado por la vía clásica se observa

Microwave-Hydrothermal Synthesis and Characterization of High-Purity Nb Doped BaTiO3 Nanocrystals

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A. Khanfekr

2014-01-01

Full Text Available The synthesis of Nb doped BaTiO3 has been investigated under Microwave-Hydrothermal (MH conditions in the temperature of 150°C for only 2 h using C16H36O4Ti, BaH2O2.8H2O and NbCl5 as Ba, Ti and  Nb sources, respectively.  Typical experiments performed on MH processing have not yet reported for Nb doped BaTiO3.  In the MH process, the formation of high purity nano tetragonal Nb-BaTiO3 was strongly enhanced. New hydrothermal method was used instead of the previous solid state reaction for the BaTiO3±Nb2O3 system. The new method uses high pressure to create nano dimension particles in a lower time and temperature. In case of the phase evolution studies, the XRD pattern measurements and Raman spectroscopy were performed. TEM and FE-SEM images were taken for the detailed analysis of the particle size, surface and morphology.  Synthesis of Nb doped BaTiO3 with the Microwave-hydrothermal provides an advantage of fast crystallization and reduced crystal size when compared to existing methods.

Structural evolution of Ba8Ti3Nb4O24 from BaTiO3 using a series of Ba(Ti1−5xNb4x)O3 solid solutions

International Nuclear Information System (INIS)

Barrientos Hernández, F.R.; Lira Hernández, I.A.; Gómez Yáñez, C.; Arenas Flores, A.; Cabrera Sierra, R.; Pérez Labra, M.

2014-01-01

Highlights: • The evolution phase Ba 8 Ti 3 Nb 4 O 24 was obtained through the mechanism Ba(Ti 1-5x Nb 4x )O 3 . • Addition of niobium can accelerate grain growth of BaTiO 3 ceramics. • Ba 8 Ti 3 Nb 4 O 24 presents a dielectric loss of 0.0035 and permittivity value of 54.6. • Electrical measurements showed that Nb 5+ content drops Curie temperature. • Samples with x ⩾ 0.0625 shows an insulating behavior. -- Abstract: In this work, the structural evolution of hexagonal phase Ba 8 Ti 3 Nb 4 O 24 by adding Nb 2 O 5 to perovskite structure of BaTiO 3 was investigated. The compositions Ba(Ti 1-5x Nb 4x )O 3 ceramics, with 0.00025 ⩽ x ⩽ 0.125 were prepared by the conventional solid state route in air atmosphere, the powders precursors, BaTiO 3 , BaCO 3 and Nb 2 O 5 , were mixed in stoichiometric proportions and ground in a ball mill using alumina balls and acetone. The mixed powders were calcined at temperatures up to 1500 °C. The phase transformation of Ba 8 Ti 3 Nb 4 O 24 from BaTiO 3 was studied by DRX, Raman spectroscopy, SEM, electrical measurements (relative permittivity and P–E hysteresis loops); Rietveld’s refinement was used to structurally characterize the samples. For the devices obtained capacitance was measured at 1 kHz; with these values we calculated the relative permittivity. The samples show typical P–E hysteresis loops at room temperature accompanied by saturation polarization (Ps) and remnant polarization (Pr). The DRX and Rietveld’s refinement results show x ⩽ 0.01 has a ferroelectric behavior. When the doped level is increased x ⩾ 0.02, a peak displacement is observed, this is due to the phase transformation of tetragonal to cubic into the unit cell. Finally, with x = 0.125 the crystal structure transforms to the characteristic hexagonal phase Ba 8 Ti 3 Nb 4 O 24 which resonates at microwave frequencies

Structural and electrical characterization of (BaTiO3)x(La0.67Sr0.33MnO3)1-x ceramic composites

International Nuclear Information System (INIS)

Gaffoor, Abdul; Ravinder, D.; Joshi, U.S.; Mistry, B.V.; Joshi, Nikhail G.; Chayya, U.V.; Gadhvi, M.R.

2012-01-01

Multiferroic materials with the coexistence of at least two ferroic orders (ferroelectric, (anti-)ferromagnetic, and ferroelastic) have recently drawn ever-increasing interest due to their potential for applications as multifunctional devices. Among them, the coexistence of ferroelectricity and ferromagnetism is highly desired. But only their coexistence is not enough; of most important is to require a strong coupling interaction between two ferroic orders. Ceramic composite of well known ferromagnetic metallic manganite La 0.67 Sr 0.33 MnO 3 (LSMO) is systematically substituted by ferroelectric oxide BaTiO 3 (BTO). Samples with generic formula (BTO) x (LSMO) 1-x (x = 0.0 to 1.0, in step of 0.2) were synthesized by standard double sintering method. XRD show major perovskite LSMO phase upto x=0.6. However mixed phases were detected for almost all the x value except end points. Temperature dependent DC resistivity exhibit systematic metallic to insulator transformation with increasing x. Frequency dependent dielectric constants show a linear decrease over 10 MHz, whereas the loss tangent found to increase abnormally with frequency, with increasing x. Electric field dependent polarization show a broad hysteresis for x e' 0.6. (author)

The effect of inter-granular constraints on the response of polycrystalline piezoelectric ceramics at the surface and in the bulk

Science.gov (United States)

Hossain, Mohammad J.; Wang, Zhiyang; Khansur, Neamul H.; Kimpton, Justin A.; Oddershede, Jette; Daniels, John E.

2016-08-01

The electro-mechanical coupling mechanisms in polycrystalline ferroelectric materials, including a soft PbZrxTi1-xO3 (PZT) and lead-free 0.9375(Bi1/2Na1/2)TiO3-0.0625BaTiO3 (BNT-6.25BT), have been studied using a surface sensitive low-energy (12.4 keV) and bulk sensitive high-energy (73 keV) synchrotron X-ray diffraction with in situ electric fields. The results show that for tetragonal PZT at a maximum electric field of 2.8 kV/mm, the electric-field-induced lattice strain (ɛ111) is 20% higher at the surface than in the bulk, and non-180° ferroelectric domain texture (as indicated by the intensity ratio I002/I200) is 16% higher at the surface. In the case of BNT-6.25BT, which is pseudo-cubic up to fields of 2 kV/mm, lattice strains, ɛ111 and ɛ200, are 15% and 20% higher at the surface, while in the mixed tetragonal and rhombohedral phases at 5 kV/mm, the domain texture indicated by the intensity ratio, I 111 / I 11 1 ¯ and I002/I200, are 12% and 10% higher at the surface than in the bulk, respectively. The observed difference in the strain contributions between the surface and bulk is suggested to result from the fact that surface grains are not constrained in three dimensions, and consequently, domain reorientation and lattice expansion in surface grains are promoted. It is suggested that the magnitude of property difference between the surface and bulk is higher for the PZT than for BNT-6.25BT due to the level of anisotropy in the strain mechanism. The comparison of the results from different methods demonstrates that the intergranular constraints have a significant influence on the electric-field-induced electro-mechanical responses in polycrystalline ferroelectrics. These results have implications for the design of higher performance polycrystalline piezoelectrics.

The effect of inter-granular constraints on the response of polycrystalline piezoelectric ceramics at the surface and in the bulk

DEFF Research Database (Denmark)

Hossain, Mohammad J.; Wang, Zhiyang; Khansur, Neamul H.

2016-01-01

V) synchrotron X-ray diffraction with in situ electric fields. The results show that for tetragonal PZT at a maximum electric field of 2.8 kV/mm, the electric-field-induced lattice strain (ε111) is 20% higher at the surface than in the bulk, and non-180° ferroelectric domain texture (as indicated......The electro-mechanical coupling mechanisms in polycrystalline ferroelectric materials, including a soft PbZrxTi1−xO3 (PZT) and lead-free 0.9375(Bi1/2Na1/2)TiO3-0.0625BaTiO3 (BNT-6.25BT), have been studied using a surface sensitive low-energy (12.4 keV) and bulk sensitive high-energy (73 ke...... by the intensity ratio I002/I200) is 16% higher at the surface. In the case of BNT-6.25BT, which is pseudo-cubic up to fields of 2 kV/mm, lattice strains, ε111 and ε200, are 15% and 20% higher at the surface, while in the mixed tetragonal and rhombohedral phases at 5 kV/mm, the domain texture indicated...

Dynamics of ferroelectric nanodomains in BaTiO3 epitaxial thin films via piezoresponse force microscopy

International Nuclear Information System (INIS)

Pertsev, N A; Petraru, A; Kohlstedt, H; Waser, R; Bdikin, I K; Kiselev, D; Kholkin, A L

2008-01-01

Ferroelectric nanodomains were created in BaTiO 3 thin films by applying a voltage to a sharp conducting tip of a scanning force microscope (SFM). The films were epitaxially grown on SrRuO 3 -covered (001)-oriented SrTiO 3 substrates by a high-pressure sputtering. They appeared to be single-crystalline with the (001) crystallographic orientation relative to the substrate. Using the piezoresponse mode of the SFM to detect the out-of-plane film polarization, the domain sizes were measured as a function of the applied writing voltage and the pulse time. It was found that the time dependence of the domain diameter in a 60 nm thick BaTiO 3 film deviates significantly from the logarithmic law observed earlier in Pb(Zr 0.2 Ti 0.8 )O 3 (PZT) films. At a given writing time, the domain size increases nonlinearly with increasing applied voltage, in contrast to the linear behavior reported earlier for PZT films and LiNbO 3 single crystals. The dynamics of domain growth is analyzed theoretically taking into account the strong inhomogeneity of the external electric field in the film and the influence of the bottom electrode. It is shown that the observed writing time and voltage dependences of the domain size can be explained by the domain-wall creep in the presence of random-bond disorder

Synthesis and electrical properties of BaBiO ₃ and high resistivity BaTiO ₃ –BaBiO ₃ ceramics

Energy Technology Data Exchange (ETDEWEB)

Kumar, Nitish [Oregon State Univ., Corvallis, OR (United States); Univ. of New South Wales, Sydney, NSW (Australia); Golledge, Stephen L. [Univ. of Oregon, Eugene, OR (United States); Cann, David P. [Oregon State Univ., Corvallis, OR (United States)

2016-12-01

Ceramics of the composition BaBiO3 (BB) were sintered in oxygen to obtain a single phase with monoclinic II2/mm symmetry as suggested by high-resolution X-ray diffraction. X-ray photoelectron spectroscopy confirmed the presence of bismuth in two valence states - 3+ and 5+. Optical spectroscopy showed presence of a direct bandgap at ~ 2.2eV and a possible indirect bandgap at ~ 0.9eV. This combined with determination of the activation energy for conduction of 0.25eV, as obtained from ac impedance spectroscopy, suggested that a polaron-mediated conduction mechanism was prevalent in BB. The BB ceramics were crushed, mixed with BaTiO3 (BT), and sintered to obtain BT–BB solid solutions. All the ceramics had tetragonal symmetry and exhibited a normal ferroelectric-like dielectric response. Using ac impedance and optical spectroscopy, it was shown that resistivity values of BT–BB were orders of magnitude higher than BT or BB alone, indicating a change in the fundamental defect equilibrium conditions. A shift in the site occupancy of Bi to the A-site is proposed to be the mechanism for the increased electrical resistivity.

Ferroelectric BaTiO3 thin films on Ti substrate fabricated using pulsed-laser deposition.

Science.gov (United States)

He, J; Jiang, J C; Liu, J; Collins, G; Chen, C L; Lin, B; Giurgiutiu, V; Guo, R Y; Bhalla, A; Meletis, E I

2010-09-01

We report on the fabrication of ferroelectric BaTiO3 thin films on titanium substrates using pulsed laser deposition and their microstructures and properties. Electron microscopy studies reveal that BaTiO3 films are composed of crystalline assemblage of nanopillars with average cross sections from 100 nm to 200 nm. The BaTiO3 films have good interface structures and strong adhesion with respect to Ti substrates by forming a rutile TiO2 intermediate layer with a gradient microstructure. The room temperature ferroelectric polarization measurements show that the as-deposited BTO films possess nearly the same spontaneous polarization as the bulk BTO ceramics indicating formation of ferroelectric domains in the films. Successful fabrication of such ferroelectric films on Ti has significant importance for the development of new applications such as structural health monitoring spanning from aerospace to civil infrastructure. The work can be extended to integrate other ferroelectric oxide films with various promising properties to monitor the structural health of materials.

Properties of TiO2 prepared by acid treatment of BaTiO3

International Nuclear Information System (INIS)

Okada, Kiyoshi; Yanagisawa, Tomoki; Kameshima, Yoshikazu; Nakajima, Akira

2007-01-01

TiO 3 powders were prepared by acid treatment of BaTiO 3 and their properties were investigated. The BaTiO 3 powder was subjected to HNO 3 in concentrations ranging from 10 -3 to 8 M at 90 deg. C for 0.5-6 h. Dissolution of BaTiO 3 and precipitation of TiO 2 occurred at acid concentrations of 2-5 M. BaTiO 3 dissolves completely to form a clear solution at reaction times of 0.5-1 h, but a rutile precipitate is formed after 2 h of acid treatment. By contrast, anatase is precipitated by adjusting the pH of the clear solution to 2-3 using NaOH or NH 4 OH solution. The rutile crystals were small and rod-shaped, consisting of many small coherent domains connected by grain boundaries with small inclination angles and edge dislocations, giving them a high specific surface area (S BET ). With increasing HNO 3 concentration, the S BET value increased from 100 to 170 m 2 /g while the crystallite size decreased from 25 to 11 nm. The anatase crystals obtained here were very small equi-axial particles with a smaller crystallite size than the rutile and S BET values of about 270 m 2 /g (higher than the rutile samples). The photocatalytic activity of these TiO 2 was determined from the decomposition rate of Methylene Blue under ultraviolet irradiation. Higher decomposition rates were obtained with larger crystallite sizes resulting from heat treatment. The maximum decomposition rates were obtained in samples heated at 500-600 deg. C. The photocatalytic activity of the TiO 2 was found to depend more strongly on the sample crystallite size than on S BET

Interface control in BaTiO3 based supercapacitors

Science.gov (United States)

Maglione, Mario; Elissalde, Catherine; Chung, U.-Chan

2010-03-01

Core shell BaTiO3 based particles sintered using advanced processes provide a high control of grain boundaries in bulk composites. As a result, supercapacitor behavior was evidenced which came from the balance between inner grain conductivity and grain boundary dielectric barrier. Thanks to the core-shell structure of the starting particles, improved control of the effective dielectric parameters can be achieved.

Zn2+ in-situ substitution behavior during the formation of BaTiO3 coatings from plasma-sprayed powders collected in liquid nitrogen

Science.gov (United States)

Liu, Zhe; Xing, Zhiguo; Wang, Haidou; Xue, Zifan; Chen, Shuying; Cui, Xiufang; Jin, Guo

2018-04-01

The dielectric performance of BaTiO3 ceramic coatings is enhanced significantly by the addition of ZnO. In this study, the maximum relative permittivity value (εr ≈ 923) was measured in BaTiO3 coatings with ZnO added at 6 wt%. The Curie temperature (Tc) was in the range of 111 °C-121 °C for all of the ZnO-modified BaTiO3 coatings. Tc shifted to low temperatures as the ZnO content increased. Detailed analyses were performed to determine the phase composition and optical band gaps of powders collected in liquid nitrogen, which showed that the Zn2+ ions were incorporated into the BaTiO3 lattice where they substituted into the Ti4+ sites, and the composite powders (BaTiO3 + 6 wt% ZnO) tolerated high temperatures in the plasma beam. In addition, some residual Zn accumulated in the grain boundary in the form of ZnO. X-ray diffraction and Raman spectroscopy showed that the substitution led to changes in the compositional and structural properties. The red shift in the optical band gap of BaTiO3 indicated that the ZnTi'' defects caused by the dopants acted as carriers in the doped BaTiO3 coatings.

Multiferroic behavior on nanometric La2/3Ca1/3MnO3 / BaTiO3 bilayers

Science.gov (United States)

Prieto, Pedro; Ordoñez, John Edward; Gomez, Maria Elena; Lopera, Wilson

2014-03-01

We have deposited bilayers of the FM La2/3Ca1/3MnO3 and FE BaTiO3 as a route to design systems with artificial magnetoelectric coupling on LCMO/BTO/Nb:STO system. We maintain a fixed magnetic layer thickness (tLCMO = 48 nm) and varying the thickness of the ferroelectric layer (tBTO = 20, 50, 100 nm). We analyze the influence of the thickness ratio (tBTO/ tLCMO) in electrical and magnetic properties of manganite. From X-ray diffraction analysis we observed that the samples grew textured. Magnetization and transport measurements indicate a possible multiferroic behavior in the bilayer. We found an increase in the Curie and metal-insulator transition temperature in the bilayer in comparison with those for LCMO (48nm)/STO. Hysteresis loops on bilayers show ferromagnetic behavior. This work has been supported by the ``El Patrimonio Autónomo Fondo Nacional de Financiamiento para CT&I FJC'' Colciencias-CENM Research Projects: No. 1106-48-925531 and CI7917-CC 10510 contract 0002-2013 COLCIENCIAS-UNIVALLE.

Arsenic implantation into polycrystalline silicon and diffusion to silicon substrate

International Nuclear Information System (INIS)

Tsukamoto, K.; Akasaka, Y.; Horie, K.

1977-01-01

Arsenic implantation into polycrystalline silicon and drive-in diffusion to silicon substrate have been investigated by MeV He + backscattering analysis and also by electrical measurements. The range distributions of arsenic implanted into polycrystalline silicon are well fitted to Gaussian distributions over the energy range 60--350 keV. The measured values of R/sub P/ and ΔR/sub P/ are about 10 and 20% larger than the theoretical predictions, respectively. The effective diffusion coefficient of arsenic implanted into polycrystalline silicon is expressed as D=0.63 exp[(-3.22 eV/kT)] and is independent of the arsenic concentration. The drive-in diffusion of arsenic from the implanted polycrystalline silicon layer into the silicon substrate is significantly affected by the diffusion atmosphere. In the N 2 atmosphere, a considerable amount of arsenic atoms diffuses outward to the ambient. The outdiffusion can be suppressed by encapsulation with Si 3 N 4 . In the oxidizing atmosphere, arsenic atoms are driven inward by growing SiO 2 due to the segregation between SiO 2 and polycrystalline silicon, and consequently the drive-in diffusion of arsenic is enhanced. At the interface between the polycrystalline silicon layer and the silicon substrate, arsenic atoms are likely to segregate at the polycrystalline silicon side

Linear electro-optical properties of tetragonal BaTiO 3

Indian Academy of Sciences (India)

Linear optical susceptibility and clamped linear electro-optical tensor coefficients of tetragonal BaTiO3 are calculated using a formalism based on bond charge theory. Calculated values are in close agreement with experimental data. The covalent Ti–O bonds constituting distorted TiO6 octahedral groups are found to be ...

Effects of A-site nonstoichiometry on oxide ion conduction in 0.94Bi0.5Na0.5TiO3–0.06BaTiO3 ceramics

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Sasiporn Prasertpalichat

2016-06-01

Full Text Available Lead free 0.94(Bi0.5Na0.5TiO3–0.06BaTiO3 ceramics were prepared by conventional solid-state mixed oxide route with the A-site stoichiometry modified to incorporate donor-doping (through Bi-excess and acceptor-doping (through Na-excess. Both stoichiometric and nonstoichiometric ceramics exhibited a single perovskite phase with pseudo-cubic symmetry. A significant improvement in the dielectric properties was observed in Bi-excess compositions and a deterioration in the dielectric properties was observed in Na-excess compositions. Impedance spectroscopy was utilized to analyze the effects of A-site nonstoichiometry on conduction mechanisms. Compositions with Bi-excess resulted in an electrically homogeneous microstructure with an increase in resistivity by ∼3–4 orders of magnitude and an associated activation energy of 1.57eV which was close to half of the optical bandgap. In contrast, an electrically heterogeneous microstructure was observed in both the stoichiometric and Na-excess compositions. In addition, the Na-excess compositions exhibited low resistivities (ρ∼103Ω-cm with characteristic peaks in the impedance data comparable to the recent observations of oxide ion conduction in (Bi0.5Na0.5TiO3. Long term annealing studies were also conducted at 800∘C to identify changes in crystal structure and electrical properties. The results of this study demonstrates that the dielectric and electrical properties of 0.94(Bi0.5Na0.5TiO3–0.06BaTiO3 ceramics are very sensitive to Bi/Na stoichiometry.

HRTEM analysis on nanocrystalline BaTiO3 and PbTiO3: size effects on ferroelectric phase transition temperature

International Nuclear Information System (INIS)

Bursill, L.A.; Jiang, B.; Peng, J.L.; Zhong, W.L.; Zhang, P.L.

1997-01-01

High-Resolution Transmission Electron Microscopic studies of nanocrystaline particles of BaTiO 3 and PbTiO 3 are reported. There are characteristic differences observed for BaTiO 3 prepared using sol gel (SG) and steric acid gel (SAG) methods. The former exhibit a critical size below which there is no paraelectric/ferroelectric phase transition, whereas BaTiO 3 prepared via the SAG route remained cubic for all conditions. The SAG preparations always showed chemical intergrowth defects whereas the SG preparations were single phase. Atomic resolution images of both varieties showed interesting surface steps and surface relaxations/reconstructions of some facets. Nanocrystalline PbTiO 3 prepared by the SG route remains tetragonal, albeit with decreasing c/a ratio, down to 25nm diameter. HRTEM observations of nanocrystalline PbTiO 3 are also presented. X-ray diffraction, dielectric and Raman scattering measurements also demonstrate pronounced size effects. The relationship between the observed nanostructures and size effects on the physical properties is discussed. 6 refs., 1 tab., 6 figs

Giant strain with ultra-low hysteresis and high temperature stability in grain oriented lead-free K0.5Bi0.5TiO3-BaTiO3-Na0.5Bi0.5TiO3 piezoelectric materials.

Science.gov (United States)

Maurya, Deepam; Zhou, Yuan; Wang, Yaojin; Yan, Yongke; Li, Jiefang; Viehland, Dwight; Priya, Shashank

2015-02-26

We synthesized grain-oriented lead-free piezoelectric materials in (K0.5Bi0.5TiO3-BaTiO3-xNa0.5Bi0.5TiO3 (KBT-BT-NBT) system with high degree of texturing along the [001]c (c-cubic) crystallographic orientation. We demonstrate giant field induced strain (~0.48%) with an ultra-low hysteresis along with enhanced piezoelectric response (d33 ~ 190pC/N) and high temperature stability (~160°C). Transmission electron microscopy (TEM) and piezoresponse force microscopy (PFM) results demonstrate smaller size highly ordered domain structure in grain-oriented specimen relative to the conventional polycrystalline ceramics. The grain oriented specimens exhibited a high degree of non-180° domain switching, in comparison to the randomly axed ones. These results indicate the effective solution to the lead-free piezoelectric materials.

BaTiO3–P(VDF-HFP) nanocomposite dielectrics—Influence of surface modification and dispersion additives

International Nuclear Information System (INIS)

Ehrhardt, Claudia; Fettkenhauer, Christian; Glenneberg, Jens; Münchgesang, Wolfram; Pientschke, Christoph; Großmann, Thomas; Zenkner, Mandy; Wagner, Gerald; Leipner, Hartmut S.; Buchsteiner, Alexandra; Diestelhorst, Martin; Lemm, Sebastian; Beige, Horst; Ebbinghaus, Stefan G.

2013-01-01

Highlights: • Polymer composites were prepared using a sol–gel synthesized BaTiO 3 . • BaTiO 3 surface hydroxyle groups act as linkers for surfactant molecules. • The effect of chemical adjustment between surfactant and polymer host is studied. • A positive effect of an additional dispersant was found. • Dielectric properties of the resulting composite films are presented. -- Abstract: We report on BaTiO 3 –polymer composites as dielectrics for film capacitors. BaTiO 3 was synthesized by a sol–gel soft-chemistry method leading to spherical nanoparticles with a high degree of surface hydroxyl groups which turned out to be important for the bonding of surfactant molecules. As surfactants, n-octylphosphonic acid and 2,3,4,5,6-pentafluorobenzyl phosphonic acid were used to inhibit particle agglomeration and to improve the wetting behaviour with the polymer. The phosphonic acid-coated BaTiO 3 nanoparticles were dispersed in solutions of poly(vinylidefluoride-co-hexafluoropropylene). Composite films were prepared by the spin-coating technique. A systematic study was performed on the influence of varying oxide fractions, different surfactants and the effect of additional dispersion aids such as sodium dodecyl sulphate or BYK-W 9010 on the quality and dielectric properties of the films obtained. The chemical adjustment of the 2,3,4,5,6-pentaflourobenzyl phosphonic acid within the fluorinated organic host form a more uniform particle distribution and increase relative permittivity of the resulting composite material compared to the unflourinated surfactant. Additionally, an enhancement of the relative permittivity can be realized by adding of dispersants. These two components can increase the relative permittivity by factor 5 compared to the pure polymer material

Ferroelectric BaTiO3 and LiNbO3 Nanoparticles Dispersed in Ferroelectric Liquid Crystal Mixtures: Electrooptic and Dielectric (Postprint)

Science.gov (United States)

2016-10-14

strength for non- doped LF4 and LiNbO3/LF4 nanocolloids at temperature 30C. 146 R. K . SHUKLA ET AL. 6 Distribution A. Approved for public release (PA...AFRL-RX-WP-JA-2017-0210 FERROELECTRIC BaTiO3 AND LiNbO3 NANOPARTICLES DISPERSED IN FERROELECTRIC LIQUID CRYSTAL MIXTURES: ELECTROOPTIC...COMMAND UNITED STATES AIR FORCE Ferroelectric BaTiO3 and LiNbO3 nanoparticles dispersed in ferroelectric liquid crystal mixtures: Electrooptic and

Thermal analysis of formation of nano-crystalline BaTiO3 using Ba(NO32 and TiO2

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Md. Jawed Ansaree

2015-12-01

Full Text Available The reaction of Ba(NO32 with TiO2 was studied by thermogravimetric (TG and differential scanning calorimetric (DSC techniques up to 1000 °C and in nitrogen atmosphere. It was found that the formation of BaTiO3 takes place above 600 °C and that precursor mixing time and heating rate have no effect on the reaction temperature. BaTiO3 powder was prepared by calcination of Ba(NO32 and TiO2 precursor mixture at 800 °C for 8 h. X-ray diffraction analysis of the synthesized BaTiO3 confirmed the formation of tetragonal phase with lattice parameters a = 3.9950±0.0003 Å and c = 4.0318±0.0004 Å. Thermal analysis of the synthesized BaTiO3 powder showed weight loss within temperature range 40–1000 °C of only 0.40%. This small amount of weight loss was connected with some impurity phase, and identified as BaCO3 using Fourier transform infrared (FTIR technique.

Enhanced thermoelectric properties of polycrystalline Bi2Te3 core fibers with preferentially oriented nanosheets

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Min Sun

2018-03-01

Full Text Available Bi2Te3-based materials have been reported to be one of the best room-temperature thermoelectric materials, and it is a challenge to substantially improve their thermoelectric properties. Here novel Bi2Te3 core fibers with borosilicate glass cladding were fabricated utilizing a modified molten core drawing method. The Bi2Te3 core of the fiber was found to consist of hexagonal polycrystalline nanosheets, and polycrystalline nanosheets had a preferential orientation; in other words, the hexagonal Bi2Te3 lamellar cleavage more tended to be parallel to the symmetry axis of the fibers. Compared with a homemade 3-mm-diameter Bi2Te3 rod, the polycrystalline nanosheets’ preferential orientation in the 89-μm-diameter Bi2Te3 core increased its electrical conductivity, but deduced its Seebeck coefficient. The Bi2Te3 core exhibits an ultrahigh ZT of 0.73 at 300 K, which is 232% higher than that of the Bi2Te3 rod. The demonstration of fibers with oriented nano-polycrystalline core and the integration with an efficient fabrication technique will pave the way for the fabrication of high-performance thermoelectric fibers.

Highly uniform bipolar resistive switching characteristics in TiO2/BaTiO3/TiO2 multilayer

International Nuclear Information System (INIS)

Ma, W. J.; Zhang, X. Y.; Wang, Ying; Zheng, Yue; Lin, S. P.; Luo, J. M.; Wang, B.; Li, Z. X.

2013-01-01

Nanoscale multilayer structure TiO 2 /BaTiO 3 /TiO 2 has been fabricated on Pt/Ti/SiO 2 /Si substrate by chemical solution deposition method. Highly uniform bipolar resistive switching (BRS) characteristics have been observed in Pt/TiO 2 /BaTiO 3 /TiO 2 /Pt cells. Analysis of the current-voltage relationship demonstrates that the space-charge-limited current conduction controlled by the localized oxygen vacancies should be important to the resistive switching behavior. X-ray photoelectron spectroscopy results indicated that oxygen vacancies in TiO 2 play a crucial role in the resistive switching phenomenon and the introduced TiO 2 /BaTiO 3 interfaces result in the high uniformity of bipolar resistive switching characteristics

Luminescent Properties of Surface Functionalized BaTiO3 Embedded in Poly(methyl methacrylate)

Science.gov (United States)

Requena, Sebastian; Lacoul, Srijan; Strzhemechny, Yuri M.

2014-01-01

As-received BaTiO3 nanopowders of average grain sizes 50 nm and 100 nm were functionalized by (3-aminopropyl)triethoxysilane (APTES) and mixed with poly(methyl methacrylate)/toluene solution. The nanocomposite solution was spin coated on Si substrates to form thin films. The photoluminescence spectrum of the pure powder was composed of a bandgap emission at 3.0 eV and multiple bands centered about 2.5 eV. Surface functionalization of the BaTiO3 powder via APTES increases overall luminescence at room temperature while only enhancing bandgap emission at low-temperature. Polymer coating of the functionalized nanoparticles significantly enhances bandgap emissions while decreasing emissions associated with near-surface lattice distortions at 2.5 eV. PMID:28788468

Luminescent Properties of Surface Functionalized BaTiO3 Embedded in Poly(methyl methacrylate

Directory of Open Access Journals (Sweden)

Sebastian Requena

2014-01-01

Full Text Available As-received BaTiO3 nanopowders of average grain sizes 50 nm and 100 nm were functionalized by (3-aminopropyltriethoxysilane (APTES and mixed with poly(methyl methacrylate/toluene solution. The nanocomposite solution was spin coated on Si substrates to form thin films. The photoluminescence spectrum of the pure powder was composed of a bandgap emission at 3.0 eV and multiple bands centered about 2.5 eV. Surface functionalization of the BaTiO3 powder via APTES increases overall luminescence at room temperature while only enhancing bandgap emission at low-temperature. Polymer coating of the functionalized nanoparticles significantly enhances bandgap emissions while decreasing emissions associated with near-surface lattice distortions at 2.5 eV.

Reflectance of Co- and Nb-doped BaTiO3 for photon energies from 1.8 to 70 eV

International Nuclear Information System (INIS)

Goudonnet, J.P.; Godefroy, G.; Inagaki, T.; Moretti, P.; Williams, M.W.; Arakawa, E.T.

1985-01-01

The reflectance spectra of Co- and Nb-doped BaTiO 3 crystals have been measured for photon energies from 1.8 to 70 eV. For both types of crystal, structures observed in the 1.8 to 2.3 eV range can be attributed to the presence of residual impurities. Between 2.3 and 3.2 eV the peaks in the reflectance of the Co-doped crystal are found to be of an acceptor charge transfer type. For Nb-doped crystals structures appear at the bottom of the conduction band. For energies larger than 3.2 eV the spectra are characteristic of pure BaTiO 3 crystals, in reasonable agreement with those determined by Baeuerle et al. and calculated by Michel-Calendini and Moretti. 15 refs., 4 figs., 1 tab

Oxygen 1s excitation and tetragonal distortion from core-hole effect in BaTiO3

Science.gov (United States)

Bugnet, Matthieu; Radtke, Guillaume; Botton, Gianluigi A.

2013-11-01

The accurate description of the O 1s excitation in BaTiO3 has been elusive so far. In this Rapid Communication, the electronic structure and the high-resolution electron energy-loss near-edge structures of the O K edge in tetragonal BaTiO3 are investigated using first-principles calculations. The results demonstrate a clear correlation between the broadening of the lower energy fine structure and the anisotropic effects induced by the core-hole potential, which are directly related to the structural distortion occurring in tetragonal BaTiO3. Moreover, we show that a significant improvement of the description of higher-lying structures can be obtained when correcting the energy position of the Ba 4f states. This demonstrates that the O 1s spectrum can be a very effective probe of the distortion and changes in the local electronic structure, and be used as a sensitive tool for studying new materials and ferroelectric transitions.

Morphology controlled ultrafine BaTiO3 based PVDF-HFP ...

Indian Academy of Sciences (India)

21

... for real applications. Kew Words: Polygonal, Barium Titanate, Hydrothermal, Dielectric and Sensor. 1. 2 ... structure and can be tuned further by substituting various dopants (Sr, Ca and Zr). .... Modified BaTiO3 induces less displacement of Ti and O ions along c- axis and .... sputter coated on both sides with gold. The films ...

Pyroelectrically Induced Pyro-Electro-Chemical Catalytic Activity of BaTiO3 Nanofibers under Room-Temperature Cold–Hot Cycle Excitations

OpenAIRE

Yuntao Xia; Yanmin Jia; Weiqi Qian; Xiaoli Xu; Zheng Wu; Zichen Han; Yuanting Hong; Huilin You; Muhammad Ismail; Ge Bai; Liwei Wang

2017-01-01

A pyro-electro-chemical catalytic dye decomposition using lead-free BaTiO3 nanofibers was realized under room-temperature cold–hot cycle excitation (30–47 °C) with a high Rhodamine B (RhB) decomposition efficiency ~99%, which should be ascribed to the product of pyro-electric effect and electrochemical redox reaction. Furthermore, the existence of intermediate product of hydroxyl radical in pyro-electro-chemical catalytic process was also observed. There is no significant decrease in pyro-ele...

The effect of secondary abnormal grain growth on the dielectric properties of La/Mn co-doped BaTiO3 ceramics

Directory of Open Access Journals (Sweden)

Živković Lj.M.

2006-01-01

Full Text Available La/Mn-codoped BaTiO3 systems, obtained by solid state reactions, were investigated regarding their microstructure characteristics and ferroelectric properties. Different concentrations of La2O3 were used for doping, ranging from 0.1 to 5.0 at% La, while a content of Mn was constant at 0.05 at%. For all samples sintered below the eutectic temperature (1332°C, a uniform microstructure was formed with average grain size from 1-3 μm. The appearance of secondary abnormal grains with (111 double twins grains with curved or faceted grain boundaries were observed in La/Mn BaTiO3 ceramics after sintering at temperatures above the eutectic temperature. All sintered samples exhibited a high electrical resistivity. Better dielectric performances were obtained for low doped samples (0.1 at% La sintered at 1350°C. For samples with La content above 1.0 at% a lower value in dielectric permittivity at higher sintering temperature is due to secondary abnormal grain growth, and to the presence of a non-ferroelectric phase rich in La. The Curie constant together with other dielectric parameters were also calculated.

Oxygen-vacancy defects on BaTiO3 (001) surface: a quantum chemical study

International Nuclear Information System (INIS)

Duque, Carlos; Stashans, Arvids

2003-01-01

A quantum-chemical study of technologically important BaTiO 3 crystal and oxygen-vacancy defects on its (001) surface is reported in the present work. The computations are made using a quantum-chemical method developed for periodic systems (crystals), which is based on the Hartree-Fock theory. The atomic rearrangement due to the surface creation is obtained for a pure BaTiO 3 by means of the periodic large unit cell (LUC) model and using an automated geometry optimisation procedure. The same technique is employed to study the electronic and structural properties of the material due to the presence of an O vacancy and F centre (two electrons trapped in an oxygen vacancy). The computations are carried out for both cubic and tetragonal lattices

Pyroelectrically Induced Pyro-Electro-Chemical Catalytic Activity of BaTiO3 Nanofibers under Room-Temperature Cold–Hot Cycle Excitations

Directory of Open Access Journals (Sweden)

Yuntao Xia

2017-04-01

Full Text Available A pyro-electro-chemical catalytic dye decomposition using lead-free BaTiO3 nanofibers was realized under room-temperature cold–hot cycle excitation (30–47 °C with a high Rhodamine B (RhB decomposition efficiency ~99%, which should be ascribed to the product of pyro-electric effect and electrochemical redox reaction. Furthermore, the existence of intermediate product of hydroxyl radical in pyro-electro-chemical catalytic process was also observed. There is no significant decrease in pyro-electro-chemical catalysis activity after being recycled five times. The pyro-electrically induced pyro-electro-chemical catalysis provides a high-efficient, reusable and environmentally friendly technology to remove organic pollutants from water.

Grain-size effects on thermal properties of BaTiO3 ceramics

Indian Academy of Sciences (India)

Administrator

decreasing grain size. Furthermore, the Curie temperature shifts to lower temperature with decreasing grain size. Keywords. Nanocrystalline ceramics; thermal properties; size effect. 1. Introduction. BaTiO3 has been widely used in the electronic industry for its high dielectric constant and low losses above room temperature ...

Surface structures and dielectric response of ultrafine BaTiO3 particles

International Nuclear Information System (INIS)

Jiang, B.; Peng, J.L.; Bursill, L.A.

1998-01-01

Characteristic differences are observed for the dielectric response and microstructures of BaTiO 3 nanoscale fine powders prepared using sol gel (SG) and steric acid gel (SAG) methods. The former exhibit a critical size below which there is no paraelectric/ferroelectric phase transition whereas BaTiO 3 prepared via the SAG route remained cubic for all conditions. Atomic resolution images of both varieties showed a high density of interesting surface steps and facets. Computer simulated images of surface structure models showed that the outer (100) surface was typically a BaO layer and that at corners and ledges the steps are typically finished with Ba+2 ions; i.e. the surfaces and steps are Ba-rich. Otherwise the surfaces were typically clean and free of amorphous layers. The relationship between the observed surfaces structures and theoretical models for size effects on the dielectric properties is discussed. (authors)

Phase stabilization in plasma sprayed BaTiO3

Czech Academy of Sciences Publication Activity Database

Ctibor, Pavel; Seiner, Hanuš; Sedláček, J.; Pala, Zdeněk; Vaněk, Přemysl

2013-01-01

Roč. 39, č. 5 (2013), s. 5039-5048 ISSN 0272-8842 R&D Projects: GA ČR(CZ) GA101/09/0702 Institutional support: RVO:61389021 ; RVO:61388998 ; RVO:68378271 Keywords : Spectroscopy * BaTiO3 * Plasma spraying * Spark plasma sintering Subject RIV: JH - Ceramics, Fire-Resistant Materials and Glass; BJ - Thermodynamics (UT-L); JH - Ceramics, Fire-Resistant Materials and Glass (FZU-D) Impact factor: 2.086, year: 2013 http://www.sciencedirect.com/science/article/pii/S0272884212013582

Orientation dependence of magnetoelectric coefficient in 1-3-type BaTiO3/CoFe2O4

Science.gov (United States)

Jian, Gang; Shao, Hui; Zhang, Cheng; Yan, Chao; Zhao, Ning; Song, Bo; Wong, C. P.

2018-03-01

Orientation dependence of magnetoelectric coefficient αE33 in 1-3-type BaTiO3/CoFe2O4 composites was calculated in arbitrary directions by three-dimensional coordinate transformation method. The space distributions of pc11‧, pc12‧, e31‧ for piezoelectric phase and mc11‧, mc12‧, q31‧ for magnetic phase were obtained independently using relative experimental data and original matrices for 4mm BaTiO3 and m3m CoFe2O4. Elastic stiffness coefficients show little orientation differences, while e31‧ and q31‧ exhibit high dependence on crystal orientation, with the MAX absolute e31‧ = 2.96 C/m2 and the MAX q31‧ = 556 × 10-12 m/A are found at θ = 0° and θ = 0°, ϕ = 45°, respectively. For space distribution of αE33‧, BaTiO3||[0 0 1]/CoFe2O4||[0 0 1] combination has the maximum value which applies to both 1-3 p/m (1.485 V/A) and 1-3 m/p composites (1.529 V/A). Volume fraction is quite independent of orientations of both piezoelectric and magnetic phases and the volume fraction for magnetic phase f around 0.5 obtains the largest αE33. The results suggest an approach to significantly enhancing magnetoelectric coefficient of composite multiferroic materials through crystal orientation controls of single crystals and textured ceramics.

Nitrogen induced ferromagnetism in Cobalt doped BaTiO3

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Chandrima Mitra

2012-09-01

Full Text Available The electronic structure and magnetism of Cobalt doped BaTiO3 (BaTi1−xCoxO3 is investigated. Substitutional Nitrogen on an Oxygen site is found to play an important role in inducing net magnetic moments in the system. The presence of a Nitrogen atom as nearest neighbour to a Cobalt atom is crucial in producing spin splitting of both the Nitrogen and Cobalt states thereby introducing a net local magnetic moment. The introduction of Nitrogen is further found to enhance ferromagnetic interactions between Cobalt atoms.

Quantitative evaluation of the piezoelectric response of unpoled ferroelectric ceramics from elastic and dielectric measurements: Tetragonal BaTiO3

Science.gov (United States)

Cordero, F.

2018-03-01

A method is proposed for evaluating the potential piezoelectric response, that a ferroelectric material would exhibit after full poling, from elastic and dielectric measurements of the unpoled ceramic material. The method is based on the observation that the softening in a ferroelectric phase with respect to the paraelectric phase is of piezoelectric origin, and is tested on BaTiO3. The angular averages of the piezoelectric softening in unpoled ceramics are calculated for ferroelectric phases of different symmetries. The expression of the orientational average with the piezoelectric and dielectric constants of single crystal tetragonal BaTiO3 from the literature reproduces well the softening of the Young's modulus of unpoled ceramic BaTiO3, after a correction for the porosity. The agreement is good in the temperature region sufficiently far from the Curie temperature and from the transition to the orthorhombic phase, where the effect of fluctuations should be negligible, but deviations are found outside this region, and possible reasons for this are discussed. This validates the determination of the piezoelectric response by means of purely elastic measurements on unpoled samples. The method is indirect and, for quantitative assessments, requires the knowledge of the dielectric tensor. On the other hand, it does not require poling of the sample, and therefore is insensitive to inaccuracies from incomplete poling, and can even be used with materials that cannot be poled, for example, due to excessive electrical conductivity. While the proposed example of the Young's modulus of a ceramic provides an orientational average of all the single crystal piezoelectric constants, a Resonant Ultrasound Spectroscopy measurement of a single unpoled ceramic sample through the ferroelectric transition can in principle measure all the piezoelectric constants, together with the elastic ones.

Controlled Confinement of Half-metallic 2D Electron Gas in BaTiO3/Ba2FeReO6/BaTiO3 Heterostructures: A First-principles Study

Science.gov (United States)

Saha-Dasgupta, Tanusri; Baidya, Santu; Waghmare, Umesh; Paramekanti, Arun

Using density functional theory calculations, we establish that the half-metallicity of bulk Ba2FeReO6 survives down i to 1 nm thickness in BaTiO3/Ba2FeReO6/BaTiO3 heterostructures grown along the (001) and (111) directions. The confinement of the two-dimensional (2D) electron gas in this quantum well structure arises from the suppressed hybridization between Re/Fe d states and unoccupied Ti d states, and it is further strengthened by polar fields for the (111) direction. This mechanism, distinct from the polar catastrophe, leads to an order of magnitude stronger confinement of the 2D electron gas than that at the LaAlO3/SrTiO3 interface. We further show low-energy bands of (111) heterostructure display nontrivial topological character. Our work opens up the possibility of realizing ultra-thin spintronic devices. Journal Ref: Phys. Rev. B 92, 161106(R) (2015) S.B. and T.S.D thank Department of Science and Technology, India for the support through Thematic Unit of Excellence. AP was supported by NSERC (Canada).

Enhanced output performance of a lead-free nanocomposite generator using BaTiO3 nanoparticles and nanowires filler

Science.gov (United States)

Baek, Changyeon; Yun, Jong Hyuk; Wang, Hee Seung; Wang, Ji Eun; Park, Hyeonbin; Park, Kwi-Il; Kim, Do Kyung

2018-01-01

Flexible nanocomposite generators based on piezoelectric nanoparticles (NPs)-polymeric matrix have been attracted attention as the energy harvesting device converted the electricity from the mechanical deformations. To enhance the piezo-potential difference introduced inside the piezoelectric nanocomposite, one-dimensional nanostructures such as CNTs, copper nanorods, and Ag nanowires (NWs) should be used inevitably as a dispersing agent for achieving well-distributed piezoelectric nanoparticles in an elastomer. These non-piezoelectric additives showed versatile roles; however, their toxicity to living organism has been an obstacle to realize the bio-eco-friendly flexible energy harvesters. Replacing them with piezoelectric NWs with non-toxic can be a challengeable approach to achieve not only the original purposes of additives but also the improvement of output performance. Here, we synthesized well-crystallized BaTiO3 spherical and acicular NPs via a simple hydrothermal reaction and the two-step hydrothermal reactions, respectively and produced piezoelectric nanocomposite made of piezoelectric BaTiO3 NPs and NWs without toxic dispersion enhancers. Output performance of the fabricated flexible energy harvesters with varying the composition of NPs and NWs were investigated by the well-optimized measurement system during the periodical bending and unbending. A nanocomposite-based energy harvester with 4:1 wt ratio generated the maximum open-circuit voltage and short-circuit current of 60 V and 1.1 μA, respectively.

First-principles calculations on thermodynamic properties of BaTiO3 rhombohedral phase.

Science.gov (United States)

Bandura, Andrei V; Evarestov, Robert A

2012-07-05

The calculations based on the linear combination of atomic orbitals have been performed for the low-temperature phase of BaTiO(3) crystal. Structural and electronic properties, as well as phonon frequencies were obtained using hybrid PBE0 exchange-correlation functional. The calculated frequencies and total energies at different volumes have been used to determine the equation of state and thermal contribution to the Helmholtz free energy within the quasiharmonic approximation. For the first time, the bulk modulus, volume thermal expansion coefficient, heat capacity, and Grüneisen parameters in BaTiO(3) rhombohedral phase have been estimated at zero pressure and temperatures form 0 to 200 K, based on the results of first-principles calculations. Empirical equation has been proposed to reproduce the temperature dependence of the calculated quantities. The agreement between the theoretical and experimental thermodynamic properties was found to be satisfactory. Copyright © 2012 Wiley Periodicals, Inc.

Strain-mediated magnetic response in La0.67Sr0.33MnO3/SrTiO3/La0.67Sr0.33MnO3/BaTiO3 structure

Science.gov (United States)

Swain, Anupama; Komatsu, Katsuyoshi; Itoh, Mitsuru; Taniyama, Tomoyasu; Gorige, Venkataiah

2018-05-01

Electric field controlled magnetism is an exciting area of condensed matter physics to explore the device applications at ultra-low power consumption compared to the conventional current controlled or magnetic field controlled devices. In this study, an attempt was made to demonstrate electric field controlled magnetoresistance (MR) in a tri-layer structure consisting of La0.67Sr0.33MnO3 (LSMO) (40 nm)/SrTiO3 (10 nm)/LSMO (10 nm) grown on a 500-μm-thick BaTiO3 (001) (BTO) single crystal substrate by pulsed laser deposition technique. Epitaxial growth of the trilayer structure was confirmed by x-ray diffraction measurements. Jumps observed in the temperature-dependent magnetization curve at around the structural phase transitions of BTO ensure the strain-mediated magnetoelectric coupling between LSMO and BTO layers. A significant change in MR of this structure in applied electric fields does not show any polarity dependence. The findings are related to the lattice strain-mediated magnetoelectric coupling in ferromagnetic LSMO/ferroelectric BTO heterostructures.

Zeeman perturbed nuclear quadrupole spin echo envelope modulations for spin 3/2 nuclei in polycrystalline specimens

Science.gov (United States)

Ramachandran, R.; Narasimhan, P. T.

The results of theoretical and experimental studies of Zeeman-perturbed nuclear quadrupole spin echo envelope modulations (ZSEEM) for spin 3/2 nuclei in polycrystalline specimens are presented. The response of the Zeeman-perturbed spin ensemble to resonant two pulse excitations has been calculated using the density matrix formalism. The theoretical calculation assumes a parallel orientation of the external r.f. and static Zeeman fields and an arbitrary orientation of these fields to the principal axes system of the electric field gradient. A numerical powder averaging procedure has been adopted to simulate the response of the polycrystalline specimens. Using a coherent pulsed nuclear quadrupole resonance spectrometer the ZSEEM patterns of the 35Cl nuclei have been recorded in polycrystalline specimens of potassium chlorate, barium chlorate, mercuric chloride (two sites) and antimony trichloride (two sites) using the π/2-τ-π/2 sequence. The theoretical and experimental ZSEEM patterns have been compared. In the case of mercuric chloride, the experimental 35Cl ZSEEM patterns are found to be nearly identical for the two sites and correspond to a near-zero value of the asymmetry parameter, η, of the electric field gradient tensor. The difference in the η values for the two 35Cl sites (η ˜0·06 and η˜0·16) in antimony trichloride is clearly reflected in the experimental and theoretical ZSEEM patterns. The present study indicates the feasibility of evaluating η for spin 3/2 nuclei in polycrystalline specimens from ZSEEM investigations.

Type-I pseudo-first-order phase transition induced electrocaloric effect in lead-free Bi0.5Na0.5TiO3-0.06BaTiO3 ceramics

Science.gov (United States)

Li, Feng; Chen, Guorui; Liu, Xing; Zhai, Jiwei; Shen, Bo; Li, Shandong; Li, Peng; Yang, Ke; Zeng, Huarong; Yan, Haixue

2017-05-01

In this study, the electrocaloric effect (ECE) of Bi0.5Na0.5TiO3-0.06BaTiO3 (BNT-0.06BT) ceramic has been directly measured using a home-made adiabatic calorimeter. The maximum adiabatic temperature change (ΔT) approaches 0.86 K under an electric field of 5 kV/mm at 110 °C, which provides experimental evidence for optimizing the ECE near the type-I pseudo-first-order phase transition (PFOPT). Most importantly, a considerable ΔT value can be maintained over a wide temperature range well above the temperature of the PFOPT under a high electric field. In addition, ΔT is closely related to the structural transition and electric field strength. This work provides a guideline to investigate the high ECE in BNT-based ferroelectric ceramics for applications in cooling technologies.

Characterization of individual barium titanate nanorods and their assessment as building blocks of new circuit architectures

International Nuclear Information System (INIS)

Zagar, Kristina; Recnik, Aleksander; Ceh, Miran; Hernandez-Ramirez, Francisco; Morante, Joan Ramon; Prades, Joan Daniel

2011-01-01

In this work, we report on the integration of individual BaTiO 3 nanorods into simple circuit architectures. Polycrystalline BaTiO 3 nanorods were synthesized by electrophoretic deposition (EPD) of barium titanate sol into aluminium oxide (AAO) templates and subsequent annealing. Transmission electron microscopy (TEM) observations revealed the presence of slabs of hexagonal polymorphs intergrown within cubic grains, resulting from the local reducing atmosphere during the thermal treatment. Electrical measurements performed on individual BaTiO 3 nanorods revealed resistivity values between 10 and 100 Ω cm, which is in good agreement with typical values reported in the past for oxygen-deficient barium titanate films. Consequently the presence of oxygen vacancies in their structure was indirectly validated. Some of these nanorods were tested as proof-of-concept humidity sensors. They showed reproducible responses towards different moisture concentrations, demonstrating that individual BaTiO 3 nanorods may be integrated in complex circuit architectures with functional capacities.

Microcracking in polycrystalline YBa2Cu3O7-δ

International Nuclear Information System (INIS)

Smith, D.S.; Suasmoro, S.; Huger, M.; Gault, C.

1991-01-01

The presence of microcracks can have a significant role for the electrical properties of polycrystalline YBa 2 Cu 3 O 7-δ due to the reduction of the effective current carrying cross section. This results in an increase of the normal state resistivity and a decrease of the critical current density, j c . Shaw et.al have reported an onset of microcracking for grain sizes greater than 1-2 μm. In this work we focus attention on the geometrical aspects of the microstructure by using ultrasonic measurements to characterize the mechanical properties of the ceramic for comparison to the electrical data. The studies have been extended with experiments as a function of temperature and atmosphere in order to investigate the origins of the microcracks. (orig./BHO)

Evolving morphotropic phase boundary in lead-free (Bi1/2Na1/2)TiO3-BaTiO3 piezoceramics

Science.gov (United States)

Jo, Wook; Daniels, John E.; Jones, Jacob L.; Tan, Xiaoli; Thomas, Pamela A.; Damjanovic, Dragan; Rödel, Jürgen

2011-01-01

The correlation between structure and electrical properties of lead-free (1-x)(Bi1/2Na1/2)TiO3-xBaTiO3 (BNT-100xBT) polycrystalline piezoceramics was investigated systematically by in situ synchrotron diffraction technique, combined with electrical property characterization. It was found that the morphotropic phase boundary (MPB) between a rhombohedral and a tetragonal phase evolved into a morphotropic phase region with electric field. In the unpoled material, the MPB was positioned at the transition from space group R3m to P4mm (BNT-11BT) with optimized permittivity throughout a broad single-phase R3m composition regime. Upon poling, a range of compositions from BNT-6BT to BNT-11BT became two-phase mixture, and maximum piezoelectric coefficient was observed in BNT-7BT. It was shown that optimized electrical properties are related primarily to the capacity for domain texturing and not to phase coexistence.

Evolving morphotropic phase boundary in lead-free (Bi1/2Na1/2)TiO3-BaTiO3 piezoceramics

International Nuclear Information System (INIS)

Jo, Wook; Roedel, Juergen; Daniels, John E.; Jones, Jacob L.; Tan Xiaoli; Thomas, Pamela A.; Damjanovic, Dragan

2011-01-01

The correlation between structure and electrical properties of lead-free (1-x)(Bi 1/2 Na 1/2 )TiO 3 -xBaTiO 3 (BNT-100xBT) polycrystalline piezoceramics was investigated systematically by in situ synchrotron diffraction technique, combined with electrical property characterization. It was found that the morphotropic phase boundary (MPB) between a rhombohedral and a tetragonal phase evolved into a morphotropic phase region with electric field. In the unpoled material, the MPB was positioned at the transition from space group R3m to P4mm (BNT-11BT) with optimized permittivity throughout a broad single-phase R3m composition regime. Upon poling, a range of compositions from BNT-6BT to BNT-11BT became two-phase mixture, and maximum piezoelectric coefficient was observed in BNT-7BT. It was shown that optimized electrical properties are related primarily to the capacity for domain texturing and not to phase coexistence.

Vacancy-induced magnetism in BaTiO3(001) thin films based on density functional theory.

Science.gov (United States)

Cao, Dan; Cai, Meng-Qiu; Hu, Wang-Yu; Yu, Ping; Huang, Hai-Tao

2011-03-14

The origin of magnetism induced by vacancies on BaTiO(3)(001) surfaces is investigated systematically by first-principles calculations within density-functional theory. The calculated results show that O vacancy is responsible for the magnetism of the BaO-terminated surface and the magnetism of the TiO(2)-terminated surface is induced by Ti vacancy. For the BaO-terminated surface, the magnetism mainly arises from the unpaired electrons that are localized in the O vacancy basin. In contrast, for the TiO(2)-terminated surface, the magnetism mainly originates from the partially occupied O-2p states of the first nearest neighbor O atoms surrounding the Ti vacancy. These results suggest the possibility of implementing magneto-electric coupling in conventional ferroelectric materials.

Resistive switching in polycrystalline YMnO3 thin films

Directory of Open Access Journals (Sweden)

A. Bogusz

2014-10-01

Full Text Available We report a unipolar, nonvolatile resistive switching in polycrystalline YMnO3 thin films grown by pulsed laser deposition and sandwiched between Au top and Ti/Pt bottom electrodes. The ratio of the resistance in the OFF and ON state is larger than 103. The observed phenomena can be attributed to the formation and rupture of conductive filaments within the multiferroic YMnO3 film. The generation of conductive paths under applied electric field is discussed in terms of the presence of grain boundaries and charged domain walls inherently formed in hexagonal YMnO3. Our findings suggest that engineering of the ferroelectric domains might be a promising route for designing and fabrication of novel resistive switching devices.

Electrical characterization and impedance response of lanthanum doped barium titanate ceramics

Directory of Open Access Journals (Sweden)

Mančić D.

2008-01-01

Full Text Available The dielectric permittivity and dissipation factor of La-doped and undoped BaTiO3 were investigated as a function of frequency and temperature. The impedance response was used to study the electrical properties of La-doped BaTiO3 over the temperature range from room temperature (RT to 350°C. La-doped and undoped BaTiO3, obtained by a modified Pechini method, were sintered in air at 1300°C for 2 and 16 hours. The impedance spectra were analyzed in terms of equivalent circuits involving resistors, capacitors and constant phase elements (CPE. The most suitable electrical circuit for the interpretation of experimental results is found to be the equivalent circuit consisting of resistors and CPE elements which replace the capacitor elements. The contribution of grain boundary resistance to the total resistance of a system is remarkable at low temperature. Dielectric permittivity of doped BaTiO3 was in the range of 8000 to 12000 at 1 kHz and the dissipation factor was less than 1%.

Modulation of resistive switching characteristics for individual BaTiO3 microfiber by surface oxygen vacancies

Science.gov (United States)

Miao, Zhilei; Chen, Lei; Zhou, Fang; Wang, Qiang

2018-01-01

Different from traditional thin-film BaTiO3 (BTO) RRAM device with planar structure, individual microfiber-shaped RRAM device, showing promising application potentials in the micro-sized non-volatile memory system, has not been investigated so far to demonstrate resistive switching behavior. In this work, individual sol-gel BTO microfiber has been formed using the draw-bench method, followed by annealing in different atmospheres of air and argon, respectively. The resistive switching characteristics of the individual BTO microfiber have been investigated by employing double-probe SEM measurement system, which shows great convenience to test local electrical properties by modulating the contact sites between the W probes and the BTO microfiber. For the sample annealed in air, the average resistive ON/OFF ratio is as high as 108, enhanced about four orders in comparison with the counterpart that annealed in Argon. For the sample annealed in argon ambience, the weakened resistive ON/OFF ratio can be attributed to the increased presence of oxygen vacancies in the surface of BTO fibers, and the underlying electrical conduction mechanisms are also discussed.

Recrystallization behaviour and electrical properties of germanium ion implanted polycrystalline silicon films

International Nuclear Information System (INIS)

Kang, Myeon-Koo; Matsui, Takayuki; Kuwano, Hiroshi

1996-01-01

The recrystallization behaviour of undoped and phosphorus-doped polycrystalline silicon films amorphized by germanium ion implantation at doses ranging from 1 x 10 15 to 1 x 10 16 cm -2 are investigated, and the electrical properties of phosphorus-doped films after recrystallization are studied. The phosphorus doping concentration ranges from 3 x 10 18 to 1 x 10 20 cm -3 . It is found that the nucleation rate decreases for undoped films and increases for phosphorus-doped films with increasing germanium dose; the growth rates decrease for both doped and undoped films. The decrease in nucleation rate is caused by the increase in implantation damage. The decrease in growth rate is considered to be due to the increase in lattice strain. The grain size increases with germanium dose for undoped films, but decreases for phosphorus-doped films. The dependence of the electrical properties of the recrystallized films as a function of phosphorus doping concentration with different germanium doses can be explained in terms of the grain size, crystallinity and grain boundary barrier height. (Author)

Electrical Conduction of Ba(Ti0.99Fe0.01)O3-δ Ceramic at High Temperatures

Science.gov (United States)

Yu, Zi-De; Chen, Xiao-Ming

2018-03-01

BaTiO3 and Ba(Ti0.99Fe0.01)O3-δ ceramics with dense microstructure have been synthesized by a solid-state reaction method, and their electrical conduction investigated by broadband electrical impedance spectroscopy at frequencies from 0.05 Hz to 3 × 106 Hz and temperatures from 200°C to 400°C. Compared with BaTiO3, the real part of the permittivity and the phase-transition temperature of Ba(Ti0.99Fe0.01)O3-δ decreased. Relaxation peaks appeared in the curves of the imaginary part of the permittivity as a function of frequency. With increase in frequency, the peaks gradually shifted towards higher frequency and their height increased. Conductivity was closely related to frequency and temperature. Frequency-dependent conductivity was analyzed using the Jonscher double power law. Compared with BaTO3, Ba(Ti0.99Fe0.01)O3-δ exhibited high impedance at given frequency and temperature. Impedance Cole-Cole plots displayed two semicircles, which could be well fit using two parallel RC equivalent circuit models. The conductivity activation energy was found to be around 1 eV. For Ba(Ti0.99Fe0.01)O3-δ , the electrical modulus curve versus frequency displayed two peaks.

Local manifestations of a static magnetoelectric effect in nanostructured BaTiO3-BaFe12O9 composite multiferroics

Science.gov (United States)

Trivedi, Harsh; Shvartsman, Vladimir V.; Lupascu, Doru C.; Medeiros, Marco S. A.; Pullar, Robert C.; Kholkin, Andrei L.; Zelenovskiy, Pavel; Sosnovskikh, Andrey; Shur, Vladimir Ya.

2015-02-01

A study on magnetoelectric phenomena in the barium titanate-barium hexaferrite (BaTiO3-BaFe12O19) composite system, using high resolution techniques including switching spectroscopy piezoresponse force microscopy (SSPFM) and spatially resolved confocal Raman microscopy (CRM), is presented. It is found that both the local piezoelectric coefficient and polarization switching parameters change on the application of an external magnetic field. The latter effect is rationalized by the influence of magnetostrictive stress on the domain dynamics. Processing of the Raman spectral data using principal component analysis (PCA) and self-modelling curve resolution (SMCR) allowed us to achieve high resolution phase distribution maps along with separation of average and localized spectral components. A significant effect of the magnetic field on the Raman spectra of the BaTiO3 phase has been revealed. The observed changes are comparable with the classical pressure dependent studies on BaTiO3, confirming the strain mediated character of the magnetoelectric coupling in the studied composites.

Calcul théorique de l’hystérésis thermique de BaTiO3 pur et dopé au fer

NARCIS (Netherlands)

Aattar, M.; Khatib, D.; Noheda, B.

1999-01-01

Theory of thermal hysteresis of pure and iron doped BaTiO3. The value of the thermal hysteresis of pure and iron doped BaTiO3 was calculated using an effective field model taking into account dipolar and quadripolar interactions. The calculation is performed using a self-consistent method. The

Ferroelectric properties of NaNbO3-BaTiO3 thin films deposited on SrRuO3/(001)SrTiO3 substrate by pulsed laser deposition

International Nuclear Information System (INIS)

Yamazoe, Seiji; Oda, Shinya; Sakurai, Hiroyuki; Wada, Takahiro; Adachi, Hideaki

2009-01-01

(NaNbO 3 ) 1-x (BaTiO 3 ) x (NN-xBT) thin films with low BaTiO 3 (BT) concentrations x (x=0.05 and 0.10) were fabricated on SrRuO 3 /(001)SrTiO 3 (SRO)/(001)STO) substrate by pulsed laser deposition (PLD). X-ray diffraction pattern (XRD) and transmission electron diffraction pattern (TED) showed that NN-0.10BT thin film was epitaxially grown on SRO/(001)STO substrate with a crystallographic relationship of [001] NN-xBT parallel [001] STO . From reciprocal space maps, the lattice parameters of the out-of-plane direction of NN-xBT thin films became larger with an increase in BT concentration, although the lattice parameter of the in-plane was hardly changed by the BT concentration. The value of relative dielectric constant ε r of the NN-xBT thin films were increased with BT concentration. The ε r and the dielectric loss tanδ of NN-0.10BT were 1220 and 0.02 at 1 kHz, respectively. The P-E hysteresis loops of the NN-xBT thin films showed clear ferroelectricity. Although the value of remanent polarization P r decreased with the BT concentration, the behaviors of ε r , P r , and coercive electric field E c of the NN-xBT thin films against the BT concentration accorded with those of NN-xBT ceramics, in which NN-0.10BT ceramics exhibited the largest piezoelectric property. Therefore, the NN-0.10BT thin film is expected to show high piezoelectricity. (author)

Effect of BaTiO3 Nanopowder Concentration on Rheological Behaviour of Ceramic Inkjet Inks

Science.gov (United States)

Kyrpal, R.; Dulina, I.; Ragulya, A.

2015-04-01

The relationship between rheological properties of ceramic inkjet inks based on BaTiO3 nanopowder and solid phase concentration has been investigated. In the ink volume takes place the formation periodic colloidal structures (PCS). The determining factor of structure formation is powder-dispersant ratio. Structural constitution of in the system with the low pigment concentration represented as PCS2, that contains solid particles in deflocculated that stabilized by the presence of adsorption-solvate layers. Dilatant structure formation for such inks explained by constrained conditions of the interaction. Samples with high BaTiO3 concentration have been classified as PKS1. Dilatant properties of the PKS1 resulted in particles rearrangement under the influence of the flow. In the region of some values powder-dispersant ratio take place conversation PKS2 to PKS1 and ink structure transformation from monodisperse to aggregate state.

Size Tunable Synthesis of Highly Crystalline BaTiO3 Nanoparticles using Salt-Assisted Spray Pyrolysis

International Nuclear Information System (INIS)

Itoh, Yoshifumi; Lenggoro, I. Wuled; Okuyama, Kikuo; Maedler, Lutz; Pratsinis, Sotiris E.

2003-01-01

Highly crystalline, dense BaTiO 3 nanoparticles in a size range from 30 to 360nm with a narrow size distribution (σ g = 1.2-1.4) were prepared at various synthesis temperatures using a salt-assisted spray pyrolysis (SASP) method without the need for post-annealing. The effect of synthesis temperature on particle size, crystallinity and surface morphology of the nanoparticles were characterized by X-ray diffraction and scanning/transmission electron microscopy. The nature of the crystalline structure was analyzed by Rietveld refinement and Raman spectroscopy. The particle size decreased with decreasing operation temperature. The crystal phase was transformed from tetragonal to cubic at a particles size of about 50nm at room temperature. SASP can be used to produce high weight fraction of tetragonal BaTiO 3 nanoparticles down to 64nm in a single step

Ferroelectric properties of composites containing BaTiO3 nanoparticles of various sizes

International Nuclear Information System (INIS)

Adam, Jens; Lehnert, Tobias; Klein, Gabi; McMeeking, Robert M

2014-01-01

Size effects, including the occurrence of superparaelectric phases associated with small scale, are a significant research topic for ferroelectrics. Relevant phenomena have been explored in detail, e.g. for homogeneous, thin ferroelectric films, but the related effects associated with nanoparticles are usually only inferred from their structural properties. In contrast, this paper describes all the steps and concepts necessary for the direct characterization and quantitative assessment of the ferroelectric properties of as-synthesized and as-received nanoparticles. The method adopted uses electrical polarization measurements on polymer matrix composites containing ferroelectric nanoparticles. It is applied to ten different BaTiO 3 particle types covering a size range from 10 nm to 0.8 μm. The influence of variations of particle characteristics such as tetragonality and dielectric constant is considered based on measurements of these properties. For composites containing different particle types a clearly differing polarization behaviour is found. For decreasing particle size, increasing electric field is required to achieve a given level of polarization. The size dependence of a measure related to the coercive field revealed by this work is qualitatively in line with the state of the knowledge for ferroelectrics having small dimensions. For the first time, such results and size effects are described based on data from experiments on collections of actual nanoparticles. (paper)

Ferroelectric properties of composites containing BaTiO 3 nanoparticles of various sizes

Science.gov (United States)

Adam, Jens; Lehnert, Tobias; Klein, Gabi; McMeeking, Robert M.

2014-01-01

Size effects, including the occurrence of superparaelectric phases associated with small scale, are a significant research topic for ferroelectrics. Relevant phenomena have been explored in detail, e.g. for homogeneous, thin ferroelectric films, but the related effects associated with nanoparticles are usually only inferred from their structural properties. In contrast, this paper describes all the steps and concepts necessary for the direct characterization and quantitative assessment of the ferroelectric properties of as-synthesized and as-received nanoparticles. The method adopted uses electrical polarization measurements on polymer matrix composites containing ferroelectric nanoparticles. It is applied to ten different BaTiO3 particle types covering a size range from 10 nm to 0.8 μm. The influence of variations of particle characteristics such as tetragonality and dielectric constant is considered based on measurements of these properties. For composites containing different particle types a clearly differing polarization behaviour is found. For decreasing particle size, increasing electric field is required to achieve a given level of polarization. The size dependence of a measure related to the coercive field revealed by this work is qualitatively in line with the state of the knowledge for ferroelectrics having small dimensions. For the first time, such results and size effects are described based on data from experiments on collections of actual nanoparticles.

Effect of crystal orientation on the phase diagrams, dielectric and piezoelectric properties of epitaxial BaTiO3 thin films

Directory of Open Access Journals (Sweden)

Huaping Wu

2016-01-01

Full Text Available The influence of crystal orientations on the phase diagrams, dielectric and piezoelectric properties of epitaxial BaTiO3 thin films has been investigated using an expanded nonlinear thermodynamic theory. The calculations reveal that crystal orientation has significant influence on the phase stability and phase transitions in the misfit strain-temperature phase diagrams. In particular, the (110 orientation leads to a lower symmetry and more complicated phase transition than the (111 orientation in BaTiO3 films. The increase of compressive strain will dramatically enhance the Curie temperature TC of (110-oriented BaTiO3 films, which matches well with previous experimental data. The polarization components experience a great change across the boundaries of different phases at room temperature in both (110- and (111-oriented films, which leads to the huge dielectric and piezoelectric responses. A good agreement is found between the present thermodynamics calculation and previous first-principles calculations. Our work provides an insight into how to use crystal orientation, epitaxial strain and temperature to tune the structure and properties of ferroelectrics.

Facile Low Temperature Hydrothermal Synthesis of BaTiO3 Nanoparticles Studied by In Situ X-ray Diffraction

Directory of Open Access Journals (Sweden)

Ola G. Grendal

2018-06-01

Full Text Available Ferroelectric materials are crucial for today’s technological society and nanostructured ferroelectric materials are important for the downscaling of devices. Controlled and reproducible synthesis of these materials are, therefore, of immense importance. Hydrothermal synthesis is a well-established synthesis route, with a large parameter space for optimization, but a better understanding of nucleation and growth mechanisms is needed for full utilization and control. Here we use in situ X-ray diffraction to follow the nucleation and growth of BaTiO3 formed by hydrothermal synthesis using two different titanium precursors, an amorphous titania precipitate slurry and a Ti-citric acid complex solution. Sequential Rietveld refinement was used to extract the time dependency of lattice parameters, crystallite size, strain, and atomic displacement parameters. Phase pure BaTiO3 nanoparticles, 10–15 nm in size, were successfully synthesized at different temperatures (100, 125, and 150 °C from both precursors after reaction times, ranging from a few seconds to several hours. The two precursors resulted in phase pure BaTiO3 with similar final crystallite size. Finally, two different growth mechanisms were revealed, where the effect of surfactants present during hydrothermal synthesis is discussed as one of the key parameters.

Flux Growth of Highly Crystalline Photocatalytic BaTiO3 Particle Layers on Porous Titanium Sponge Substrate and Insights into the Formation Mechanism

Science.gov (United States)

Wang, Q.; Li, B.

2017-09-01

A unique architecture of idiomorphic and highly crystalline BaTiO3 particle layers directly grown on a porous titanium sponge substrate was successfully achieved for the first time using a facile molten salt method at a relatively low temperature of 700 °C. Specifically, the low-melting KCl-NaCl eutectic salts and barium hydroxide octahydrate were employed as the reaction medium and barium source, respectively. Powder X-ray diffraction (XRD), scanning electron microscopy (SEM), Energy dispersive X-ray spectroscopy (EDS), transmission electron microscopy (TEM), high-resolution transmission electron microscopy (HRTEM) and UV-vis diffuse reflectance spectrophotometry were used to characterize the structure, morphology and optical property of the obtained samples. The results revealed that the flux-grown tetragonal BaTiO3 products had well-defined and uniform morphology with an average size of 300 nm and a band gap of ∼3.16 eV. Based on XRD, EDS, SEM, and TEM, the possible formation mechanism responsible for the well-developed architecture of BaTiO3 particle layers was proposed and discussed. Furthermore, the photocatalytic activity of the flux-grown BaTiO3 products for organic pollutant degradation under simulated sunlight irradiation was also investigated.

Piezoelectric properties of electrospun nanofibers of BaTiO3; Propiedades piezoeletricas de nanofibras eletrofiadas de BaTiO3

Energy Technology Data Exchange (ETDEWEB)

Carvalho, L.F.R.M.; Melo, G.F.; Goncalves, A.M.; Eiras, J.A.; Bretas, R.E.S., E-mail: bretas@ufscar.br [Universidade Federal de Sao Carlos (UFSCar), SP (Brazil)

2016-07-01

BaTiO3 nanofibers were produced by the electrospinning method from a mixture of a solution of the precursors Ba (CH{sub 3}COO){sub 2} and [(CH{sub 3}){sub 2}CHO]{sub 4}Ti in acetic acid and a solution of poly(vinylpyrrolidone) in ethanol. A voltage of 10 kV and a working distance of 4.6 cm were used for the electrospinning, at controlled room temperature and humidity of 21 °C and 60% respectively. Nanofibers as spun were dried in air on an air-circulating oven at 100 °C for one hour to remove residual solvent and were subsequently calcined at 750 °C during 2 h. The morphology, crystallographic structure and piezoelectric properties of the nanofibers were analyzed by scanning electron microscopy (SEM), X-ray angle (WAXS) and Piezoresponse Force Microscopy (PFM), respectively. The average diameter of the nanofibers was 414 nm with an aspect ratio of 40. By PFM, there was strong evidence that the nanofibers had piezoelectric activity. (author)

Effects of ultrasonication and conventional mechanical homogenization processes on the structures and dielectric properties of BaTiO3 ceramics.

Science.gov (United States)

Akbas, Hatice Zehra; Aydin, Zeki; Yilmaz, Onur; Turgut, Selvin

2017-01-01

The effects of the homogenization process on the structures and dielectric properties of pure and Nb-doped BaTiO 3 ceramics have been investigated using an ultrasonic homogenization and conventional mechanical methods. The reagents were homogenized using an ultrasonic processor with high-intensity ultrasonic waves and using a compact mixer-shaker. The components and crystal types of the powders were determined by Fourier-transform infrared spectroscopy (FTIR) and X-ray diffraction (XRD) analyses. The complex permittivity (ε ' , ε″) and AC conductivity (σ') of the samples were analyzed in a wide frequency range of 20Hz to 2MHz at room temperature. The structures and dielectric properties of pure and Nb-doped BaTiO 3 ceramics strongly depend on the homogenization process in a solid-state reaction method. Using an ultrasonic processor with high-intensity ultrasonic waves based on acoustic cavitation phenomena can make a significant improvement in producing high-purity BaTiO 3 ceramics without carbonate impurities with a small dielectric loss. Copyright © 2016 Elsevier B.V. All rights reserved.

Effect of double layer thickness on magnetoelectric coupling in multiferroic BaTiO3-Bi0.95Gd0.05FeO3 multilayers

Science.gov (United States)

Hohenberger, S.; Lazenka, V.; Temst, K.; Selle, S.; Patzig, C.; Höche, T.; Grundmann, M.; Lorenz, M.

2018-05-01

The effect of double-layer thickness and partial substitution of Bi3+ by Gd3+ is demonstrated for multiferroic BaTiO3–BiFeO3 2–2 heterostructures. Multilayers of 15 double layers of BaTiO3 and Bi0.95Gd0.05FeO3 were deposited onto (0 0 1) oriented SrTiO3 substrates by pulsed laser deposition with various double layer thicknesses. X-ray diffraction and high resolution transmission electron microscopy investigations revealed a systematic strain tuning with layer thickness via coherently strained interfaces. The multilayers show increasingly enhanced magnetoelectric coupling with reduced double layer thickness. The maximum magnetoelectric coupling coefficient was measured to be as high as 50.8 V cm‑1 Oe‑1 in 0 T DC bias magnetic field at room temperature, and 54.9 V cm‑1 Oe‑1 above 3 T for the sample with the thinnest double layer thickness of 22.5 nm. This enhancement is accompanied by progressively increasing perpendicular magnetic anisotropy and compressive out-of-plane strain. To understand the origin of the enhanced magnetoelectric coupling in such multilayers, the temperature and magnetic field dependency of is discussed. The magnetoelectric performance of the Gd3+ substituted samples is found to be slightly enhanced when compared to unsubstituted BaTiO3–BiFeO3 multilayers of comparable double-layer thickness.

Investigation of the Anisotropic Thermoelectric Properties of Oriented Polycrystalline SnSe

Directory of Open Access Journals (Sweden)

Yulong Li

2015-06-01

Full Text Available Polycrystalline SnSe was synthesized by a melting-annealing-sintering process. X-ray diffraction reveals the sample possesses pure phase and strong orientation along [h00] direction. The degree of the orientations was estimated and the anisotropic thermoelectric properties are characterized. The polycrystalline sample shows a low electrical conductivity and a positive and large Seebeck coefficient. The low thermal conductivity is also observed in polycrystalline sample, but slightly higher than that of single crystal. The minimum value of thermal conductivity was measured as 0.3 W/m·K at 790 K. With the increase of the orientation factor, both electrical and thermal conductivities decrease, but the thermopowers are unchanged. As a consequence, the zT values remain unchanged in the polycrystalline samples despite the large variation in the degree of orientation.

Pulsed Laser Deposition of BaTiO3 Thin Films on Different Substrates

Directory of Open Access Journals (Sweden)

Yaodong Yang

2010-01-01

Full Text Available We have studied the deposition of BaTiO3 (BTO thin films on various substrates. Three representative substrates were selected from different types of material systems: (i SrTiO3 single crystals as a typical oxide, (ii Si wafers as a semiconductor, and (iii Ni foils as a magnetostrictive metal. We have compared the ferroelectric properties of BTO thin films obtained by pulsed laser deposition on these diverse substrates.

Dielectric and modulus studies of polycrystalline BaZrO3 ceramic

Science.gov (United States)

Saini, Deepash S.; Singh, Sunder; Kumar, Anil; Bhattacharya, D.

2018-05-01

In the present work, dielectric and modulus studies of polycrystalline BaZrO3 ceramic, prepared by modified combustion method followed by conventional sintering, are investigated over the frequency range of 100 Hz to 106 Hz at different temperatures from 250 to 500 °C in air. The high value of dielectric constant (ɛ' ˜ 103) of BaZrO3 at high temperature and low frequency can be attributed to the Maxwell-Wagner polarization mechanism as well as to the thermally activated mechanism of charge carriers. Electric modulus reveal two type relaxations in the 250 °C to 800 °C temperature region as studied at different frequencies over 100 Hz to 106 Hz in air.

The effects of PbZn1/3Nb2/3O3-doping on structural, thermal, optical, dielectric, and ferroelectric properties of BaTiO3 ceramics

Science.gov (United States)

Suchanicz, J.; Świerczek, K.; Sitko, D.; Czaja, P.; Marchet, P.; Czternastek, H.; Majda, D.

2017-09-01

Low-lead (1-x)BT-xPZN (x = 0, 0.025, 0.05, 0.075, 0.10, 0.125, and 0.15) ceramics were successfully synthesized by the spark-plasma-sintering method for the first time. Their phase transition behavior as well as structural, thermal, optical, and electrical properties was investigated. These materials exhibit the structure of perovskite-type solid solutions and undergo a sequence of phase transitions, typical of pure BaTiO3 (BT). The dielectric test results revealed that with the increase in the PbZn1/3Nb2/3O3 (PZN) content, the frequency dispersion of electric permittivity increases, whilst the dielectric/ferroelectric properties tend to deteriorate, which is characteristic of relaxor-type behavior. Therefore, it is reasonable to suppose that these ceramics progressively lack long-range ordering. These effects are due to the competition between lone-pair electrons' induced changes in the A-O band upon Pb2+ addition and ionic size differences. In general, the transition temperatures observed by dielectric analyses are in good agreement with those obtained from X-ray diffraction and differential scanning calorimetry measurements. The BT-PZN system may help to understand why relaxor behavior appears in perovskite-based materials. It appears that these materials can become a good starting point for the development of new low-lead electronic ceramics.

Microstructural and dielectrical characterization of Ho doped BaTiO3 ceramics

Directory of Open Access Journals (Sweden)

Marjanović Miloš

2014-01-01

Full Text Available The Ho doped BaTiO3 ceramics, with different Ho2O3 content, ranging from 0.01 to 1.0 wt % Ho, were investigated regarding their microstructural and dielectric characteristics. Doped BaTiO3 were prepared using conventional solid state reaction and sintered at 1380°C for four hours. SEM analysis of Ho/BaTiO3 doped ceramics showed that the low doped samples exhibit mainly fairly uniform and homogeneous microstructure with the grain size ranged from 20-40 μm. In the samples with the higher dopant concentration the abnormal grain growth is inhibited and the grain size ranged between 2-10 μm. Measurements of dielectric properties were carried out as a function of temperature up to 180 °C at different frequencies. The samples doped with 0.01wt % of Ho, exhibit the high value of dielectric permittivity (εr = 2160 at room temperature. A nearly flat permittivity-response was obtained in specimens with higher additive content. Using a Curie-Weiss law and modified Curie-Weiss law the Curie constant (C, Curie temperature (Tc and a critical exponent of nonlinearity (g were calculated. The Curie temperature of doped samples were ranged from 128 to 130°C. The Curie constant for all series of samples decrease with increase of dopant concentration and the lowest values were observed on samples doped with 0.01 wt % of holmium. [Projekat Ministarstva nauke Republike Srbije, br. OI 172057: Directed synthesis, structure and properties of multifunctional materials i br. TR 32026

Influence of Mn site doping on electrical resistivity of polycrystalline La1-yAyMn1-xBxO3 (A=Ba, Sr; B=Cu, Cr, Co Manganites

Directory of Open Access Journals (Sweden)

Paunović N.

2008-01-01

Full Text Available We have the measured electrical resistivity of La1-yBayMn1-xCuxO3 (0.17≤y≤0.30; 0.04≤x≤0.10, La1-ySryMn1-xCrxO3 and La1-ySryMn1-xCoxO3 (0.270≤y≤0.294; 0.02≤x≤0.10 polycrystalline samples in the 25-325 K temperature range. The increase of Mn site doping concentration leads to an increase of the electrical resistivity of the samples and the appearance of a “double-peak” structure in the electrical resistivity versus temperature graphs. The first peak represents the insulator-metal transition in vicinity of the paramagnetic-ferromagnetic transition (TC. We have found that the intensity of the second peak increases with an increase of concentration of Mn substituents, due to the hole scattering by the random potential of the Mn site impurities.

Understanding the peculiarities of the piezoelectric effect in macro-porous BaTiO3.

Science.gov (United States)

Roscow, James I; Topolov, Vitaly Yu; Bowen, Christopher R; Taylor, John; Panich, Anatoly E

2016-01-01

This work demonstrates the potential of porous BaTiO 3 for piezoelectric sensor and energy-harvesting applications by manufacture of materials, detailed characterisation and application of new models. Ferroelectric macro-porous BaTiO 3 ceramics for piezoelectric applications are manufactured for a range of relative densities, α  = 0.30-0.95, using the burned out polymer spheres method. The piezoelectric activity and relevant parameters for specific applications are interpreted by developing two models: a model of a 3-0 composite and a 'composite in composite' model. The appropriate ranges of relative density for the application of these models to accurately predict piezoelectric properties are examined. The two models are extended to take into account the effect of 90° domain-wall mobility within ceramic grains on the piezoelectric coefficients [Formula: see text]. It is shown that porous ferroelectrics provide a novel route to form materials with large piezoelectric anisotropy [Formula: see text] at 0.20 ≤ α ≤ 0.45 and achieve a high squared figure of merit [Formula: see text] [Formula: see text]. The modelling approach allows a detailed analysis of the relationships between the properties of the monolithic and porous materials for the design of porous structures with optimum properties.

Synthesis, structural characterization and dielectric properties of Nb doped BaTiO3/SiO2 core–shell heterostructure

International Nuclear Information System (INIS)

Cernea, M.; Vasile, B.S.; Boni, A.; Iuga, A.

2014-01-01

Highlights: • Optimal parameters for preparation by sol–gel of core–shell (BT-Nb 0.005 )/SiO 2 are presented in this paper. • Single crystalline BT-Nb 0.005 /SiO 2 core–shell composite with ∼34 nm shell thick was prepared. • The core–shell ceramic exhibits good dielectric properties and ferroelectric characteristics. -- Abstract: Perovskite complex ceramic oxides, BaTiO 3 doped with 0.5 mol%Nb 2 O 5 and then nanocoated with SiO 2 (abbreviated as BT-Nb 0.005 /SiO 2 ) was successful prepared using conventional sol–gel processing. Phase composition, particle morphology, structure, and electric properties of BT-Nb 0.005 core and BT-Nb 0.005 /SiO 2 core–shell were examined and compared, using X-ray diffraction, transmission electron microscopy and, dielectric and ferroelectric measurements. Core–shell composite with well-defined perovskite tetragonal phase of BaTiO 3 was achieved. Furthermore, single crystalline BT-Nb 0.005 /SiO 2 core–nanoshell heterostructure with ∼34 nm shell thick was prepared, which is a novelty in ferroelectrics field. The ferroelectric quality of BT-Nb 0.005 has suffered an alteration when the (BT-Nb 0.005 )/SiO 2 core–shell heterostructure was realized. One-dimensional BT-Nb 0.005 /SiO 2 core–shell heterostructure exhibits an improvement of dielectric losses and a decrease of dielectric constant, compared to uncoated BT-Nb 0.005 . The (BT-Nb 0.005 )/SiO 2 core–shell material could be interesting for application in the composite capacitors

(Nd0⋅065Ti0⋅87Nb0⋅065)O3 ceramic

Indian Academy of Sciences (India)

Unknown

Polycrystalline ceramic samples of sodium bismuth titanate with simultaneous doping at A and B sites have been studied for the influence of ... of Nd and Nb at B site in BaTiO3 (BaNdxTi1–2xNbxO3). (Mahboob et al 2005a). Dielectric ..... hence the conduction arises due to short range translation hopping via large polarons.

A first-principles study of phase transitions in ultrathin films of BaTiO 3

Indian Academy of Sciences (India)

We determine the effects of film thickness, epitaxial strain and the nature of electrodes on ferroelectric phase transitions in ultrathin films of BaTiO3 using a first-principles effective Hamiltonian in classical molecular dynamics simulations. We present results for polarization and dielectric properties as a function of temperature ...

Pulse-based electron spin transient nutation measurement of BaTiO3 fine particle: Identification of controversial signal around g = 2.00

Science.gov (United States)

Sawai, Takatoshi; Yamaguchi, Yoji; Kitamura, Noriko; Date, Tomotsugu; Konishi, Shinya; Taga, Kazuya; Tanaka, Katsuhisa

2018-05-01

Two dimensional pulse-based electron spin transient nutation (2D-ESTN) spectroscopy is a powerful tool for determining the spin quantum number and has been applied to BaTiO3 fine powder in order to identify the origin of the continuous wave electron spin resonance (CW-ESR) signal around g = 2.00. The signal is frequently observed in BaTiO3 ceramics, and the correlation between the signal intensity and positive temperature coefficient of resistivity (PTCR) properties has been reported to date. The CW-ESR spectrum of BaTiO3 fine particles synthesized by the sol-gel method shows a typical asymmetric signal at g = 2.004. The 2D-ESTN measurements of the sample clearly reveal that the signal belongs to the S = 5/2 high spin state, indicating that the signal is not due to a point defect as suggested by a number of researchers but rather to a transition metal ion. Our elemental analysis, as well as previous studies, indicates that the origin of the g = 2.004 signal is due to the presence of an Fe3+ impurity. The D value (second-order fine structure parameter) reveals that the origin of the signal is an Fe3+ center with distant charge compensation. In addition, we show a peculiar temperature dependence of the CW-ESR spectrum, suggesting that the phase transition behavior of a BaTiO3 fine particle is quite different from that of a bulk single crystal. Our identification does not contradict a vacancy-mediated mechanism for PTCR. However, it is incorrect to use the signal at g = 2.00 as evidence to support the vacancy-mediated mechanism.

3D study in modelling in static regime of a bi facial polycrystalline solar cell under intense light and under a constant magnetic field

International Nuclear Information System (INIS)

ZOUNGRANA Martial

2010-01-01

In this work we propose a three-dimensional (3D) study of magnetic field, light concentration and electron gradient concentration electric field respective influences on bi facial polycrystalline silicon solar cell behaviour. The hold account of these parameters in our study leads to the new expressions of continuity equations, electric and electronic parameters. On the basis of these equations, grain size, grain boundary recombination velocity, magnetic field and light intensity effects on carriers density, photocurrent, photovoltage, electric and electronic parameters are analysed. We finally propose an equivalent electric model of bi facial polycrystalline silicon solar cell under magnetic field. According to this model, electric parameters expressions was established (shunt and series resistances, space charge zone capacity ) and we study magnetic field, grain size, grain boundary recombination velocity and light concentration influences on these parameters.(Author) [fr

Investigations on electrical, magnetic and optical behaviors of five-layered Aurivillius Bi6Ti3Fe2O18 polycrystalline films

International Nuclear Information System (INIS)

Bai, W.; Xu, W.F.; Wu, J.; Zhu, J.Y.; Chen, G.; Yang, J.; Lin, T.; Meng, X.J.; Tang, X.D.; Chu, J.H.

2012-01-01

Five-layered Aurivillius Bi 6 Ti 3 Fe 2 O 18 (BTF2) polycrystalline thin films were prepared by a chemical solution deposition route. The crystalline structures and microstructures were characterized by X-ray diffractometer, micro-Raman spectrometer and atomic force microscopy. Its electrical and magnetic properties were investigated, and especially optical properties were addressed in detail. Coexistence of the ferroelectric and weak ferromagnetic properties indicated the multiferroic behavior of the BTF2 films. The optical dielectric functions in the photon energy range of 1.13–4.13 eV have been extracted by fitting the experimental data in the light of the Tauc–Lorentz dispersion model. A direct interband transition with bandgap energy ∼ 3.72 eV was determined for the BTF2 films. The weak absorption below band-gap edge was explained by the Urbach band tail rule. Finally, the optical dispersion behaviors of the BTF2 films in the transparent oscillating region were described using a single oscillator model. - Highlights: ► Five-layered Aurivillius Bi 6 Ti 3 Fe 2 O 18 (BTF2) thin films were prepared. ► Electrical and magnetic properties of the BTF2 films were investigated. ► Optical properties of the BTF2 films were especially addressed in detail.

Optical properties of BaTiO3 nanoparticles and silver nanoprisms in polymer host matrices

Science.gov (United States)

Requena, Sebastian

Nanocomposites are materials comprised of a host matrix, such as glass or polymer, with embedded nanoparticles. Embedding nanoparticles into the host makes it possible to create materials with properties that are distinctly unique from those of their host and nanoparticle constituents. Nanocomposites can have superior mechanical, thermal, and optical properties compared to their host materials. We characterized the photoluminescent properties of BaTiO3 polymer nanocomposites and the effects of chemically modifying the nanoparticles surface on said properties. BaTiO3 nanopowders of average grain sizes 50 nm and 100 nm were functionalized by (3-aminopropyl)triethoxysilane (3APTS) and mixed with poly(methyl methacrylate)/toluene solution. The nanocomposites films morphology and chemical structure were studied via AFM and FTIR. The photoluminescence spectrum of the pure nanoparticles was composed of an emission at ˜3.0 eV and multiple bands centered at ˜2.5 eV. Surface functionalization of the BaTiO3 nanoparticles via 3APTS increased overall luminescence at room temperature while only enhancing the ˜3.0 eV emission at low-temperature. On the other hand, polymer coating of the functionalized nanoparticles significantly enhances ˜3.0 eV emissions while decreasing emissions associated with near-surface lattice distortions at ˜2.5 eV. Chemical modification of the surface with 3APTS and PMMA presents a pathway to tune and control the photoluminescent properties of BTO nanoparticles. We also present optical studies of two different size distributions of silver triangular nanoprisms, one with a dipole resonance at ˜520 nm and the other with a dipole resonance at ˜650 nm, placed in different media. The silver nanoprisms were embedded in a polyvinyl alcohol (PVA) polymer matrix and oriented by stretching the polymer/nanoprism nanocomposite films. We observe significantly increased linear dichroism in the region associated with the plasmonic in-plane dipole mode upon

A model of electric breakdown in polycrystalline semiconductors with highly nonlinear I - V characteristics

International Nuclear Information System (INIS)

Yildirim, E.H.; Tanatar, B.; Canessa, E.

1993-07-01

A deterministic algorithm to study the nonlinear current-voltage characteristics of polycrystalline semiconductors, such as ZnO-based metal oxide varistors, under dc bias and at room temperature is developed based on the electrical properties of individual grain boundaries. Assuming a thermionic emission type mechanism between individual grains and a nonuniform distribution of barrier heights at grain boundaries, the set of nonlinear Kirchhoff equations that determines the macroscopic current across the specimen and the nonlinearity coefficient α is solved numerically. The applied voltage dependence of the barrier height is found to be crucial to obtain α values reaching ∼50, indicating high nonlinearity as required by potential commercial applications. (author). 20 refs, 3 figs

Optical Second Harmonic Generation in the BaTiO3 phase of magnetically aligned multiferroic nanofibers

Science.gov (United States)

Gasperi, Katia

Multiferroic materials enable the exploration of electrical control of magnetic properties and vice versa. Their increasing interest is especially due to their potential applications in the industry of information storage. Thanks to recent progress in nanotechnology, they have also been found to have many other applications such as transducers and sensors, and they already occupy a unique place in the biomedical field. The objective of this project is to study multiferroic nanofibers made of cobalt ferrite CoFe2O 4 (CFO) and barium titanate BaTiO3 (BTO) with a specific focus in the characterization of the ferroelectric phase. We researched the state of knowledge concerning the size effects on phase transition for nanoparticles and polycrystals BTO. The ferroelectric phase transition of BTO occurs when it changes from a tetragonal (anisotropic) crystal structure to a cubic (isotropic) structure. This change suggests that optical second harmonic generation (SHG) is a good measurement technique for monitoring the phase transition of the BTO half of the nanofibers. We designed and prepared a temperature dependent SHG experiment on magnetically aligned fibers in transmission with the possibility to investigate the polarization dependence of the signal. We also prepared interdigital electrodes on glass for the future study of the fibers in an external electric field.

Some Aspects of the Failure Mechanisms in BaTiO3-Based Multilayer Ceramic Capacitors

Science.gov (United States)

Liu, David Donhang; Sampson, Michael J.

2012-01-01

The objective of this presentation is to gain insight into possible failure mechanisms in BaTiO3-based ceramic capacitors that may be associated with the reliability degradation that accompanies a reduction in dielectric thickness, as reported by Intel Corporation in 2010. The volumetric efficiency (microF/cm3) of a multilayer ceramic capacitor (MLCC) has been shown to not increase limitlessly due to the grain size effect on the dielectric constant of ferroelectric ceramic BaTiO3 material. The reliability of an MLCC has been discussed with respect to its structure. The MLCCs with higher numbers of dielectric layers will pose more challenges for the reliability of dielectric material, which is the case for most base-metal-electrode (BME) capacitors. A number of MLCCs manufactured using both precious-metal-electrode (PME) and BME technology, with 25 V rating and various chip sizes and capacitances, were tested at accelerated stress levels. Most of these MLCCs had a failure behavior with two mixed failure modes: the well-known rapid dielectric wearout, and so-called 'early failures." The two failure modes can be distinguished when the testing data were presented and normalized at use-level using a 2-parameter Weibull plot. The early failures had a slope parameter of Beta >1, indicating that the early failures are not infant mortalities. Early failures are triggered due to external electrical overstress and become dominant as dielectric layer thickness decreases, accompanied by a dramatic reduction in reliability. This indicates that early failures are the main cause of the reliability degradation in MLCCs as dielectric layer thickness decreases. All of the early failures are characterized by an avalanche-like breakdown leakage current. The failures have been attributed to the extrinsic minor construction defects introduced during fabrication of the capacitors. A reliability model including dielectric thickness and extrinsic defect feature size is proposed in this

Multiferroic properties of BiFeO3/BaTiO3 multilayered thin films

International Nuclear Information System (INIS)

Sharma, Savita; Tomar, Monika; Kumar, Ashok; Puri, Nitin K.; Gupta, Vinay

2014-01-01

Multilayered structures of multiferroic BiFeO 3 (BFO) and ferroelectric BaTiO 3 (BTO) have been fabricated using pulsed laser deposition (PLD). Ferromagnetic and ferroelectric properties of the multilayered system (BFO/BTO) have been investigated. It could be inferred that the magnetization increases with the incorporation of BTO buffer layer, which indicates a coupling between the ferroelectric and ferromagnetic orders. Vibrating sample magnetometer (VSM) measurements performed on the prepared multiferroic samples show that the magnetization is significantly increased (M s =56.88 emu/cm 3 ) for the multilayer system with more number of layers (four) keeping the total thickness of the multilayered system constant (350 nm) meanwhile maintaining the sufficiently enhanced ferroelectric properties (P r =29.68 µC/cm 2 )

Ho2O3 additive effects on BaTiO3 ceramics microstructure and dielectric properties

Directory of Open Access Journals (Sweden)

Paunović Vesna

2012-01-01

Full Text Available Doped BaTiO3-ceramics is very interesting for their application as PTCR resistors, multilayer ceramic capacitors, thermal sensors etc. Ho doped BaTiO3 ceramics, with different Ho2O3 content, ranging from 0.01 to 1.0 wt% Ho, were investigated regarding their microstructural and dielectric characteristics. The samples were prepared by the conventional solid state reaction and sintered at 1320° and 1380°C in an air atmosphere for 4 hours. The grain size and microstructure characteristics for various samples and their phase composition was carried out using a scanning electron microscope (SEM equipped with EDS system. SEM analysis of Ho/BaTiO3 doped ceramics showed that in samples doped with a rare-earth ions low level, the grain size ranged from 20-30μm, while with the higher dopant concentration the abnormal grain growth is inhibited and the grain size ranged between 2- 10μm. Dielectric measurements were carried out as a function of temperature up to 180°C. The low doped samples sintered at 1380°C, display the high value of dielectric permittivity at room temperature, 2400 for 0.01Ho/BaTiO3. A nearly flat permittivity-response was obtained in specimens with higher additive content. Using a Curie-Weiss low and modified Curie-Weiss low the Curie constant (C, Curie temperature (Tc and a critical exponent of nonlinearity (γ were calculated. The obtained value of γ pointed out that the specimens have almost sharp phase transition. [Projekat Ministarstva nauke Republike Srbije, br. 172057: Directed synthesis, structure and properties of multifunctional materials

Electric field modulated conduction mechanism in Al/BaTiO3/La0.67Sr0.33MnO3 heterostructures

KAUST Repository

Zheng, Dongxing; Li, Dong; Gong, Junlu; Jin, Chao; Li, Peng; Zhang, Xixiang; Bai, Haili

2017-01-01

Mediating a metastable state is a promising way to achieve a giant modulation of physical properties in artificial heterostructures. A metastable state La0.67Sr0.33MnO3 (LSMO) layer suffering tensile strain was grown on MgO substrates. Incorporating with the ferroelectric BaTiO3 (BTO) layer, an accumulation or depletion state controlled by electric fields can be formed at the BTO/LSMO interface, which drives a switching of the conduction mechanism between space charge limited conduction and Poole-Frenkel emission, corresponding to the low and high resistance states. Our results lighten an effective way for electric-field modulated resistance states in multiferroic magnetoelectric devices.

Electric field modulated conduction mechanism in Al/BaTiO3/La0.67Sr0.33MnO3 heterostructures

KAUST Repository

Zheng, Dongxing

2017-08-08

Mediating a metastable state is a promising way to achieve a giant modulation of physical properties in artificial heterostructures. A metastable state La0.67Sr0.33MnO3 (LSMO) layer suffering tensile strain was grown on MgO substrates. Incorporating with the ferroelectric BaTiO3 (BTO) layer, an accumulation or depletion state controlled by electric fields can be formed at the BTO/LSMO interface, which drives a switching of the conduction mechanism between space charge limited conduction and Poole-Frenkel emission, corresponding to the low and high resistance states. Our results lighten an effective way for electric-field modulated resistance states in multiferroic magnetoelectric devices.

Compensation mechanisms at high temperature in Y-doped BaTiO3

International Nuclear Information System (INIS)

Paredes-Olguín, M.; Lira-Hernández, I.A.; Gómez-Yáñez, C.; Espino-Cortés, F.P.

2013-01-01

Samples of BaTiO 3 with different concentrations of Y were synthesized from powders. The mixtures of powders were pressed and sintered at 1500 °C for 1 h. Two groups of samples were processed, one satisfying Ba/(Ti+Y) 3+ occupies the Ti 4+ lattice sites. The conductivity behavior as a function of Y concentration suggests that the compensation mechanisms are hole and oxygen vacancies. Due to the presence of charge carriers in the material, high values for the dielectric constant and dielectric loss were observed. Analysis of the microstructure showed that the average grain size decreases as the Y concentration is increased.

Gold nanoparticles decorated on BaTiO3 as photocatalyst: effect of SPR and ferroelectricity

Science.gov (United States)

Miao, Zhilei; Chen, Lei; Wang, Rui; Yuan, Rongchun; Zhou, Fang; Lv, Pengfei; Zhang, Xiuyun; Wang, Qiang

2018-02-01

BaTiO3(BTO) powders with cubic(C) and tetragonal(T) crystalline structures were prepared by sol-gel method followed by calcination at different temperatures, and they were decorated with gold nanoparticles(AuNPs) to form Au-T-BTO and Au-C-BTO respectively. All the samples (C-BTO, T-BTO, Au-C-BTO and Au-T-BTO) were used as photo-catalysts for the degradation of Rhodamine B (RhB). Au-T-BTO exhibits the highest photocatalytic activity due to thecombined effect of surface plasmon resonance (SPR) and the ferroelectricity of the tetragonalphase BTO. The light absorption peaks at 500 to 600 nm verify the presence of SPR effect from Au NPs. Based on density functional theory (DFC) within the generalized gradient approximation (GGA) approach, it was demonstrated that the tetragonal phase BaTiO3 shows a spontaneous polarization with the calculated value of 0.34 C m-2, which is absent in thecubic phase. The internal space charge layer in tetragonal phase BTO enhances the separation of photoexcited carriers due to the spontaneous ferroelectric polarization, which also benefits photocatalytic activities.

Induced Ti magnetization at La0.7Sr0.3MnO3 and BaTiO3 interfaces

Directory of Open Access Journals (Sweden)

Yaohua Liu

2016-04-01

Full Text Available In artificial multiferroics hybrids consisting of ferromagnetic La0.7Sr0.3MnO3 (LSMO and ferroelectric BaTiO3 epitaxial layers, net Ti moments are found from polarized resonant soft x-ray reflectivity and absorption. The Ti dichroic reflectivity follows the Mn signal during the magnetization reversal, indicating exchange coupling between the Ti and Mn ions. However, the Ti dichroic reflectivity shows stronger temperature dependence than the Mn dichroic signal. Besides a reduced ferromagnetic exchange coupling in the interfacial LSMO layer, this may also be attributed to a weak Ti-Mn exchange coupling that is insufficient to overcome the thermal energy at elevated temperatures.

Crystallization to polycrystalline silicon thin film and simultaneous inactivation of electrical defects by underwater laser annealing

Energy Technology Data Exchange (ETDEWEB)

Machida, Emi [Graduate School of Materials Science, Nara Institute of Science and Technology, 8916-5 Takayama-cho, Ikoma, Nara 630-0192 (Japan); Research Fellowships of the Japan Society for the Promotion of Science, Japan Society for the Promotion of Science, 1-8 Chiyoda, Tokyo 102-8472 (Japan); Horita, Masahiro; Ishikawa, Yasuaki; Uraoka, Yukiharu [Graduate School of Materials Science, Nara Institute of Science and Technology, 8916-5 Takayama-cho, Ikoma, Nara 630-0192 (Japan); Core Research for Evolutional Science and Technology, Japan Science and Technology Agency, Honcho, Kawaguchi, Saitama 332-0012 (Japan); Ikenoue, Hiroshi [Graduate School of Information Science and Electrical Engineering, Kyushu University, 744 Motooka Nishi-ku, Fukuoka 819-0395 (Japan)

2012-12-17

We propose a low-temperature laser annealing method of a underwater laser annealing (WLA) for polycrystalline silicon (poly-Si) films. We performed crystallization to poly-Si films by laser irradiation in flowing deionized-water where KrF excimer laser was used for annealing. We demonstrated that the maximum value of maximum grain size of WLA samples was 1.5 {mu}m, and that of the average grain size was 2.8 times larger than that of conventional laser annealing in air (LA) samples. Moreover, WLA forms poly-Si films which show lower conductivity and larger carrier life time attributed to fewer electrical defects as compared to LA poly-Si films.

Overcoming challenges to the formation of high-quality polycrystalline TiO{sub 2}:Ta transparent conducting films by magnetron sputtering

Energy Technology Data Exchange (ETDEWEB)

Neubert, M.; Cornelius, S.; Fiedler, J. [Institute of Ion Beam Physics and Materials Research, Helmholtz-Zentrum Dresden-Rossendorf, P.O. Box 510119, 01314 Dresden (Germany); Gebel, T.; Liepack, H. [DTF Technology GmbH, 01108 Dresden (Germany); Kolitsch, A. [Institute of Ion Beam Physics and Materials Research, Helmholtz-Zentrum Dresden-Rossendorf, P.O. Box 510119, 01314 Dresden (Germany); HZDR Innovation GmbH, 01328 Dresden (Germany); Vinnichenko, M. [Fraunhofer-Institut für Keramische Technologien und Systeme, 01277 Dresden (Germany)

2013-08-28

The work is focused on understanding the physical processes responsible for the modification of the structure, electrical and optical properties of polycrystalline TiO{sub 2}:Ta films formed by annealing of initially amorphous films grown by direct current magnetron sputtering of electrically conductive ceramic targets. It is shown that fine tuning of the oxygen content during deposition of amorphous TiO{sub 2}:Ta films is critical to achieving low resistivity and high optical transmittance after annealing. Increasing the total pressure during magnetron sputter deposition is shown to decrease the sensitivity of the annealed films to the oxygen flow variation during deposition of the initially amorphous layers. Polycrystalline anatase TiO{sub 2}:Ta films of low electrical resistivity (ρ{sub H} = 1.5 × 10{sup −3}Ω cm), high free electron mobility (μ{sub H} = 8 cm{sup 2}/Vs), and low extinction (k{sub 550nm} = 0.006) are obtained in this way at a total pressure of 2 Pa. The dependence of the polycrystalline film electrical properties on the oxygen content is discussed in terms of Ta dopant electrical activation/deactivation taking into account the formation of compensating defects at different oxygen pressures. The temperature-dependent transport of the polycrystalline anatase TiO{sub 2}:Ta films is investigated showing the dominant role of the optical phonon scattering in the case of films with an optimum Ti/O ratio.

Electrostrain in excess of 1% in polycrystalline piezoelectrics

Science.gov (United States)

Narayan, Bastola; Malhotra, Jaskaran Singh; Pandey, Rishikesh; Yaddanapudi, Krishna; Nukala, Pavan; Dkhil, Brahim; Senyshyn, Anatoliy; Ranjan, Rajeev

2018-05-01

Piezoelectric actuators transform electrical energy into mechanical energy, and because of their compactness, quick response time and accurate displacement, they are sought after in many applications. Polycrystalline piezoelectric ceramics are technologically more appealing than single crystals due to their simpler and less expensive processing, but have yet to display electrostrain values that exceed 1%. Here we report a material design strategy wherein the efficient switching of ferroelectric-ferroelastic domains by an electric field is exploited to achieve a high electrostrain value of 1.3% in a pseudo-ternary ferroelectric alloy system, BiFeO3-PbTiO3-LaFeO3. Detailed structural investigations reveal that this electrostrain is associated with a combination of several factors: a large spontaneous lattice strain of the piezoelectric phase, domain miniaturization, a low-symmetry ferroelectric phase and a very large reverse switching of the non-180° domains. This insight for the design of a new class of polycrystalline piezoceramics with high electrostrains may be useful to develop alternatives to costly single-crystal actuators.

Barium titanate nanometric polycrystalline ceramics fired by spark plasma sintering.

Czech Academy of Sciences Publication Activity Database

Ctibor, Pavel; Sedláček, J.; Ryukhtin, Vasyl; Cinert, Jakub; Lukáč, František

2016-01-01

Roč. 42, č. 14 (2016), s. 15989-15993 ISSN 0272-8842 R&D Projects: GA ČR GB14-36566G; GA MŠk LM2015056 Institutional support: RVO:61389021 ; RVO:61389005 Keywords : BaTiO3 * Spark plasma sintering * Electrical properties Subject RIV: JH - Ceramics, Fire-Resistant Materials and Glass; JH - Ceramics, Fire-Resistant Materials and Glass (UJF-V) Impact factor: 2.986, year: 2016 http://www.sciencedirect.com/science/article/pii/S0272884216311695

Influence of domain on grain size effects of the dielectric properties of BaTiO3 nanoceramics and nanoparticles

International Nuclear Information System (INIS)

Fang Chao; Chen Liangyan; Zhou Dongxiang

2013-01-01

The dielectric property of BaTiO 3 nanoparticles and nanoceramics has been studied on the basis of Ginsburg-Landau-Devonshire thermodynamic theory. In this paper, considering nanodomains, Landau coefficients have been written as a function of grain size, and the dielectric constant of the material has been calculated at a variety of temperatures and grain size. The results indicate that with decreasing grain size, the dielectric peak decreases. The two lower dielectric peaks of the orthorhombic-rhombohedral phase and tetragonal-orthorhombic phase move to higher temperature, while cubic-tetragonal phase dielectric peak moves to lower temperature. The dielectric constant of BaTiO 3 ceramics decreases with decreasing grain size. The dielectric constant peak at room temperature is at the grain size which is larger than the critical grain size 17-30 nm. The calculated result is consistent with the experimental data.

Piezoelectric properties of electrospun nanofibers of BaTiO3

International Nuclear Information System (INIS)

Carvalho, L.F.R.M.; Melo, G.F.; Goncalves, A.M.; Eiras, J.A.; Bretas, R.E.S.

2016-01-01

BaTiO3 nanofibers were produced by the electrospinning method from a mixture of a solution of the precursors Ba (CH_3COO)_2 and [(CH_3)_2CHO]_4Ti in acetic acid and a solution of poly(vinylpyrrolidone) in ethanol. A voltage of 10 kV and a working distance of 4.6 cm were used for the electrospinning, at controlled room temperature and humidity of 21 °C and 60% respectively. Nanofibers as spun were dried in air on an air-circulating oven at 100 °C for one hour to remove residual solvent and were subsequently calcined at 750 °C during 2 h. The morphology, crystallographic structure and piezoelectric properties of the nanofibers were analyzed by scanning electron microscopy (SEM), X-ray angle (WAXS) and Piezoresponse Force Microscopy (PFM), respectively. The average diameter of the nanofibers was 414 nm with an aspect ratio of 40. By PFM, there was strong evidence that the nanofibers had piezoelectric activity. (author)

Conformación de termistores utilizando polvos de BaTiO3 sintetizados por el método pechini

Directory of Open Access Journals (Sweden)

Claudia P. Fernández Perdomo

2010-05-01

Full Text Available El titanato de bario, BaTiO3, es un compuesto de gran interés en el ámbito de la electrocerámica, ya que se utiliza en la fabricación de condensadores, transductores piezoeléctricos y dispositivos resistivos con coeficiente positivo de temperatura (PTCR, así como en la manufactura de piroeléctricos y dispositivos optoelectrónicos, entre otros dispositivos. La mayoría de estos componentes son conformados con polvos cerámicos de elevada pureza y tamaño de partícula adecuado. Esto exige estructurar métodos de síntesis que garanticen es- tos requerimientos. En este trabajo se sintetizaron polvos cerámicos de BaTiO3 por el método de precursor polimérico (Pechini, obteniéndose una materia prima muy pura y con pequeño tamaño de partícula. Los polvos obtenidos se caracterizaron utilizando análisis térmico (ATD/TG, difracción de rayos X (DRX y calorimetría diferencial de barrido (DSC. Los resultados indican que en las muestras tratadas a 650 °C la única fase cristalina presente es el BaTiO3 cúbico y a 1.100 °C la tetragonal, con una relación c/a < 1.007. Las muestras tratadas a 1.100 °C presentaron una transición ferroeléctrica a paraeléctrica a una temperatura de T ≈ 123 °C. Los polvos cerámicos de BaTiO3 tetragonal fueron prensados uniaxialmente y posteriormente sinterizados a 1.200 °C durante 2 horas. Estas muestras se caracterizaron eléctricamente, obteniéndose curvas de resistencia eléctrica en función de la temperatura (R-T, evidenciándose en ellas su comportamiento termistor tipo PTCR. Además, se midió la variación de la corriente-voltaje (I-V a diferentes temperaturas.

Effects of Reaction Medium on the Phase Synthesis and Particle Size Evolution of BaTiO3

NARCIS (Netherlands)

Stawski, Thomasz M.; Veldhuis, Sjoerd A.; Göbel, Ole; ten Elshof, Johan E.; Blank, David H.A.

2010-01-01

The low-temperature alkoxide–hydroxide precipitation synthesis of nanosized crystalline barium titanate (BaTiO3) in nonaqueous media is presented. In this report, we show the influence of the reaction medium on the nature of the product by investigating the reaction of titanium (IV) isopropoxide

On stoichiometry and intermixing at the spinel/perovskite interface in CoFe2O4/BaTiO3 thin films.

Science.gov (United States)

Tileli, Vasiliki; Duchamp, Martial; Axelsson, Anna-Karin; Valant, Matjaz; Dunin-Borkowski, Rafal E; Alford, Neil McN

2015-01-07

The performance of complex oxide heterostructures depends primarily on the interfacial coupling of the two component structures. This interface character inherently varies with the synthesis method and conditions used since even small composition variations can alter the electronic, ferroelectric, or magnetic functional properties of the system. The focus of this article is placed on the interface character of a pulsed laser deposited CoFe2O4/BaTiO3 thin film. Using a range of state-of-the-art transmission electron microscopy methodologies, the roles of substrate morphology, interface stoichiometry, and cation intermixing are determined on the atomic level. The results reveal a surprisingly uneven BaTiO3 substrate surface formed after the film deposition and Fe atom incorporation in the top few monolayers inside the unit cell of the BaTiO3 crystal. Towards the CoFe2O4 side, a disordered region extending several nanometers from the interface was revealed and both Ba and Ti from the substrate were found to diffuse into the spinel layer. The analysis also shows that within this somehow incompatible composite interface, a different phase is formed corresponding to the compound Ba2Fe3Ti5O15, which belongs to the ilmenite crystal structure of FeTiO3 type. The results suggest a chemical activity between these two oxides, which could lead to the synthesis of complex engineered interfaces.

Quantitative analysis of UV excitation bands for red emissions in Pr3+-doped CaTiO3, SrTiO3 and BaTiO3 phosphors by peak fitting

International Nuclear Information System (INIS)

Fujiwara, Rei; Sano, Hiroyuki; Shimizu, Mikio; Kuwabara, Makoto

2009-01-01

A quantitative spectral analysis of the ultraviolet (UV) broad excitation bands, which are located in the range 300-400 nm, for red emissions at around 610 nm in Pr-doped CaTiO 3 , SrTiO 3 :Al and BaTiO 3 :Mg phosphors has been carried out using a peak fitting technique. The obtained results demonstrate that the UV broad band of CaTiO 3 :Pr consists of four primary excitation bands centered around 330, 335, 365 and 380 nm and those of both SrTiO 3 :Al and BaTiO 3 :Mg consist of three primary bands centered around 310, 345 and 370 nm. Based on the behavior patterns and the values of the respective primary excitation bands' parameters, i.e. center gravity (λ top ), maximum height (I max ) and full-width at half-maximum (FWHM), the UV-to-red relaxation processes in these titanate phosphors can be explained to be essentially the same, except for the existence of an additional relaxation pathway via electron-trap states in CaTiO 3 :Pr, which gives a characteristic shape of its UV excitation spectrum in the wavelength range of >360 nm

Symmetry, strain, defects, and the nonlinear optical response of crystalline BaTiO3/silicon

Science.gov (United States)

Kormondy, Kristy; Abel, Stefan; Popoff, Youri; Sousa, Marilyne; Caimi, Daniele; Siegwart, Heinz; Marchiori, Chiara; Rossell, Marta; Demkov, Alex; Fompeyrine, Jean

Recent progress has been made towards exploiting the linear electro-optic or Pockels effect in ferroelectric BaTiO3 (BTO) for novel integrated silicon photonics devices. In such structures, the crystalline symmetry and domain structure of BTO determine which electro-optic tensor elements are accessible under application of an external electric field. For epitaxial thin films of BTO on Si (001), the role of defects in strain relaxation can lead to very different crystalline symmetry even for films of identical thickness. Indeed, through geometric phase analysis of high-resolution scanning transmission electron microscopy images, we map changes of the in-plane and out-of-plane lattice parameters across two 80-nm-thick BTO films. A corresponding 20% difference in the effective electro-optic response was measured by analyzing induced rotation of the polarization of a laser beam (λ = 1550 nm) transmitted through lithographically defined electrodes. Understanding, controlling, and modelling the role of BTO symmetry in nonlinear optics is of fundamental importance for the development of a hybrid BTO/Si photonics platform.. Work supported by the NSF (IRES-1358111), AFOSR (FA9550-12-10494), and European Commission (FP7-ICT-2013-11-619456-SITOGA).

Production of BaTiO3 nanoparticles through the sol-gel route using humic substances from river water

International Nuclear Information System (INIS)

Lima, C.H.S.; Lima, S.S.S.; Gomes, M.A.; Novaes, S.M.V.; Macedo, Z.S.

2016-01-01

A new route of synthesis, low cost and low environmental impact, has been developed for the production of barium titanate (BaTiO3). This material is widely used in the electronics industry due to its dielectric properties, ferroelectric and piezoelectric. Its crystal structure of perovskite type also has the ability to host dopants of different sizes, allowing a wide variety of ions is accommodated in BaTiO3 structure. The synthesis route proposed in this paper explores the complexation capacity of natural organic matter (NOM). Parameters such as concentration, pH and calcination temperature were investigated during production, with the aim of developing a simple, efficient and low energy cost procedure. Samples produced with concentration 0.5 g / ml showed a single phase after calcination at 1200 °C for 5 h. The crystallite size was estimated by Scherrer equation around 28 nm and the particle size, determined by scanning electron microscopy (SEM-FEG) was from 80 to 180nm order. The sample produced also presented heterogeneous morphology with spherical particles, rods and needles. (author)

Magnetoelectric coupling in multiferroic BaTiO3-CoFe2O4 composite nanofibers via electrospinning

Science.gov (United States)

Fu, Bi; Lu, Ruie; Gao, Kun; Yang, Yaodong; Wang, Yaping

2015-07-01

Magnetoelectric (ME) coupling in Pb-based multiferroic composites has been widely investigated due to the excellent piezoelectric property of lead zirconate titanate (PZT). In this letter, we report a strategy to create a hybrid Pb-free ferroelectric and ferromagnetic material and detect its ME coupling at the nanoscale. Hybrid Pb-free multiferroic BaTiO3-CoFe2O4 (BTO-CFO) composite nanofibers (NFs) were generated by sol-gel electrospinning. The perovskite structure of BTO and the spinel structure of CFO nanograins were homogenously distributed in the composite NFs and verified by bright-field transmission electron microscopy observations along the perovskite [111] zone axis. Multiferroicity was confirmed by amplitude-voltage butterfly curves and magnetic hysteresis loops. ME coupling was observed in terms of a singularity on a dM/dT curve at the ferroelectric Curie temperature (TC) of BaTiO3. The lateral ME coefficient was investigated by the evolution of the piezoresponse under an external magnetic field of 1000 Oe and was estimated to be α31 =0.78× 104 \\text{mV cm}-1 \\text{Oe}-1 . These findings could enable the creation of nanoscale Pb-free multiferroic composite devices.

Enhanced thermoelectric properties of N-type polycrystalline In4Se3-x compounds via thermally induced Se deficiency

Science.gov (United States)

Zhao, Ran; Shu, Yu-Tian; Guo, Fu

2014-03-01

In4Se3-x compound is considered as a potential thermoelectric material due to its comparably low thermal conductivity among all existing ones. While most studies investigated In4Se3-x thermoelectric properties by controlling selennium or other dopants concentrations, in the current study, it was found that even for a fixed initial In/Se ratio, the resulting In/Se ratio varied significantly with different thermal processing histories (i.e., melting and annealing), which also resulted in varied thermoelectric properties as well as fracture surface morphologies of In4Se3-x polycrystalline specimens. Single phase polycrystalline In4Se3-x compounds were synthesized by combining a sequence of melting, annealing, pulverizing, and spark plasma sintering. The extension of previous thermal history was observed to significantly improve the electrical conductivity (about 121%) and figure of merit (about 53%) of In4Se3-x polycrystalline compounds. The extended thermal history resulted in the increase of Se deficiency (x) from 0.39 to 0.53. This thermally induced Se deficiency was observed to associate with increasing carrier mobility but decreasing concentration, which differs from the general trend observed for the initially adjusted Se deficiency at room temperature. Unusually large dispersed grains with nanosize layers were observed in specimens with the longest thermal history. The mechanism(s) by which previous thermal processing enhances carrier mobility and affect microstructural evolution are briefly discussed.

Direct detection of cysteine using functionalized BaTiO3 nanoparticles film based self-powered biosensor.

Science.gov (United States)

Selvarajan, Sophia; Alluri, Nagamalleswara Rao; Chandrasekhar, Arunkumar; Kim, Sang-Jae

2017-05-15

Simple, novel, and direct detection of clinically important biomolecules have continuous demand among scientific community as well as in market. Here, we report the first direct detection and facile fabrication of a cysteine-responsive, film-based, self-powered device. NH 2 functionalized BaTiO 3 nanoparticles (BT-NH 2 NPs) suspended in a three-dimensional matrix of an agarose (Ag) film, were used for cysteine detection. BaTiO 3 nanoparticles (BT NPs) semiconducting as well as piezoelectric properties were harnessed in this study. The changes in surface charge properties of the film with respect to cysteine concentrations were determined using a current-voltage (I-V) technique. The current response increased with cysteine concentration (linear concentration range=10µM-1mM). Based on the properties of the composite (BT/Ag), we created a self-powered cysteine sensor in which the output voltage from a piezoelectric nanogenerator was used to drive the sensor. The potential drop across the sensor was measured as a function of cysteine concentrations. Real-time analysis of sensor performance was carried out on urine samples by non-invasive method. This novel sensor demonstrated good selectivity, linear concentration range and detection limit of 10µM; acceptable for routine analysis. Copyright © 2016 Elsevier B.V. All rights reserved.

Sonochemically assisted hollow/solid BaTiO3:Dy3+ microspheres and their applications in effective detection of latent fingerprints and lip prints

Directory of Open Access Journals (Sweden)

M. Dhanalakshmi

2017-03-01

Full Text Available Nanostructured materials find potential benefits for surface-based science such as latent fingerprints (LFPs and lip print detection on porous and non-porous surfaces. To encounter the drawbacks viz. low sensitivity, high background hindrance, complicated procedure and high toxicity associated with traditional fluorescent powders were resolved by using hollow/solid BaTiO3:Dy3+ (1–5 mol % microspheres. The visualization of LFPs stained by the optimized BaTiO3:Dy3+ (2 mol % hollow/solid microspheres exhibits well-defined ridge patterns with high sensitivity, low background hindrance, high efficiency and low toxicity on various surfaces. The powder X-ray diffraction results revealed the body centered cubic phase of the prepared samples. The emission spectra exhibit intensive peaks at ∼480, 575, and 637 nm, which were attributed to transitions 4F9/2→6HJ (J = 15/2, 13/2, 11/2 of Dy3+ ions, respectively. Surface morphologies were extensively studied with different sonication times and concentrations of the used barbituric acid. The Commission International De I-Eclairage (CIE and Correlated Color Temperature (CCT analyses revealed that the present phosphor is highly useful for the fabrication of white light emitting diodes.

A new computer-aided simulation model for polycrystalline silicon film resistors

Science.gov (United States)

Ching-Yuan Wu; Weng-Dah Ken

1983-07-01

A general transport theory for the I-V characteristics of a polycrystalline film resistor has been derived by including the effects of carrier degeneracy, majority-carrier thermionic-diffusion across the space charge regions produced by carrier trapping in the grain boundaries, and quantum mechanical tunneling through the grain boundaries. Based on the derived transport theory, a new conduction model for the electrical resistivity of polycrystalline film resitors has been developed by incorporating the effects of carrier trapping and dopant segregation in the grain boundaries. Moreover, an empirical formula for the coefficient of the dopant-segregation effects has been proposed, which enables us to predict the dependence of the electrical resistivity of phosphorus-and arsenic-doped polycrystalline silicon films on thermal annealing temperature. Phosphorus-doped polycrystalline silicon resistors have been fabricated by using ion-implantation with doses ranged from 1.6 × 10 11 to 5 × 10 15/cm 2. The dependence of the electrical resistivity on doping concentration and temperature have been measured and shown to be in good agreement with the results of computer simulations. In addition, computer simulations for boron-and arsenic-doped polycrystalline silicon resistors have also been performed and shown to be consistent with the experimental results published by previous authors.

Magnetic behavior of La2/3Ca1/3MnO3 / BaTiO3 bilayers

Science.gov (United States)

Ordonez, John E.; Gomez, Maria E.; Lopera, Wilson; Marin, Lorena; Pardo, Jose A.; Morellon, Luis; Algarabel, Pedro; Prieto, Pedro

2013-03-01

We have grown ferroelectric BaTiO3(BTO) and ferromagnetic La2/3Ca1/3MnO3 (LCMO) onto (001) SrTiO3 and Nb:SrTiO3 by pulsed laser deposition (PLD) at pure oxygen atmosphere, and a substrate temperature of 820° C, seeking for a multiferroic behavior in this structure. From x-ray diffraction (XRD) we found lattice parameter aBTO=4.068 Å, and aLCMO=3.804 Å, for each individual layer. In the BTO/LCMO bilayer, (002)-Bragg peak for BTO maintain its position whereas (002) LCMO peak shift to lower Bragg angle indicating a strained LCMO film. Magnetization measurements reveal an increase in the Curie temperature from 170 K to 220 K for the bilayer when LCMO (t = 47 nm) is deposited on BTO (t=52 nm) film, while depositing the BTO (50 nm) above LCMO (48 nm) the Curie temperature remains at values close to that obtained for a LCMO single layer (~175 K), deposited under identical growth parameters This work has been supported by Instituto de Nanociencias de Aragón, Zaragoza, Spain, ``El Patrimonio Autónomo Fondo Nacional de Financiamiento para CT&I FJC'' COLCIENCIAS-CENM Contract RC 275-2011 and Research Project COLCIENCIAS-UNIVALLE.

Effects of applied electric field during postannealing on the tunable properties of (Ba,Sr)TiO3 thin films

International Nuclear Information System (INIS)

Xia Yidong; Cheng Jinbo; Pan Bai; Wu Di; Meng Xiangkang; Liu Zhiguo

2005-01-01

The impact of postannealing in electric field on the structure, tunability, and dielectric behavior of rf magnetron sputtering derived (Ba,Sr)TiO 3 films has been studied. It has been demonstrated that postannealing in the proper electric field can increase the dielectric constant and the tunability remarkably and destroy the symmetry of capacitance-voltage characteristics of the films. The increased out-of-plane lattice constant and the appearance of the hysteresis loops in the electric-annealed films indicated the formation of small polar regions with tetragonal structure, which are responsible for the increased dielectric constant and tunability. It was proposed that the segregation of Ti 3+ ions caused by electric annealing could induce the formation of BaTiO 3 -like regions, which are ferroelectric at room temperature

Effects of applied electric field during postannealing on the tunable properties of (Ba,Sr)TiO3 thin films

Science.gov (United States)

Xia, Yidong; Cheng, Jinbo; Pan, Bai; Wu, Di; Meng, Xiangkang; Liu, Zhiguo

2005-08-01

The impact of postannealing in electric field on the structure, tunability, and dielectric behavior of rf magnetron sputtering derived (Ba,Sr)TiO3 films has been studied. It has been demonstrated that postannealing in the proper electric field can increase the dielectric constant and the tunability remarkably and destroy the symmetry of capacitance-voltage characteristics of the films. The increased out-of-plane lattice constant and the appearance of the hysteresis loops in the electric-annealed films indicated the formation of small polar regions with tetragonal structure, which are responsible for the increased dielectric constant and tunability. It was proposed that the segregation of Ti3+ ions caused by electric annealing could induce the formation of BaTiO3-like regions, which are ferroelectric at room temperature.

Dielectric and conducting behaviour of polycrystalline holmium octa-molybdate

International Nuclear Information System (INIS)

Want, Basharat; Zahoor Ahmad, Bhat; Hamid Bhat, Bilal

2014-01-01

Polycrystalline holmium octa-molybdate spherulites have been obtained by using gel diffusion technique and characterized by different physio-chemical techniques. The surfaces of these spherulites are composed of nano-rod with an average diameter of about 80 nm. At room temperature the initial crystal structure is triclinic, space group P1. Thermal studies suggested a phase transition occurring in holmium octa-molybdate crystals at about 793 K. The electrical properties of the system have been studied as a function of frequency and temperature in the ranges of 20 Hz–3 MHz and 290–570 K, respectively. A giant dielectric constant and two loss peaks have been observed in the permittivity formalism. The conducting behaviour of the material is also discussed. The conductivity was found to be 1572 μ Ω −1 m −1 at room temperature and 3 MHz frequency. The conductivity of the polycrystalline material was attributed to the fact that it arises due to the migration of defects on the oxygen sub-lattice. Impedance studies were also performed in the frequency domain to infer the bulk and grain boundary contributions to the overall electric response of the material. The electrical responses have been attributed to the grain, grain-boundary, and interfacial effects. (paper)

Strong magnetoelectric coupling in CoFe2O4-BaTiO3 composites prepared by molten-salt synthesis method

International Nuclear Information System (INIS)

Nie Junwu; Xu Guoyue; Yang Ying; Cheng Chuanwei

2009-01-01

Magnetoelectric nano-composites (1 - x)CoFe 2 O 4 + (x)BaTiO 3 with x varies as 0, 0.5, 0.65 and 1.0 in molar ratio were prepared by molten-salt synthesis method. The structural analysis carried out by X-ray diffraction (XRD) technique has confirmed that both phases are present in all the nano-composites powders and ceramic composites. The TEM images show that the nano-particle crystallite size is about 50-80 nm, which is consistent to the result calculated by XRD. The dielectric constant was studied as a function of frequency for ceramic composites sintered by using those nano-composite powders. The saturation magnetization (Ms) and remnant polarization (Pr) were calculated from the magnetic hysteresis loop and electric hysteresis loop, respectively. And a large ME coefficient of about 17.04 mV cm -1 Oe -1 was observed for 0.5CoFe 2 O 4 + 0.5BaTiO 3 ME composite under the ac superimposed magnetic signal with 20 kHz frequency by using the lock-in technique

The influence of high hydrostatic pressure on lattice parameters of a single crystal of BaTiO3

International Nuclear Information System (INIS)

Malinowski, M.; Lukaszewicz, K.; Asbrink, S.

1986-01-01

The lattice parameters of a single crystal of BaTiO 3 have been measured under high hydrostatic pressure up to 5 GPa using a diamond-anvil high-pressure cell of a new design. The lattice becomes cubic at 2.08(8) GPa and stays cubic at higher pressures. The pressure dependence of the tetragonal-cubic transition temperature is estimated to be -46 K GPa -1 . (orig.)

Evolution from successive phase transitions to "morphotropic phase boundary" in BaTiO3-based ferroelectrics

Science.gov (United States)

Zhou, Chao; Ke, Xiaoqin; Yao, Yonggang; Yang, Sen; Ji, Yuanchao; Liu, Wenfeng; Yang, Yaodong; Zhang, Lixue; Hao, Yanshuang; Ren, Shuai; Zhang, Le; Ren, Xiaobing

2018-04-01

Obtaining superior physical properties for ferroic materials by manipulating the phase transitions is a key concern in solid state physics. Here, we investigated the dielectric permittivity, piezoelectric coefficient d33, storage modulus, and crystal symmetry of (1-x)Ba(Ti0.8Zr0.2)O3-x(Ba1-yCay)TiO3 (BZT-xBCyT) systems to demonstrate the gradual evolution process from successive phase transitions in BaTiO3 to the morphotropic phase boundary (MPB) regime in BZT-xBC0.3T. Furthermore, we analysed with a Landau-type theoretical model to show that the high field-sensitive response (dielectric permittivity) originates from a small polarization anisotropy and low energy barrier at the quadruple point. Together, the intermediate orthorhombic phase regime and the tetragonal-orthorhombic and orthorhombic-rhombohedral phase boundaries constitute the MPB. Our work not only reconciles the arguments regarding whether the structural state around the MPB corresponds to a single-phase regime or a multiple-phase-coexistence regime but also suggests an effective method to design high-performance functional ferroic materials by tailoring the successive phase transitions.

Electrical and mechanical properties of 0.5Ba (Zr0.2Ti0.8)O3-0.5 (Ba0.7Ca0.3)TiO3 (BZT-BCT) lead free ferroelectric ceramics reinforced with Al2O3 nano-oxide

International Nuclear Information System (INIS)

Adhikari, Prativa; Mazumder, R.

2014-01-01

Piezoelectric ceramics are widely used as actuator, resonator, and spark igniter. Recently, much attention has been paid to prepare 0.5Ba (Zr 0.2 Ti 0.8 )O 3 -0.5 (Ba 0.7 Ca 0.3 )TiO 3 (BZT-BCT) piezoelectric ceramics because of its good dielectric, piezoelectric properties and environment friendly nature. However, piezoelectric ceramics based on BaTiO 3 suffer from low reliability and poor mechanical properties such as strength and toughness. For practical application improvement of the mechanical properties of BaTiO 3 -based ceramics is strongly required. A novel method has been used to improve the mechanical properties of structural ceramics by reinforcement of oxide (Al 2 O 3 , MgO, ZrO 2 and Stabilized-ZrO 2 ) or non-oxide (SiC) particles. It is well known that electrical properties of ferroelectric ceramics generally degrade with non-ferroelectric additives and decrease in sinterability usually encountered with refractory oxide additives. Use of nano-oxide additives may drastically reduce the amount of additive and electrical property may not degrade much. In this report we would show the electrical and mechanical properties of BZT-BCT with Al 2 O 3 nano oxide additive. Modified BZT-BCT nanocomposites were prepared by mixing and sintering of solid state synthesized Zr, Ca modified barium titanate powder and small amount (0.1-2.0 vol %) of nano-oxides, i.e. Al 2 O 3 . Effect of sintering temperature, time, particle size of the nano-oxide additives on electrical (dielectric constant, loss factor, Curie temperature, d 33 ) and mechanical (flexural strength, fracture toughness, hardness) properties were studied. We obtained ∼ 94% dense BZT-BCT reinforced with Al 2 O 3 nano-oxide at 1300℃ without degrading electrical properties (dielectric constant (4850), low dissipation factor (0.0242)) and superior mechanical properties (flexural strength - 60.3 MPa, Vickers hardness-750-800 MPa). (author)

Effect of mechanical milling on barium titanate (BaTiO3) perovskite

Science.gov (United States)

Singh, Rajan Kumar; Sanodia, Sagar; Jain, Neha; Kumar, Ranveer

2018-05-01

Commercial Barium Titanate BaTiO3 (BT) is milled by planetary ball mill in acetone medium using stainless steel bowl & ball for different hours. BT is an important perovskite oxide with structure ABO3. BT has applications in electro-optic devices, energy storing devices such as photovoltaic cells, thermistors, multiceramic capacitors & DRAMs etc. BT is non-toxic & environment friendly ceramic with high dielectric and piezoelectric property so it can be used as the substitute of PZT & PbTiO3. Here, we have investigated the effect of milling time and temperature on particle size and phase transition of BT powder. We used use Raman spectroscopy for studying the spectra of BT; XRD is used for structural study. Intensity (height) of Raman spectra and XRD spectra continuously decrease with increasing the milling hours and width if these spectra increases which indicates, decrease in BT size.

Nanofrictional behavior of amorphous, polycrystalline and textured Y-Cr-O films

International Nuclear Information System (INIS)

Gervacio-Arciniega, J.J.; Flores-Ruiz, F.J.; Diliegros-Godines, C.J.; Broitman, E.; Enriquez-Flores, C.I.; Espinoza-Beltrán, F.J.; Siqueiros, J.; Cruz, M.P.

2016-01-01

Highlights: • Friction coefficient (μ) of ferroelectric textured and polycrystalline YCrO_3 films. • A simple method to evaluate μ from a single AFM image is presented. • The AFM-cantilever spring constant was determined from its dynamic response. • Polycrystalline and amorphous films have a lower μ than textured samples. - Abstract: Differences in friction coefficients (μ) of ferroelectric YCrO_3, textured and polycrystalline films, and non-ferroelectric Y-Cr-O films are analyzed. The friction coefficient was evaluated by atomic force microscopy using a simple quantitative procedure where the dependence of friction force with the applied load is obtained in only one topographical image. A simple code was developed with the MATLAB"® software to analyze the experimental data. The code includes a correction of the hysteresis in the forward and backward scanning directions. The quantification of load exerted on the sample surface was obtained by finite element analysis of the AFM cantilever starting from its experimental dynamic information. The results show that the ferroelectric YCrO_3 film deposited on a Pt(150 nm)/TiO_2(30 nm)/SiO_2/Si (100) substrate is polycrystalline and has a lower friction coefficient than the deposited on SrTiO_3 (110), which is highly textured. From a viewpoint of industrial application in ferroelectric memories, where the writing process is electrical or mechanically achieved by sliding AFM tips on the sample, polycrystalline YCrO_3 films seem to be the best candidates due to their lower μ.

Nanofrictional behavior of amorphous, polycrystalline and textured Y-Cr-O films

Energy Technology Data Exchange (ETDEWEB)

Gervacio-Arciniega, J.J. [Centro de Nanociencias y Nanotecnología (CNyN), Universidad Nacional Autónoma de México (UNAM), km. 107, Carretera Tijuana-Ensenada, 22860 Ensenada, B.C. (Mexico); Flores-Ruiz, F.J., E-mail: fcojfloresr@gmail.com [Centro de Nanociencias y Nanotecnología (CNyN), Universidad Nacional Autónoma de México (UNAM), km. 107, Carretera Tijuana-Ensenada, 22860 Ensenada, B.C. (Mexico); Diliegros-Godines, C.J. [Centro de Nanociencias y Nanotecnología (CNyN), Universidad Nacional Autónoma de México (UNAM), km. 107, Carretera Tijuana-Ensenada, 22860 Ensenada, B.C. (Mexico); Broitman, E. [Thin Film Physics Division, IFM, Linköping University, SE-58183 Linköping (Sweden); Enriquez-Flores, C.I.; Espinoza-Beltrán, F.J. [CINVESTAV Unidad Querétaro, Lib. Norponiente 2000, Real de Juriquilla, 76230 Querétaro, Qro. (Mexico); Siqueiros, J.; Cruz, M.P. [Centro de Nanociencias y Nanotecnología (CNyN), Universidad Nacional Autónoma de México (UNAM), km. 107, Carretera Tijuana-Ensenada, 22860 Ensenada, B.C. (Mexico)

2016-08-15

Highlights: • Friction coefficient (μ) of ferroelectric textured and polycrystalline YCrO{sub 3} films. • A simple method to evaluate μ from a single AFM image is presented. • The AFM-cantilever spring constant was determined from its dynamic response. • Polycrystalline and amorphous films have a lower μ than textured samples. - Abstract: Differences in friction coefficients (μ) of ferroelectric YCrO{sub 3}, textured and polycrystalline films, and non-ferroelectric Y-Cr-O films are analyzed. The friction coefficient was evaluated by atomic force microscopy using a simple quantitative procedure where the dependence of friction force with the applied load is obtained in only one topographical image. A simple code was developed with the MATLAB{sup ®} software to analyze the experimental data. The code includes a correction of the hysteresis in the forward and backward scanning directions. The quantification of load exerted on the sample surface was obtained by finite element analysis of the AFM cantilever starting from its experimental dynamic information. The results show that the ferroelectric YCrO{sub 3} film deposited on a Pt(150 nm)/TiO{sub 2}(30 nm)/SiO{sub 2}/Si (100) substrate is polycrystalline and has a lower friction coefficient than the deposited on SrTiO{sub 3} (110), which is highly textured. From a viewpoint of industrial application in ferroelectric memories, where the writing process is electrical or mechanically achieved by sliding AFM tips on the sample, polycrystalline YCrO{sub 3} films seem to be the best candidates due to their lower μ.

Electromechanical behavior of [001]-textured Pb(Mg1/3Nb2/3)O3-PbTiO3 ceramics

Science.gov (United States)

Yan, Yongke; Wang, Yu. U.; Priya, Shashank

2012-05-01

[001]-textured Pb(Mg1/3Nb2/3)O3-PbTiO3 (PMN-PT) ceramics were synthesized by using templated grain growth method. Significantly high [001] texture degree corresponding to 0.98 Lotgering factor was achieved at 1 vol. % BaTiO3 template. Electromechanical properties for [001]-textured PMN-PT ceramics with 1 vol. % BaTiO3 were found to be d33 = 1000 pC/N, d31 = 371 pC/N, ɛr = 2591, and tanδ = ˜0.6%. Elastoelectric composite based modeling results showed that higher volume fraction of template reduces the overall dielectric constant and thus has adverse effect on the piezoelectric response. Clamping effect was modeled by deriving the changes in free energy as a function of applied electric field and microstructural boundary condition.

Calculation of strained BaTiO3 with different exchange correlation functionals examined with criterion by Ginzburg-Landau theory, uncovering expressions by crystallographic parameters

Science.gov (United States)

Watanabe, Yukio

2018-05-01

In the calculations of tetragonal BaTiO3, some exchange-correlation (XC) energy functionals such as local density approximation (LDA) have shown good agreement with experiments at room temperature (RT), e.g., spontaneous polarization (PS), and superiority compared with other XC functionals. This is due to the error compensation of the RT effect and, hence, will be ineffective in the heavily strained case such as domain boundaries. Here, ferroelectrics under large strain at RT are approximated as those at 0 K because the strain effect surpasses the RT effects. To find effective XC energy functionals for strained BaTiO3, we propose a new comparison, i.e., a criterion. This criterion is the properties at 0 K given by the Ginzburg-Landau (GL) theory because GL theory is a thermodynamic description of experiments working under the same symmetry-constraints as ab initio calculations. With this criterion, we examine LDA, generalized gradient approximations (GGA), meta-GGA, meta-GGA + local correlation potential (U), and hybrid functionals, which reveals the high accuracy of some XC functionals superior to XC functionals that have been regarded as accurate. This result is examined directly by the calculations of homogenously strained tetragonal BaTiO3, confirming the validity of the new criterion. In addition, the data points of theoretical PS vs. certain crystallographic parameters calculated with different XC functionals are found to lie on a single curve, despite their wide variations. Regarding these theoretical data points as corresponding to the experimental results, analytical expressions of the local PS using crystallographic parameters are uncovered. These expressions show the primary origin of BaTiO3 ferroelectricity as oxygen displacements. Elastic compliance and electrostrictive coefficients are estimated. For the comparison of strained results, we show that the effective critical temperature TC under strain 1000 K from an approximate method combining ab initio

Shell model for BaTiO3-Bi(Zn1/2Ti1/2)O3 perovskite solid solutions

Science.gov (United States)

Vielma, J.; Jackson, D.; Roundy, D.; Schneider, G.

2010-03-01

Even though the composition of BaTiO3-Bi(Zn1/2Ti1/2)O3 perovskite solid solutions is similar to other ferroelectric compounds, the dielectric response is unusual. Results of permittivity measurements as a function of temperature show a diffuse phase transition indicative of a weakly coupled relaxor behavior.footnotetextC. C. Huang and D. P. Cann, J. Appl. Phys. 104, 024117 (2008) To investigate the weakly coupled relaxor behavior in these materials at intermediate length scales we are developing a newly calibrated shell model based on first-principles supercell calculations of both the solid solution and its compositional endpoints. Initial results for its phase diagram will presented.

Growth of Ca, Zr co-doped BaTiO3 lead-free ferroelectric single crystal and its room-temperature piezoelectricity

Directory of Open Access Journals (Sweden)

Donglin Liu

2017-09-01

Full Text Available Lead-free Ca, Zr co-doped BaTiO3 (BCZT single crystal with a dimension up to 2mm×2mm×2mm was grown by a spontaneous nucleation technique using KF as the flux. The composition of the studied single crystal was defined to be Ba0.798Ca0.202Zr0.006Ti0.994O3, corresponding to a tetragonal phase at room temperature. The oriented single crystal exhibited a quasi-static piezoelectric constant of approximately 232 pC/N. The effective piezoelectric coefficient d33* of the single domain crystal obtained under a unipolar electric field of 35 kV/cm was 179 pm/V. Rayleigh analysis was used to identify the intrinsic and extrinsic contributions to the room-temperature piezoelectricity of BCZT single crystal. The extrinsic contribution was estimated up to 40% due to the irreversible domain wall movement. Furthermore a sixth-order polynomial of Landau expansion was employed to analyze the intrinsic contribution to piezoelectricity of BCZT single crystal. The large energy barriers inhibited polarization rotations, leading to the relatively low piezoelectricity.

Low-temperature transport properties of chemical solution deposited polycrystalline La0.7Sr0.3MnO3 ferromagnetic films under a magnetic field

International Nuclear Information System (INIS)

Zhu, Junyu; Chen, Ying; Xu, Wenfei; Yang, Jing; Bai, Wei; Wang, Genshui; Duan, Chungang; Tang, Zheng; Tang, Xiaodong

2011-01-01

Polycrystalline La 0.7 Sr 0.3 MnO 3 (LSMO) films were prepared on SiO 2 /Si (001) substrates by chemical solution deposition technique. Electrical and magnetic properties of LSMO were investigated. A minimum phenomenon in resistivity is found at the low temperature ( 0.7 Sr 0.3 MnO 3 films were grown by a modified chemical solution deposition route. → High quality LSMO thin films were prepared directly onto SiO 2 /Si substrates. → Abnormality in resistivity of LSMO films at low temperatures was studied in detail. → The abnormality was mainly attributed to Kondo-like spin dependent scattering.

Room Temperature Monoclinic Phase in BaTiO3 Single Crystals

Science.gov (United States)

Denev, Sava; Kumar, Amit; Barnes, Andrew; Vlahos, Eftihia; Shepard, Gabriella; Gopalan, Venkatraman

2010-03-01

BaTiO3 is a well studied ferroelectric material for the last half century. It is well known to show phase transitions to tetragonal, orthorhombic and rhombohedral phases upon cooling. Yet, some old and some recent studies have argued that all these phases co-exist with a second phase with monoclinic distortion. Using optical second harmonic generation (SHG) at room temperature we directly present evidence for such monoclininc phase co-existing with tetragonal phase at room temperature. We observe domains with the expected tetragonal symmetry exhibiting 90^o and 180^o domain walls. However, at points of higher stress at the tips of the interpenetrating tetragonal domains we observe a well pronounced metastable ``staircase pattern'' with a micron-scale fine structure. Polarization studies show that this phase can be explained only by monoclinic symmetry. This phase is very sensitive to external perturbations such as temperature and fields, hence stabilizing this phase at room temperature could lead to large properties' tunability.

Synthesis and characterization of multilayered BaTiO3/NiFe2O4 thin films

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Branimir Bajac

2013-03-01

Full Text Available Presented research was focused on the fabrication of multiferroic thin film structures, composed of ferrielectric barium titanate perovskite phase and magnetostrictive nickel ferrite spinel phase. The applicability of different, solution based, deposition techniques (film growth from solution, dip coating and spin coating for thefabrication of multilayered BaTiO3 /NiFe2O4 thin films was investigated. It was shown that only spin coating produces films of desired nanostructure, thickness and smooth and crackfree surfaces.

Fractal corrections of BaTiO3-ceramic sintering parameters

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Mitić V.V.

2014-01-01

Full Text Available Morphology of ceramics grains and pores as well as Brownian character of particle dynamics inside ceramics specimen contributes to better understanding of the sintering process. BaTiO3-ceramics, studied in this paper, has light fractal form and it is emanated in three aspects. First, the surface of grains, even in starting green body as well as distribution of grains shows fractal behavior. Second, existence of pores and their distribution follow the rules of fractal geometry. Third, movement of particles inside viscous flow underlies the rule of Brownian motion, which is essentially a fractal category. These three elements, each in its domain influence sintering dynamics, and can be described by dimensionless quantitative factors, αs αp and αm, being normalized to the interval [0,1]. Following sintering process, the associate formulae of Frenkel, Scherer and Mackenzie-Shuttleworth are shown from the angle of view of ceramics fractal dimension changing that approaches to 3. Also, it is shown that the energy balance is not violated after applying fractal correction to quasi equilibrium of the energy emanating from surface area reduction ES and energy adopted by viscous flow Ef .[Projekat Ministarstva nauke Republike Srbije, br. 172057: Directed synthesis, structure and properties of multifunctional materials

Electric-field control of electronic transport properties and enhanced magnetoresistance in La0.7Sr0.3MnO3/0.5BaZr0.2Ti0.8O3-0.5Ba0.7Ca0.3TiO3 lead-free multiferroic structures

Science.gov (United States)

Yan, Jian-Min; Gao, Guan-Yin; Liu, Yu-Kuai; Wang, Fei-Fei; Zheng, Ren-Kui

2017-10-01

We report the fabrication of lead-free multiferroic structures by depositing ferromagnetic La0.7Sr0.3MnO3 (LSMO) polycrystalline films on polished 0.5BaZr0.2Ti0.8O3-0.5Ba0.7Ca0.3TiO3 (BZT-BCT) piezoelectric ceramic substrates. By applying electric fields to the BZT-BCT along the thickness direction, the resistivity of LSMO films can be effectively manipulated via the piezoelectric strain of the BZT-BCT. Moreover, the LSMO polycrystalline films exhibit almost temperature independent and significantly enhanced magnetoresistance (MR) below TC. At T = 2 K and H = 8 T, the MR of polycrystalline films is approximately two orders of magnitude higher than that of LSMO epitaxial films grown on (LaAlO3)0.3(SrAl1/2Ta1/2O3)0.7 single-crystal substrates. The enhanced MR mainly results from the spin-polarized tunneling of charge carriers across grain boundaries. The LSMO/BZT-BCT structures with electric-field controllable modulation of resistivity and enhanced MR effect may have potential applications in low-energy consumption and environmentally friendly electronic devices.

Structure and properties of plasma sprayed BaTiO(3) coatings: Spray parameters versus structure and photocatalytic activity

Czech Academy of Sciences Publication Activity Database

Ctibor, Pavel; Ageorges, H.; Štengl, Václav; Murafa, Nataliya; Píš, I.; Zahoranová, T.; Nehasil, V.; Pala, Zdeněk

2011-01-01

Roč. 37, č. 7 (2011), s. 2561-2567 ISSN 0272-8842 R&D Projects: GA AV ČR IAAX00430803 Institutional research plan: CEZ:AV0Z20430508; CEZ:AV0Z40320502 Keywords : Spectroscopy * Optical properties * BaTiO3 * Plasma spraying * Photocatalysis Subject RIV: JH - Ceramics, Fire-Resistant Materials and Glass Impact factor: 1.751, year: 2011 http://www.sciencedirect.com/science/article/pii/S0272884211002173

Oxygen deficiency in MoO{sub 3} polycrystalline nanowires and nanotubes

Energy Technology Data Exchange (ETDEWEB)

Varlec, Ana, E-mail: ana.varlec@ijs.si [Condensed Matter Physics, Jožef Stefan Institute, Jamova 39, SI-1000 Ljubljana (Slovenia); Arčon, Denis [Condensed Matter Physics, Jožef Stefan Institute, Jamova 39, SI-1000 Ljubljana (Slovenia); Faculty of Mathematics and Physics, University of Ljubljana, Jadranska cesta 19, SI-1000 Ljubljana (Slovenia); Škapin, Srečo D. [Advanced Materials Department, Jožef Stefan Institute, Jamova 39, SI-1000 Ljubljana (Slovenia); Remškar, Maja [Condensed Matter Physics, Jožef Stefan Institute, Jamova 39, SI-1000 Ljubljana (Slovenia)

2016-02-15

We report on the synthesis of polycrystalline molybdenum oxide (MoO{sub 3}) nanowires via oxidation of molybdenum-sulfur-iodine (Mo{sub 6}S{sub 2}I{sub 8}) nanowires. This unique synthesis route results in an interesting morphology comprising porous nanowires and nanotubes. We found the nanowires to have the orthorhombic MoO{sub 3} structure. The structure is slightly oxygen deficient which results in the appearance of a new resonant Raman band (1004 cm{sup −1}) and paramagnetic defects (Mo{sup 5+}) of both the point and crystallographic shear plane nature. - Highlights: • Polycrystalline MoO{sub 3} nanowires were obtained via oxidation of Mo{sub 6}S{sub 2}I{sub 8} nanowires. • Nanowires are porous and tubular with either filled or empty interior. • Nanowires are slightly oxygen deficient which leads to a new Raman band.

Emergence of the sub-THz central peak at phase transitions in artificial BaTiO3/(Ba,Sr)TiO3 superlattices

International Nuclear Information System (INIS)

Tikhonov, Yu.A.; Razumnaya, A.G.; Torgashev, V.I.; Zakharchenko, I.N.; Yuzyuk, Yu.I.; El Marssi, M.; Ortega, N.; Kumar, A.; Katiyar, R.S.

2015-01-01

A prominent central peak in the sub-THz frequency range was observed in the Raman spectra of BaTiO 3 /(Ba,Sr)TiO 3 (BT/BST) superlattice grown on (001)MgO substrate. Both soft and central mode show an anomaly around 200 K and 280 K, which can be correlated with orthorhombic to monoclinic phase transition of BST and BT, respectively. The observed temperature dependence of the central mode enabled us to explain rather broad temperature dependence of the dielectric permittivity previously observed in BT/BST superlattices. (copyright 2015 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)

Etude de capacités en couches minces à base d'oxydes métalliques à très forte constante diélectrique, BaTiO3, SrTiO3 et SrTiO3/BaTiO3 déposées par pulvérisation par faisceau d'ions

OpenAIRE

Guillan , Julie

2005-01-01

In a view of miniaturization in microelectronics and more particularly in the sector of mobile phone, perovskites materials with very high permittivity are interesting candidates to replace dielectrics currently used in the development of Metal/Insulator/Metal (MIM) capacitor. This work is devoted to the development and the characterization of thin layers of strontium titanate (SrTiO3) and barium titanate (BaTiO3) deposited by Ion Beam Sputtering (IBS) in capacitive structure Pt/high-k/Pt.An ...

Influence of rare-earth additives (La, Sm and Dy on the microstructure and dielectric properties of doped BaTiO3 ceramics

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Paunović Vesna

2010-01-01

Full Text Available A series of La/Mn, Sm/Mn and Dy/Mn codoped BaTiO3 samples were prepared by the conventional solid state procedure with dopant concentrations ranging from 0.1 up to 2.0 at%. The specimens were sintered at 1320°C and 1350°C in an air atmosphere for two hours. The low doped samples demonstrated a mainly uniform and homogeneous microstructure with average grain sizes ranging from 0.3 μm to 5.0 μm. The appearance of secondary abnormal grains in the fine grain matrix and core-shell structure were observed in highly doped La/BaTiO3 and Dy/BaTiO3 sintered at 1350°C. The low doped samples, sintered at 1350°C, display a high value of dielectric permittivity at room temperature, 6800 for Sm/BaTiO3, 5900 for Dy/BaTiO3 and 3100 for La/BaTiO3. A nearly flat permittivity-response was obtained in specimens with 2.0 at% additive content. Using a modified Curie-Weiss law the Curie-like constant C⁄ and a critical exponent γ were calculated. The obtained values of γ pointed out the diffuse phase transformation in heavily doped BaTiO3 samples.

BaTiO3-based nanolayers and nanotubes: first-principles calculations.

Science.gov (United States)

Evarestov, Robert A; Bandura, Andrei V; Kuruch, Dmitrii D

2013-01-30

The first-principles calculations using hybrid exchange-correlation functional and localized atomic basis set are performed for BaTiO(3) (BTO) nanolayers and nanotubes (NTs) with the structure optimization. Both the cubic and the ferroelectric BTO phases are used for the nanolayers and NTs modeling. It follows from the calculations that nanolayers of the different ferroelectric BTO phases have the practically identical surface energies and are more stable than nanolayers of the cubic phase. Thin nanosheets composed of three or more dense layers of (0 1 0) and (0 1 1[overline]) faces preserve the ferroelectric displacements inherent to the initial bulk phase. The structure and stability of BTO single-wall NTs depends on the original bulk crystal phase and a wall thickness. The majority of the considered NTs with the low formation and strain energies has the mirror plane perpendicular to the tube axis and therefore cannot exhibit ferroelectricity. The NTs folded from (0 1 1[overline]) layers may show antiferroelectric arrangement of Ti-O bonds. Comparison of stability of the BTO-based and SrTiO(3)-based NTs shows that the former are more stable than the latter. Copyright © 2012 Wiley Periodicals, Inc.

Review on dielectric properties of rare earth doped barium titanate

International Nuclear Information System (INIS)

Ismail, Fatin Adila; Osman, Rozana Aina Maulat; Idris, Mohd Sobri

2016-01-01

Rare earth doped Barium Titanate (BaTiO_3) were studied due to high permittivity, excellent electrical properties and have wide usage in various applications. This paper reviewed on the electrical properties of RE doped BaTiO_3 (RE: Lanthanum (La), Erbium (Er), Samarium (Sm), Neodymium (Nd), Cerium (Ce)), processing method, phase transition occurred and solid solution range for complete study. Most of the RE doped BaTiO_3 downshifted the Curie temperature (T_C). Transition temperature also known as Curie temperature, T_C where the ceramics had a transition from ferroelectric to a paraelectric phase. In this review, the dielectric constant of La-doped BaTiO_3, Er-doped BaTiO_3, Sm-doped BaTiO_3, Nd-doped BaTiO_3 and Ce-doped BaTiO_3 had been proved to increase and the transition temperature or also known as T_C also lowered down to room temperature as for all the RE doped BaTiO_3 except for Er-doped BaTiO_3.

In situ study of electric field controlled ion transport in the Fe/BaTiO3 interface

DEFF Research Database (Denmark)

Merkel, D. G.; Bessas, D.; Bazso, G.

2018-01-01

Electric field controlled ion transport and interface formation of iron thin films on a BaTiO3 substrate have been investigated by in situ nuclear resonance scattering and x-ray reflectometry techniques. At early stage of deposition, an iron-II oxide interface layer was observed. The hyperfine...... parameters of the interface layer were found insensitive to the evaporated layer thickness. When an electric field was applied during growth, a 10 angstrom increase of the nonmagnetic/magnetic thickness threshold and an extended magnetic transition region was measured compared to the case where no field...... was applied. The interface layer was found stable under this threshold when further evaporation occurred, contrary to the magnetic layer where the magnitude and orientation of the hyperfine magnetic field vary continuously. The obtained results of the growth mechanism and of the electric field effect...

BaTiO3 thick fi lms obtained by tape casting from powders prepared by the oxalate route

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Adelina Ianculescu

2009-06-01

Full Text Available BaTiO3 powders were prepared by co-precipitation via oxalate route. The size, morphology and particle size distribution of the oxalate powders have been optimized by the control of different synthesis parameters during the precipitation reaction (nature of salts, concentration of different solutions, aging time. The single phase BaTiO3 oxide particles were obtained after a thermal decomposition of the as-synthesized powders at 850°C for 4 hours under air atmosphere. Oxide powders with a suitable specifi c surface area were selected in order to obtain thick fi lms by the tape casting technique. The microstructure and dielectric properties of the thick films varied obviously depending on the deposition-calcination-sintering cycle used. A double depositioncalcination cycle followed by sintering, as well as a two step deposition-calcination-sintering procedure was used in order to improve the compactness and therefore, the dielectric behaviour. A higher dielectric constant value (~ 750 and lower dielectric losses (~ 2 % were achieved at room temperature and at 1 kHz frequency for the dense, double-deposited fi lm obtained after two deposition-calcination-sintering cycles. For this film, a superior value of the dielectric constant (~ 1100, almost frequency independent in the frequency range of 100 Hz – 10 kHz was gained also at the ferroelectric-paraelectric phase transition temperature of 130°C.

Electrical Transport Properties of Polycrystalline Monolayer Molybdenum Disulfide

Science.gov (United States)

2014-07-14

Lou, Sina Najmaei, Matin Amani, Matthew L. Chin, Zheng Se. TASK NUMBER Liu Sf. WORK UNIT NUMBER 7. PERFORMING ORGANIZATION NAMES AND ADDRESSES 8...Transport Properties of Polycrystalline Monolayer Molybdenum Disulfide Sina Najmaei,t.§ Matin Ama ni,M Matthew L. Chin,* Zhe ng liu/ ·"·v: A. Gle n

Disappearance of dielectric anomaly in spite of presence of structural phase transition in reduced BaTiO3: Effect of defect states within the bandgap

Science.gov (United States)

Sagdeo, Archna; Nagwanshi, Anjali; Pokhriyal, Preeti; Sinha, A. K.; Rajput, Parasmani; Mishra, Vikash; Sagdeo, P. R.

2018-04-01

We report the structural, optical, ferroelectric, and dielectric properties of reduced BaTiO3 samples. For this purpose, oxygen vacancies in BaTiO3 are created by heating these samples with a Ti metal in a vacuum environment at different temperatures. It is observed that with an increase in oxygen deficiencies, the c/a ratio decreases as compared to that of the oxygen treated sample. The ferroelectric properties of the oxygen deficient samples are visibly different as compared to those of the oxygen treated sample. The disappearance of the P-E loop and the anomaly in the temperature variation of the dielectric constant have been observed; however, the structural phase transition corresponding to ferroelectric phase transitions still persists. Thus, it appears that the anomaly in dielectric data and the presence of the P-E loop are getting masked possibly by the Maxwell-Wagner effect. The presence of Ti+3 states in the prepared samples has been confirmed by X-ray absorption near edge structure measurements. The Kubelka-Munk optical absorption shows the presence of extra states below fundamental transition, indicating the emergence of new electronic states within the bandgap, which might be due to Ti+3 states. These new states appear at different energy positions, and with different intensities for different samples, which are reduced in the presence of Ti. These new states within the bandgap appear to modify the electronic structure, thereby reducing the overall bandgap, and hence, they seem to modify the ferroelectric and dielectric properties of the samples. Our results may be treated as experimental evidence for theoretically proposed defect states in oxygen deficient or reduced BaTiO3.

Identifying open-volume defects in doped and undoped perovskite-type LaCoO3, PbTiO3, and BaTiO3

International Nuclear Information System (INIS)

Ghosh, Vinita J.; Nielsen, Bent; Friessnegg, Thomas

2000-01-01

Dopants, vacancies, and impurity-vacancy clusters have a substantial impact on the properties of perovskite-type metal oxides (general formula ABO 3 ). In order to determine synthesis and processing conditions that optimize the desirable properties of these materials a careful study of these defects is required. It is essential to identify the defects and to map the defect densities. Positron annihilation spectroscopy has often been used to identify vacancy-type defects. Calculations of the positron lifetime and Doppler-broadened profiles of the positron-electron annihilation radiation in undoped and doped LaCoO 3 , PbTiO 3 , and BaTiO 3 are reported, and compared with available experimental data. The results show that these positron techniques are excellent for studying open-volume defects, vacancy-impurity complexes, and for identifying the sublattice occupied by the dopants. (c) 2000 The American Physical Society

Tunable band structures of polycrystalline graphene by external and mismatch strains

Institute of Scientific and Technical Information of China (English)

Jiang-Tao Wu; Xing-Hua Shi; Yu-Jie Wei

2012-01-01

Lacking a band gap largely limits the application of graphene in electronic devices.Previous study shows that grain boundaries (GBs) in polycrystalline graphene can dramatically alter the electrical properties of graphene.Here,we investigate the band structure of polycrystalline graphene tuned by externally imposed strains and intrinsic mismatch strains at the GB by density functional theory (DFT) calculations.We found that graphene with symmetrical GBs typically has zero band gap even with large uniaxial and biaxial strain.However,some particular asymmetrical GBs can open a band gap in graphene and their band structures can be substantially tuned by external strains.A maximum band gap about 0.19 eV was observed in matched-armchair GB (5,5) | (3,7) with a misorientation of θ =13° when the applied uniaxial strain increases to 9％.Although mismatch strain is inevitable in asymmetrical GBs,it has a small influence on the band gap of polycrystalline graphene.

Ferromagnetic clusters in polycrystalline BaCoO3

International Nuclear Information System (INIS)

Botta, P.M.; Pardo, V.; Calle, C. de la; Baldomir, D.; Alonso, J.A.; Rivas, J.

2007-01-01

Polycrystalline BaCoO 3 was synthesized by a citrate technique using thermal treatments at high oxygen pressure. Magnetic susceptibility measurements on the compound were carried out under AC conditions. The magnetic properties of the material at low temperatures were found to be determined by the appearance of nanoscale ferromagnetic (FM) regions and not by a true magnetic phase transition. These clusters have a mean size of about 1 nm in diameter and obey an Arrhenius-like thermal relaxation

Fracture properties of polycrystalline YBa2Cu3Ox

International Nuclear Information System (INIS)

Cook, R.F.; Shaw, T.M.; Duncombe, P.R.

1987-01-01

Polycrystalline YBa 2 Cu 3 O x has been prepared by sintering pre-reacted powder in oxygen to yield a material with 15 μm grain size, 86% relative density and which superconducts above liquid nitrogen temperatures. Indentation crack length measurements give a toughness K c = 1.3 ± 0.2 MPa m 1/2 , above a threshold contact load for radial crack initiation of approximately 5 N (compared with 1.1 MPa m 1/2 and < 0.1 N, respectively, for single crystals). The increased toughness and threshold contact load are controlled by the deviation of cracks from the plane of maximum driving force for fracture by weak grain boundaries and preferred fracture planes within grains. Optical microscopy of indentation cracks and scanning electron microscopy of fracture surfaces reveals approximately 50% intergranular fracture. The hardness of the polycrystal was H = 2.0 ± 0.5 GPa (compared with 8.7 GPa for single crystals). The decreased hardness arises from the porosity of the polycrystalline material and grain boundary sliding under the indentation contact. Time dependent growth of lateral cracks at the indentation contacts suggests that these materials are susceptible to moisture controlled non-equilibrium crack growth

IMPEDANCE SPECTROSCOPY OF POLYCRYSTALLINE TIN DIOXIDE FILMS

Directory of Open Access Journals (Sweden)

D. V. Adamchuck

2016-01-01

Full Text Available The aim of this work is the analysis of the influence of annealing in an inert atmosphere on the electrical properties and structure of non-stoichiometric tin dioxide films by means of impedance spectroscopy method. Non-stoichiometric tin dioxide films were fabricated by two-step oxidation of metallic tin deposited on the polycrystalline Al2O3 substrates by DC magnetron sputtering. In order to modify the structure and stoichiometric composition, the films were subjected to the high temperature annealing in argon atmosphere in temperature range 300–800 °С. AC-conductivity measurements of the films in the frequency range 20 Hz – 2 MHz were carried out. Variation in the frequency dependencies of the real and imaginary parts of the impedance of tin dioxide films was found to occur as a result of high-temperature annealing. Equivalent circuits for describing the properties of films with various structure and stoichiometric composition were proposed. Possibility of conductivity variation of the polycrystalline tin dioxide films as a result of аnnealing in an inert atmosphere was demonstrated by utilizing impedance spectroscopy. Annealing induces the recrystallization of the films, changing in their stoichiometry as well as increase of the sizes of SnO2 crystallites. Variation of electrical conductivity and structure of tin dioxide films as a result of annealing in inert atmosphere was confirmed by X-ray diffraction analysis. Analysis of the impedance diagrams of tin dioxide films was found to be a powerful tool to study their electrical properties. 

Ceramic synthesis of 0.08BiGaO3-0.90BaTiO3-0.02LiNbO3 under high pressure and high temperature

Science.gov (United States)

Hui, Jin; Yong, Li; Mou-Sheng, Song; Lin, Chen; Xiao-Peng, Jia; Hong-An, Ma

2016-07-01

In this paper, the preparation of 0.08BiGaO3-0.90BaTiO3-0.02LiNbO3 is investigated at pressure 3.8 GPa and temperature 1100-1200 °C. Experimental results indicate that not only is the sintered rate more effective, but also the sintered temperature is lower under high pressure and high temperature than those of under normal pressure. It is thought that the adscititious pressure plays the key role in this process, which is discussed in detail. The composition and the structure of the as-prepared samples are recorded by XRD patterns. The result shows that the phases of BaTiO3, BaBiO2.77, and Ba2Bi4Ti5O18 with piezoelectric ceramic performance generate in the sintered samples. Furthermore, the surface morphology characteristics of the typical samples are also investigated using a scanning electron microscope. It indicates that the grain size and surface structure of the samples are closely related to the sintering temperature and sintering time. It is hoped that this study can provide a new train of thought for the preparation of lead-free piezoelectric ceramics with excellent performance. Project supported by the National Natural Science Foundation of China (Grant No. 51172089), the Natural Science Foundation of Education Department of Guizhou Province, China (Grant Nos. KY [2013]183 and LH [2015]7232), and the Research Fund for the Doctoral Program of Tongren University, China (Grant No. DS1302).

In situ study of electric field controlled ion transport in the Fe/BaTiO3 interface

Science.gov (United States)

Merkel, D. G.; Bessas, D.; Bazsó, G.; Jafari, A.; Rüffer, R.; Chumakov, A. I.; Khanh, N. Q.; Sajti, Sz; Celse, J.-P.; Nagy, D. L.

2018-01-01

Electric field controlled ion transport and interface formation of iron thin films on a BaTiO3 substrate have been investigated by in situ nuclear resonance scattering and x-ray reflectometry techniques. At early stage of deposition, an iron-II oxide interface layer was observed. The hyperfine parameters of the interface layer were found insensitive to the evaporated layer thickness. When an electric field was applied during growth, a 10 Å increase of the nonmagnetic/magnetic thickness threshold and an extended magnetic transition region was measured compared to the case where no field was applied. The interface layer was found stable under this threshold when further evaporation occurred, contrary to the magnetic layer where the magnitude and orientation of the hyperfine magnetic field vary continuously. The obtained results of the growth mechanism and of the electric field effect of the Fe/BTO system will allow the design of novel applications by creating custom oxide/metallic nanopatterns using laterally inhomogeneous electric fields during sample preparation.

Dielectric Performance of High Permitivity Nanocomposites: Impact of Polystyrene Grafting on BaTiO3 and TiO2

Science.gov (United States)

2016-09-22

prepared using high-shear mixing (Ultra-Turrax T18, IKA). All BaTiO3 nanocomposites were solution cast from DMF onto aluminum-coated glass substrates...coated from chlorobenzene onto aluminum-coated glass substrates. Figure 3 a Real dielectric permittivity ε′ measured at 1 kHz for PS@BaTiO3 HNPs... SiO2 nanocomposites, where 15% v/v PS  +  SiO2 blends exhibited degraded energy storage efficiencies when driven above 100 V/μm, while 18% v/v PS@ SiO2

Catalytic aided electrical discharge machining of polycrystalline diamond - parameter analysis of finishing condition

Science.gov (United States)

Haikal Ahmad, M. A.; Zulafif Rahim, M.; Fauzi, M. F. Mohd; Abdullah, Aslam; Omar, Z.; Ding, Songlin; Ismail, A. E.; Rasidi Ibrahim, M.

2018-01-01

Polycrystalline diamond (PCD) is regarded as among the hardest material in the world. Electrical Discharge Machining (EDM) typically used to machine this material because of its non-contact process nature. This investigation was purposely done to compare the EDM performances of PCD when using normal electrode of copper (Cu) and newly proposed graphitization catalyst electrode of copper nickel (CuNi). Two level full factorial design of experiment with 4 center points technique was used to study the influence of main and interaction effects of the machining parameter namely; pulse-on, pulse-off, sparking current, and electrode materials (categorical factor). The paper shows interesting discovery in which the newly proposed electrode presented positive impact to the machining performance. With the same machining parameters of finishing, CuNi delivered more than 100% better in Ra and MRR than ordinary Cu electrode.

Structural and electrical properties of polycrystalline CdSe thin films, before and after irradiation with 6 MeV accelerated electrons

International Nuclear Information System (INIS)

Ion, L.; Antohe, V.A.; Tazlaoanu, C.; Antohe, S.; Scarlat, F.

2004-01-01

Structural and electrical properties of polycrystalline CdSe thin films irradiated with high-energy electrons are analyzed. The samples were prepared by vacuum deposition of CdSe powder onto optical glass substrate. Their structure and the temperature dependence of the electrical resistance were determined, both before and after irradiation with 6 MeV electrons at fluencies up to 10 16 electrons/cm 2 . There were no measurable changes in the crystalline structure of the films after irradiation. Electrical properties are controlled by the defect level of donor type, possibly a selenium vacancy, with two ionizing states having ionization energies of about 0.40 eV and 0.22 eV, respectively. The major effect of the irradiation is to increase significantly the concentration of these defects. (authors)

Effective polycrystalline sensor of ultraviolet radiation

Directory of Open Access Journals (Sweden)

S.Yu. Pavelets

2017-10-01

Full Text Available Deposition of special thin layers with high and low resistance in space charge region of surface barrier photoconverters based on the p-Cu1.8S/n-CdS structure leads to a sufficient increase in photosensitivity and decrease in dark tunneling-recombination current. Highly efficient and stable polycrystalline photoconverters of ultraviolet radiation based on polycrystalline CdS have been obtained. Electrical and photoelectric properties have been investigated, and the main operational parameters of ultraviolet sensors have been adduced. The reasons for high stability of the parameters inherent to the p-Cu1.8S/n-CdS sensors are as follows: the absence of impurity components additionally doped to the barrier structure and stability of the photocurrent photoemission component.

Mn-implanted, polycrystalline indium tin oxide and indium oxide films

International Nuclear Information System (INIS)

Scarlat, Camelia; Vinnichenko, Mykola; Xu Qingyu; Buerger, Danilo; Zhou Shengqiang; Kolitsch, Andreas; Grenzer, Joerg; Helm, Manfred; Schmidt, Heidemarie

2009-01-01

Polycrystalline conducting, ca. 250 nm thick indium tin oxide (ITO) and indium oxide (IO) films grown on SiO 2 /Si substrates using reactive magnetron sputtering, have been implanted with 1 and 5 at.% of Mn, followed by annealing in nitrogen or in vacuum. The effect of the post-growth treatment on the structural, electrical, magnetic, and optical properties has been studied. The roughness of implanted films ranges between 3 and 15 nm and XRD measurements revealed a polycrystalline structure. A positive MR has been observed for Mn-implanted and post-annealed ITO and IO films. It has been interpreted by considering s-d exchange. Spectroscopic ellipsometry has been used to prove the existence of midgap electronic states in the Mn-implanted ITO and IO films reducing the transmittance below 80%.

Influence of applied electric field annealing on the microwave properties of (Ba0.5Sr0.5)TiO3 thin films

Science.gov (United States)

Cho, Kwang-Hwan; Lee, Chil-Hyoung; Kang, Chong-Yun; Yoon, Seok-Jin; Lee, Young-Pak

2007-04-01

The effect of heat treatment in electric field on the structure and dielectric properties at microwave range of rf magnetron sputtering derived (Ba0.5Sr0.5)TiO3 thin films have been studied. It has been demonstrated that postannealing in the proper electric field can increase the dielectric constant and the tunability. The increased out-of-plane lattice constant in the electric-annealed films indicated the formation of small polar regions with tetragonal structure, which are responsible for the increased dielectric constant and tunability. It was proposed that the segregation of Ti3+ ions caused by electric annealing could induce the formation of BaTiO3-like regions, which are ferroelectric at room temperature. And in dielectric loss, as the Ti-O bonding lengths increase, the energy scattering on the ferroelectric mode also increases. So, the value of dielectric loss is slightly increased.

Polycrystalline La1-xSrxMnO3 films on silicon: Influence of post-Deposition annealing on structural, (Magneto-)Optical, and (Magneto-)Electrical properties

Science.gov (United States)

Thoma, Patrick; Monecke, Manuel; Buja, Oana-Maria; Solonenko, Dmytro; Dudric, Roxana; Ciubotariu, Oana-Tereza; Albrecht, Manfred; Deac, Iosif G.; Tetean, Romulus; Zahn, Dietrich R. T.; Salvan, Georgeta

2018-01-01

The integration of La1-xSrxMnO3 (LSMO) thin film technology into established industrial silicon processes is regarded as challenging due to lattice mismatch, thermal expansion, and chemical reactions at the interface of LSMO and silicon. In this work, we investigated the physical properties of thin La0.73Sr0.27MnO3 films deposited by magnetron sputtering on silicon without a lattice matching buffer layer. The influence of a post-deposition annealing treatment on the structural, (magneto-)optical, and (magneto-)electrical properties was investigated by a variety of techniques. Using Rutherford backscattering spectroscopy, atomic force microscopy, Raman spectroscopy, and X-ray diffraction we could show that the thin films exhibit a polycrystalline, rhombohedral structure after a post-deposition annealing of at least 700 °C. The dielectric tensor in the spectral range from 1.7 eV to 5 eV determined from spectroscopic ellipsometry in combination with magneto-optical Kerr effect spectroscopy was found to be comparable to that of lattice matched films on single crystal substrates reported in literature [1]. The values of the metal-isolator transition temperature and temperature-dependent resistivities also reflect a high degree of crystalline quality of the thermally treated films.

Quantifying Local and Cooperative Components in the Ferroelectric Distortion of BaTiO3: Learning from the Off-Center Motion in the MnCl65– Complex Formed in KCl:Mn+

DEFF Research Database (Denmark)

García Lastra, Juan Maria; García-Fernández, P.; Calle-Vallejo, F.

2014-01-01

→ C4v → Oh local transformations occurring in the 10–50 K temperature range for the MnCl65– complex formed in KCl:Mn+ that mimic the behavior of BaTiO3. From Boltzmann analysis of the vibronic levels derived from ab initio calculations and considering decoherence introduced by random strains......, the present calculations reproduce the experimental phase sequence and transition temperatures. Furthermore, our calculations show that the off-center instability in KCl:Mn+ would be suppressed by reducing by only 1% the lattice parameter, a situation that then becomes comparable to that found for BaTiO3...

Effect of charge ordering and phase separation on the electrical and magnetoresistive properties of polycrystalline La0.4Eu0.1Ca0.5MnO3

Science.gov (United States)

Krichene, A.; Boujelben, W.; Mukherjee, S.; Shah, N. A.; Solanki, P. S.

2018-03-01

We have investigated the effect of charge ordering and phase separation on the electrical and magnetotransport properties of La0.4Eu0.1Ca0.5MnO3 polycrystalline sample. Temperature dependence of resistivity shows a metal-insulator transition at transition temperature Tρ. A hysteretic behavior is observed for zero field resistivity curves with Tρ = 128 K on cooling process and Tρ = 136 K on warming process. Zero field resistivity curves follow Zener polynomial law in the metallic phase with unusual n exponent value ∼9. Presence of resistivity minimum at low temperatures has been ascribed to the coulombic electron-electron scattering process. Resistivity modification due to the magnetic field cycling testifies the presence of the training effect. Magnetization and resistivity appear to be highly correlated. Magnetoresistive study reveals colossal values of negative magnetoresistance reaching about 75% at 132 K under only 2T applied field. Colossal values of magnetoresistance suggest the possibility of using this sample for magnetic field sensing and spintronic applications.

Highly constrained ferroelectric [BaTiO3](1−x)Λ/[BaZrO3]xΛ superlattices: X-ray diffraction and Raman spectroscopy

International Nuclear Information System (INIS)

Belhadi, J.; El Marssi, M.; Gagou, Y.; El Mendili, Y.; Bouyanfif, H.; Yuzyuk, Yu. I.; Raevski, I. P.; Wolfman, J.

2014-01-01

We report an x-ray diffraction (XRD) and a Raman-scattering investigation of ferroelectric/paraelectric superlattices [BaTiO 3 ] (1−x)Λ /[BaZrO 3 ] xΛ for which the composition varied, 0.15 ≤ x ≤ 0.85, while the superlattice (SL) modulation period Λ was kept constant at about 100 Å. The samples were epitaxially grown by pulsed laser deposition on MgO substrates buffered with La 0.5 Sr 0.5 CoO 3 . Based on the XRD analysis and on polarized Raman spectra, we have showed that the large strain in SLs induced ferroelectricity in BaZrO 3 (BZ) for all SLs, a material that is paraelectric in the bulk form at any temperature and in the single film. The induced polar axis in BZ layers is perpendicular to the plane of substrate while BaTiO 3 (BT) layers exhibit in-plane polar orientation. Raman spectroscopy revealed a lattice ordering in SLs due to the misfit strain generated by the large lattice mismatch between the alternating BZ and BT layers. This strain induced a huge upward frequency of the lowest E(1TO) soft mode from 60 cm −1 in the BT single film to 215 cm −1 in the SL with x = 0.85. These results show that in spite of relatively large periodicity of SLs, they are highly constrained and the variation of BZ ratio allowed modifying strains between layers. The temperature dependence of the Raman spectra for BT 0.3Λ /BZ 0.7Λ and BT 0.7Λ /BZ 0.3Λ samples revealed giant shift of the ferroelectric phase transition. The phase transition temperature was found to be upshifted by about 300 °C with respect to BT single crystal.

Improved Dielectric Properties and Energy Storage Density of Poly(vinylidene fluoride-co-hexafluoropropylene) Nanocomposite with Hydantoin Epoxy Resin Coated BaTiO3.

Science.gov (United States)

Luo, Hang; Zhang, Dou; Jiang, Chao; Yuan, Xi; Chen, Chao; Zhou, Kechao

2015-04-22

Energy storage materials are urgently demanded in modern electric power supply and renewable energy systems. The introduction of inorganic fillers to polymer matrix represents a promising avenue for the development of high energy density storage materials, which combines the high dielectric constant of inorganic fillers with supernal dielectric strength of polymer matrix. However, agglomeration and phase separation of inorganic fillers in the polymer matrix remain the key barriers to promoting the practical applications of the composites for energy storage. Here, we developed a low-cost and environmentally friendly route to modifying BaTiO3 (BT) nanoparticles by a kind of water-soluble hydantoin epoxy resin. The modified BT nanoparticles exhibited homogeneous dispersion in the ferroelectric polymer poly(vinylidene fluoride-co-hexafluoropropylene) (P(VDF-HFP)) matrix and strong interfacial adhesion with the polymer matrix. The dielectric constants of the nanocomposites increased significantly with the increase of the coated BT loading, while the dielectric loss of the nanocomposites was still as low as that of the pure P(VDF-HFP). The energy storage density of the nanocomposites was largely enhanced with the coated BT loading at the same electric field. The nanocomposite with 20 vol % BT exhibited an estimated maximum energy density of 8.13 J cm(-3), which was much higher than that of pure P(VDF-HFP) and other dielectric polymers. The findings of this research could provide a feasible approach to produce high energy density materials for practical application in energy storage.

Hydrogen-induced structural changes in polycrystalline silicon as revealed by positron lifetime spectroscopy

International Nuclear Information System (INIS)

Arole, V.M.; Takwale, M.G.; Bhide, V.G.

1989-01-01

Hydrogen passivation of polycrystalline silicon wafer is carried out in order to reduce the deleterious effects of grain boundaries. A systematic variation is made in the process parameters implemented during hydrogen passivation and the results of room temperature resistivity measurements are reported. As an efficient tool to study the structure change, positron lifetime spectroscopic measurements are performed on original and hydrogenated polycrystalline silicon wafers and a systematic correlation is sought between the changes that take place in the electrical and structural properties of polycrystalline silicon wafer, brought about by hydrogen passivation. (author)

Single crystal growth of 67%BiFeO3-33%BaTiO3 solution by the floating zone method

Science.gov (United States)

Rong, Y.; Zheng, H.; Krogstad, M. J.; Mitchell, J. F.; Phelan, D.

2018-01-01

The growth conditions and the resultant grain morphologies and phase purities from floating-zone growth of 67%BiFeO3-33%BaTiO3 (BF-33BT) single crystals are reported. We find two formidable challenges for the growth. First, a low-melting point constituent leads to a pre-melt zone in the feed-rod that adversely affects growth stability. Second, constitutional super-cooling (CSC), which was found to lead to dendritic and columnar features in the grain morphology, necessitates slow traveling rates during growth. Both challenges were addressed by modifications to the floating-zone furnace that steepened the temperature gradient at the melt-solid interfaces. Slow growth was also required to counter the effects of CSC. Single crystals with typical dimensions of hundreds of microns have been obtained which possess high quality and are suitable for detailed structural studies.

Single crystal growth of 67%BiFeO 3 -33%BaTiO 3 solution by the floating zone method

Energy Technology Data Exchange (ETDEWEB)

Rong, Y.; Zheng, H.; Krogstad, M. J.; Mitchell, J. F.; Phelan, D.

2018-01-01

The growth conditions and the resultant grain morphologies and phase purities from floating-zone growth of 67%BiFeO3-33%BaTiO3 (BF-33BT) single crystals are reported. We find two formidable challenges for the growth. First, a low-melting point constituent leads to a pre-melt zone in the feed-rod that adversely affects growth stability. Second, constitutional super-cooling (CSC), which was found to lead to dendritic and columnar features in the grain morphology, necessitates slow traveling rates during growth. Both challenges were addressed by modifications to the floating-zone furnace that steepened the temperature gradient at the melt-solid interfaces. Slow growth was also required to counter the effects of CSC. Single crystals with typical dimensions of hundreds of microns have been obtained which possess high quality and are suitable for detailed structural studies.

Anisotropic electrical conduction and reduction in dangling-bond density for polycrystalline Si films prepared by catalytic chemical vapor deposition

Science.gov (United States)

Niikura, Chisato; Masuda, Atsushi; Matsumura, Hideki

1999-07-01

Polycrystalline Si (poly-Si) films with high crystalline fraction and low dangling-bond density were prepared by catalytic chemical vapor deposition (Cat-CVD), often called hot-wire CVD. Directional anisotropy in electrical conduction, probably due to structural anisotropy, was observed for Cat-CVD poly-Si films. A novel method to separately characterize both crystalline and amorphous phases in poly-Si films using anisotropic electrical conduction was proposed. On the basis of results obtained by the proposed method and electron spin resonance measurements, reduction in dangling-bond density for Cat-CVD poly-Si films was achieved using the condition to make the quality of the included amorphous phase high. The properties of Cat-CVD poly-Si films are found to be promising in solar-cell applications.

The adhesion and tribology analysis of polycrystalline diamond coated on Si3N4 substrate

International Nuclear Information System (INIS)

Hamzah, E.; Purniawan, A.

2007-01-01

Cauliflower and octahedral structure of polycrystalline diamond was deposited on silicon nitride (Si 3 N 4 ) substrate by microwave plasma assisted chemical vapor deposition (MPACVD). In our earlier work, the effects of deposition parameters namely, % Methane (CH 4 ) diluted in hydrogen (H 2 ), microwave power and chamber pressure on surface morphology were studied. In the present work the polycrystalline diamond coating adhesion and tribology behaviour were investigated. Rockwell C hardness tester and pin-on-disk tribometer were used to determine the adhesion and tribology properties on diamond coating, respectively. The morphology of the diamond before and after indentation was observed using field emission scanning electron microscopy (FESEM). Based on the adhesion analysis results, it was found that octahedral morphology has better adhesion than cauliflower structure. It was indicated by few cracks and less peel-off than cauliflower structure of polycrystalline diamond after indentation. Based on tribology analysis, polycrystalline diamond coated on substrate has better tribology properties than uncoated substrate. (author)

Relationship between tolerance factor and temperature coefficient of permittivity of temperature-stable high permittivity BaTiO3–Bi(MeO3 compounds

Directory of Open Access Journals (Sweden)

Natthaphon Raengthon

2016-03-01

Full Text Available The temperature coefficient of permittivity (TCε of BaTiO3–Bi(MeO3 solid solutions were investigated. It was determined that as the tolerance factor was decreased with the addition of Bi(MeO3, the TCε shifted from large negative values to TCε values approaching zero. It is proposed that the different bonding nature of the dopant cation affects the magnitude and temperature stability of the permittivity. This study suggests that the relationship between tolerance factor and TCε can be used as a guide to design new dielectric compounds exhibiting temperature-stable high permittivity characteristics, which is similar to past research on perovskite and pyrochlore-based microwave dielectrics.

Structural, electrical, and optical properties of polycrystalline NbO_2 thin films grown on glass substrates by solid phase crystallization

International Nuclear Information System (INIS)

Nakao, Shoichiro; Kamisaka, Hideyuki; Hirose, Yasushi; Hasegawa, Tetsuya

2017-01-01

We investigated the structural, electrical, and optical properties of polycrystalline NbO_2 thin films on glass substrates. The NbO_2 films were crystallized from amorphous precursor films grown by pulsed laser deposition at various oxygen partial pressures (P_O_2). The electrical and optical properties of the precursor films systematically changed with P_O_2, demonstrating that the oxygen content of the precursor films can be finely controlled with P_O_2. The precursors were crystallized into polycrystalline NbO_2 films by annealing under vacuum at 600 C. The NbO_2 films possessed extremely flat surfaces with branching patterns. Even optimized films showed a low resistivity (ρ) of 2 x 10"2 Ω cm, which is much lower than the bulk value of 1 x 10"4 Ω cm, probably because of the inferior crystallinity of the films compared with that of a bulk NbO_2 crystal. Both oxygen-rich and -poor NbO_2 films showed lower ρ than that of the stoichiometric film. The NbO_2 film with the highest ρ showed an indirect bandgap of 0.7 eV. (copyright 2016 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

Ab-initio study of the relation between electric polarization and electric field gradients in ferroelectrics

CERN Document Server

Gonçalves, J N; Correia, J G; Butz, T; Picozzi, S; Fenta, A S; Amaral, V S

2012-01-01

The hyperfine interaction between the quadrupole moment of atomic nuclei and the electric field gradient (EFG) provides information on the electronic charge distribution close to a given atomic site. In ferroelectric materials, the loss of inversion symmetry of the electronic charge distribution is necessary for the appearance of the electric polarization. We present first-principles density functional theory calculations of ferroelectrics such as BaTiO$_{3}$, KNbO$_{3}$, PbTiO$_{3}$ and other oxides with perovskite structures, by focusing on both EFG tensors and polarization. We analyze the EFG tensor properties such as orientation and correlation between components and their relation with electric polarization. This work supports previous studies of ferroelectric materials where a relation between EFG tensors and polarization was observed, which may be exploited to study the ferroelectric order when standard techniques to measure polarization are not easily applied.

Structural, morphological and Raman studies on hybridized PVDF/BaTiO3 nanocomposites

Science.gov (United States)

Rajamanickam, N.; Jayakumar, K.; Ramachandran, K.

2017-05-01

Hybridized nanocomposites of polyvinylidene fluoride (PVDF) and nano - barium titanate (BaTiO3) were prepared using the solution casting method for different concentrations of nano-BaTiO3 and were characterized by X-ray diffraction and scanning electron microscopy. The flower like structure for morphology was observed in SEM. Raman analysis showed that the modified BaTiO3 particles, due to higher specific surfaces, induce, predominantly, the crystallization of the electrically active β-phase of PVDF, while the initial micron size particles induce the formation of the most common but non-polar α-crystal form.

Enhanced dielectric and ferroelectric characteristics in Ca-modified BaTiO3 ceramics

Directory of Open Access Journals (Sweden)

Xiao Na Zhu

2013-08-01

Full Text Available Synergic modification of BaTiO3 ceramics was investigated by Ca-substitution, and the superior dielectric and ferroelectric properties were determined together with the structure evolution. X-ray diffraction (XRD analysis demonstrated a large solubility limit above x = 0.25 in Ba1−xCaxTiO3 solid solution where the fine grain structure was observed with increasing x. Room temperature dielectric constant as high as 1655 was achieved in the present ceramics together with the significantly reduced dielectric loss of 0.013 (x = 0.20 at 100 kHz, where the Curie temperature kept almost a constant while other two transition temperatures decreased continuously with increasing x. More importantly, the remanent polarization Pr and dielectric strength Eb were significantly enhanced by Ca-substitution, and the best Pr (11.34 μC/cm2 and the highest dielectric strength Eb (75 kV/cm were acquired at x = 0.25. The present ceramics should be very desirable for the applications such as high density energy storage devices.

Substitution behavior of x(Na0.5K0.5)NbO3-(1 − x)BaTiO3 ceramics for multilayer ceramic capacitors by a near edge x-ray absorption fine structure analysis

International Nuclear Information System (INIS)

Ha, Jooyeon; Ryu, Jiseung; Lee, Heesoo

2014-01-01

The doping effect of (Na 0.5 K 0.5 )NbO 3 (NKN) as alternatives for rare-earth elements on the electrical properties of BaTiO 3 has been investigated, in terms of their substitution behavior. The dielectric constant of a specimen with x = 0.05 was about 79% higher than that of pure BaTiO 3 , and the temperature coefficient of capacitance was satisfied by the X7R specification. The specimen with x = 0.05 showed the lowest tetragonality among the four compositions and had a fine grain size of 5+ ion for Ti-sites. Therefore, the simultaneous substitution of Na + /K + and Nb 5+ ions into BaTiO 3 can improve dielectric properties, based on the charge-transfer process.

Grain growth kinetics of textured-BaTiO3 ceramics

Indian Academy of Sciences (India)

Administrator

3Department of Physics and Materials Science, City University of Hong Kong, Hong Kong ... Abstract. Textured BaTiO3 (BT) ceramics were fabricated by templated grain growth method. Effects of ... approaches to improve electrical properties of lead-free ceramics. ... modification methods to enhance the piezoelectric pro-.

Raman scattering intensities in BaTiO3 and PbTiO3 prototypical ferroelectrics from density functional theory

International Nuclear Information System (INIS)

Hermet, P; Veithen, M; Ghosez, Ph

2009-01-01

Nonlinear optical susceptibilities and Raman scattering spectra of the ferroelectric phases of BaTiO 3 and PbTiO 3 are computed using a first-principles approach based on density functional theory and taking advantage of a recent implementation based on the nonlinear response formalism and the 2n+1 theorem. These two prototypical ferroelectric compounds were chosen to demonstrate the accuracy of the Raman calculation based both on their complexity and their technological importance. The computation of the Raman scattering intensities has been performed not only for the transverse optical modes, but also for the longitudinal optical ones. The agreement between the measured and computed Raman spectra of these prototypical ferroelectrics is remarkable for both the frequency position and the intensity of Raman lines. This agreement presently demonstrates the state-of-the-art in the computation of Raman responses on one of the most complex systems, ferroelectrics, and constitutes a step forward in the reliable prediction of their electro-optical responses.

Preparation and optical properties of gold-dispersed BaTiO3 thin films

Energy Technology Data Exchange (ETDEWEB)

Kineri, T; Mori, M [TDK Corp., Tokyo (Japan). R and D Center; Kadono, K; Sakaguchi, T; Miya, M; Wakabayashi, H [Osaka National Research Inst., Osaka (Japan); Tsuchiya, T [Science Univ. of Tokyo, Tokyo (Japan). Faculty of Industrial Science and Technology

1993-12-01

Recently, metal or semiconductor-doped glasses were widely studied because of their large resonant third-order nonlinearity. These glasses are utilized in an optical information field as all optical logic devices in the future. The gold-doped glass films or thin layers have a large third-order nonlinear susceptibility [chi] and are prepared by r.f. sputtering method, etc. The optical properties, particularly the refractive index or dielectric constant of the matrix, are very important for the optical nonlinearity of these materials. In this study, gold-dispersed BaTiO3 thin films and gold-dispersed SiO2 thin films are prepared using r.f. magnetron sputtering method, and the optical properties of the films are compared. The [chi] of the films are measured and the effect of the matrix of the films on [chi] is investigated. The headings in the paper are: Introduction, Experimental procedure, Results, Discussion, and Conclusion. 13 refs., 9 figs.

Structural, electrical, and optical properties of polycrystalline NbO{sub 2} thin films grown on glass substrates by solid phase crystallization

Energy Technology Data Exchange (ETDEWEB)

Nakao, Shoichiro [Kanagawa Academy of Science and Technology (KAST), Kawasaki (Japan); Kamisaka, Hideyuki [Department of Chemistry, The University of Tokyo (Japan); Hirose, Yasushi; Hasegawa, Tetsuya [Kanagawa Academy of Science and Technology (KAST), Kawasaki (Japan); Department of Chemistry, The University of Tokyo (Japan)

2017-03-15

We investigated the structural, electrical, and optical properties of polycrystalline NbO{sub 2} thin films on glass substrates. The NbO{sub 2} films were crystallized from amorphous precursor films grown by pulsed laser deposition at various oxygen partial pressures (P{sub O2}). The electrical and optical properties of the precursor films systematically changed with P{sub O2}, demonstrating that the oxygen content of the precursor films can be finely controlled with P{sub O2}. The precursors were crystallized into polycrystalline NbO{sub 2} films by annealing under vacuum at 600 C. The NbO{sub 2} films possessed extremely flat surfaces with branching patterns. Even optimized films showed a low resistivity (ρ) of 2 x 10{sup 2} Ω cm, which is much lower than the bulk value of 1 x 10{sup 4} Ω cm, probably because of the inferior crystallinity of the films compared with that of a bulk NbO{sub 2} crystal. Both oxygen-rich and -poor NbO{sub 2} films showed lower ρ than that of the stoichiometric film. The NbO{sub 2} film with the highest ρ showed an indirect bandgap of 0.7 eV. (copyright 2016 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

Anomalous magnetoresistance in antiferromagnetic polycrystalline materials R2Ni3Si5 (R=rare earth)

International Nuclear Information System (INIS)

Mazumdar, C.; Nigam, A.K.; Nagarajan, R.; Gupta, L.C.; Chandra, G.; Padalia, B.D.; Godart, C.; Vijayaraghaven, R.

1997-01-01

Magnetoresistance (MR) studies on polycrystalline R 2 Ni 3 Si 5 , (R=Y, rare earth) which order antiferromagnetically at low temperatures, are reported here. MR of the Nd, Sm, and Tb members of the series exhibit positive giant magnetoresistance, largest among polycrystalline materials (85%, 75%, and 58% for Tb 2 Ni 3 Si 5 , Sm 2 Ni 3 Si 5 , and Nd 2 Ni 3 Si 5 , respectively, at 4.4 K in a field of 45 kG). These materials have, to the best of our knowledge, the largest positive GMR reported ever for any bulk polycrystalline compounds. The magnitude of MR does not correlate with the rare earth magnetic moments. We believe that the structure of these materials, which can be considered as a naturally occurring multilayer of wavy planes of rare earth atoms separated by Ni endash Si network, plays a role. The isothermal MR of other members of this series (R=Pr,Dy,Ho) exhibits a maximum and a minimum, below their respective T N close-quote s. We interpret these in terms of a metamagnetic transition and short-range ferromagnetic correlations. The short-range ferromagnetic correlations seem to be dominant in the temperature region just above T N . copyright 1997 American Institute of Physics

Improving dielectric properties of BaTiO_3/poly(vinylidene fluoride) composites by employing core-shell structured BaTiO_3@Poly(methylmethacrylate) and BaTiO_3@Poly(trifluoroethyl methacrylate) nanoparticles

International Nuclear Information System (INIS)

Zhang, Xianhong; Zhao, Sidi; Wang, Fang; Ma, Yuhong; Wang, Li; Chen, Dong; Zhao, Changwen; Yang, Wantai

2017-01-01

Highlights: • Core-shell structured BT@PMMA and BT@PTFEMA nanoparticles were synthesized. • The dispersity of BT nanoparticles in PVDF matrix was improved significantly. • Dielectric properties both of BT@PMMA/PVDF and BT@PTFEMA/PVDF composites were improved. • The frequency dependence of dielectric constant attenuation of BT@PTFEMA/PVDF composites was smaller than that of BT@PMMA/PVDF composites. - Abstract: Polymer based dielectric composites were fabricated through incorporation of core-shell structured BaTiO_3 (BT) nanoparticles into PVDF matrix by means of solution blending. Core-shell structured BT nanoparticles with different shell composition and shell thickness were prepared by grafting methacrylate monomer (MMA or TFEMA) onto the surface of BT nanoparticles via surface initiated atom transfer radical polymerization (SI-ATRP). The content of the grafted polymer and the micro-morphology of the core-shell structured BT nanoparticles were investigated by thermo gravimetric analyses (TGA) and transmission electron microscopy (TEM), respectively. The dielectric properties were measured by broadband dielectric spectroscopy. The results showed that high dielectric constant and low dielectric loss are successfully realized in the polymer based composites. Moreover, the type of the grafted polymer and its content had different effect on the dielectric constant. In detail, the attenuation of dielectric constant was 16.6% for BT@PMMA1/PVDF and 10.7% for BT@PMMA2/PVDF composite in the range of 10 Hz to 100 kHz, in which the grafted content of PMMA was 5.5% and 8.0%, respectively. However, the attenuation of dielectric constant was 5.5% for BT@PTFEMA1/PVDF and 4.0% for BT@PTFEMA2/PVDF composite, in which the grafted content of PTFEMA was 1.5% and 2.0%, respectively. These attractive features of BT@PTFEMA/PVDF composites suggested that dielectric ceramic fillers modified with fluorinated polymer can be used to prepare high performance composites, especially

Process Research of Polycrystalline Silicon Material (PROPSM)

Science.gov (United States)

Culik, J. S.

1984-01-01

An investigation was begun into the usefulness of molecular hydrogen annealing on polycrystalline solar cells. No improvement was realized even after twenty hours of hydrogenation. Thus, samples were chosen on the basis of: (1) low open circuit voltage; (2) low shunt conductance; and (3) high light generated current. These cells were hydrogenated in molecular hydrogen at 300 C. The differences between the before and after hydrogenation values are so slight as to be negligible. These cells have light generated current densities that indicate long minority carrier diffusion lengths. The open circuit voltage appears to be degraded, and quasi-neutral recombination current enhanced. Therefore, molecular hydrogen is not usful for passivating electrically active defects.

3D ductile crack propagation within a polycrystalline microstructure using XFEM

Science.gov (United States)

Beese, Steffen; Loehnert, Stefan; Wriggers, Peter

2018-02-01

In this contribution we present a gradient enhanced damage based method to simulate discrete crack propagation in 3D polycrystalline microstructures. Discrete cracks are represented using the eXtended finite element method. The crack propagation criterion and the crack propagation direction for each point along the crack front line is based on the gradient enhanced damage variable. This approach requires the solution of a coupled problem for the balance of momentum and the additional global equation for the gradient enhanced damage field. To capture the discontinuity of the displacements as well as the gradient enhanced damage along the discrete crack, both fields are enriched using the XFEM in combination with level sets. Knowing the crack front velocity, level set methods are used to compute the updated crack geometry after each crack propagation step. The applied material model is a crystal plasticity model often used for polycrystalline microstructures of metals in combination with the gradient enhanced damage model. Due to the inelastic material behaviour after each discrete crack propagation step a projection of the internal variables from the old to the new crack configuration is required. Since for arbitrary crack geometries ill-conditioning of the equation system may occur due to (near) linear dependencies between standard and enriched degrees of freedom, an XFEM stabilisation technique based on a singular value decomposition of the element stiffness matrix is proposed. The performance of the presented methodology to capture crack propagation in polycrystalline microstructures is demonstrated with a number of numerical examples.

Preparation and physical properties of polycrystalline (Bi1-xPbx)2Sr2Ca2Cu3Oy high Tc superconductors

International Nuclear Information System (INIS)

Awan, M.S.; Maqsood, M.; Mirza, S.A.; Yousaf, M.; Maqsood, A.

1995-01-01

(Bi 1-x Pb x ) 2 Sr 2 Ca 2 Cu 3 O y (x = 0.3) high critical transition temperature (T c ) superconductors are synthesized by the solid-state reaction method in polycrystalline form. X-ray diffraction (XRD) studies, direct current (dc) electrical resistivity measurements, scanning electron microscopic (SEM) studies, critical current density measurements and zero-field alternating current (ac) susceptibility measurements are performed to investigate the physical changes, structural changes, and magnetic behavior of the superconducting samples. X-ray diffraction studies show that a high T c phase exists with orthorhombic symmetry in the specimen. According to the XRD data, the lattice parameters of the high T c phase were determined as a = 0.537(1) nm, b = 0.539(1) nm, and c = 3.70(1) nm. The compound exhibits a superconducting transition at 106 ± 1 K for zero resistance. The ac susceptibility measurements in zero field confirm the dc electrical resistivity results; hence both support the XRD results. The particle size and structural changes as a function of the cold-pressing and aging effect are also reported

Development of surface relief on polycrystalline metals due to sputtering

Energy Technology Data Exchange (ETDEWEB)

Voitsenya, V.S. [IPP NSC KIPT, 61108 Kharkov (Ukraine); Balden, M. [Max-Planck-Institut für Plasmaphysik, EURATOM Association, Garching (Germany); Bardamid, A.F. [Taras Shevchenko National University, 01033 Kiev (Ukraine); Bondarenko, V.N. [IPP NSC KIPT, 61108 Kharkov (Ukraine); Davis, J.W., E-mail: jwdavis@starfire.utias.utoronto.ca [University of Toronto Institute for Aerospace Studies, 4925 Dufferin St., Toronto, ON, Canada M3H5T6 (Canada); Konovalov, V.G.; Ryzhkov, I.V.; Skoryk, O.O.; Solodovchenko, S.I. [IPP NSC KIPT, 61108 Kharkov (Ukraine); Zhang-jian, Zhou [University of Science and Technology Beijing, Beijing 100 083 (China)

2013-05-01

The characteristics of surface microrelief that appear in sputtering experiments with polycrystalline metals of various grain sizes have been studied. Specimens with grain sizes varying from 30–70 nm in the case of crystallized amorphous alloys, to 1–3 μm for technical tungsten grade and 10–100 μm for recrystallized tungsten were investigated. A model is proposed for the development of roughness on polycrystalline metals which is based on the dependence of sputtering rate on crystal orientation. The results of the modeling are in good agreement with experiments showing that the length scale of roughness is much larger than the grain size.

Raman spectra, photoluminescence, magnetism and magnetoelectric coupling in pure and Fe doped BaTiO3 nanostructures

International Nuclear Information System (INIS)

Verma, Kuldeep Chand; Gupta, Vinay; Kaur, Jaspreet; Kotnala, R.K.

2013-01-01

Highlights: •Multiferroic nanostructures by surfactant free hydrothermal method. •Stoichiometric effect on nanostructures. •Raman spectroscopy and Photoluminescence. •Transmission electron microscopy. •Magnetoelectric coupling. -- Abstract: Structural, microstructural, Raman spectroscopy, photoluminescence, saturation magnetization and magnetoelectric (ME) measurement of BaTiO 3 (BFT0) and BaFe 0.01 Ti 0.99 O 3 (BFT1) nanostructures have been studied. BFT0 and BFT1 were prepared by a hydrothermal method of processing temperature 180 °C/48 h. The X-ray diffraction pattern shows the coexistence of cubic/tetragonal and hexagonal phases for BFT0 and cubic/tetragonal for BFT1. The Raman spectra confirm the coexistence of tetragonal and hexagonal phases in BFT0 and cubic in BFT1. Transmission electron microscopy images show nanorods of hexagonal shaped faces for BFT0 and cubic shaped nanowires for BFT1. The resulting mechanism of the formation of these nanostructures is discussed. The experimental and theoretical results by photoluminescence are related to the degree of disorder existing in both BFT0 and BFT1 and suggest the presence of localized states existing inside of the band gap which are directly affected for degree of order–disorder. A strong ferromagnetism in BFT1 and diamagnetism in BFT0 is observed by magnetic hysteresis. As BFT1 is ferromagnetic, the value of linear coefficient, α called Magnetoelectric (ME) coefficient is calculated as ∼16 mV/Oe cm at a fixed frequency of 850 Hz. This ME coefficient α corresponds to induction of polarization by a magnetic field or of magnetization by an electric field. The observed optimum dc bias field at which the maximum ME coupling occurs is ∼750 Oe

Electrical characterization of chemically modified YBa2Cu3O7-x surfaces

International Nuclear Information System (INIS)

Hunt, B.D.; Foote, M.C.; Vasquez, R.P.

1990-01-01

Results on electrical characterization of YBa 2 Cu 3 O 7-x thin-film surfaces treated with a Br/ethanol chemical etch are presented. Electrical measurements of YBa 2 Cu 3 O 7-x /Au/Nb device structures fabricated using polycrystalline, post-annealed YBa 2 Cu 3 O 7-x films with Br-etched surfaces, show improvements of approximately one or two orders of magnitude in current densities and resistivities (resistance-area products) relative to unetched devices. The existence of supercurrents in these structures has been confirmed by observation of the ac Josephson effect, and by magnetic field and temperature studies of the critical currents. The Br-etch process has produced 10x10 μm 2 devices with critical current densities greater than 400 A/cm 2 and resistivities as low as 4x10 -7 Ω cm 2

Interface Control of Ferroelectricity in an SrRuO3 /BaTiO3 /SrRuO3 Capacitor and its Critical Thickness.

Science.gov (United States)

Shin, Yeong Jae; Kim, Yoonkoo; Kang, Sung-Jin; Nahm, Ho-Hyun; Murugavel, Pattukkannu; Kim, Jeong Rae; Cho, Myung Rae; Wang, Lingfei; Yang, Sang Mo; Yoon, Jong-Gul; Chung, Jin-Seok; Kim, Miyoung; Zhou, Hua; Chang, Seo Hyoung; Noh, Tae Won

2017-05-01

The atomic-scale synthesis of artificial oxide heterostructures offers new opportunities to create novel states that do not occur in nature. The main challenge related to synthesizing these structures is obtaining atomically sharp interfaces with designed termination sequences. In this study, it is demonstrated that the oxygen pressure (PO2) during growth plays an important role in controlling the interfacial terminations of SrRuO 3 /BaTiO 3 /SrRuO 3 (SRO/BTO/SRO) ferroelectric (FE) capacitors. The SRO/BTO/SRO heterostructures are grown by a pulsed laser deposition method. The top SRO/BTO interface, grown at high PO2 (around 150 mTorr), usually exhibits a mixture of RuO 2 -BaO and SrO-TiO 2 terminations. By reducing PO2, the authors obtain atomically sharp SRO/BTO top interfaces with uniform SrO-TiO 2 termination. Using capacitor devices with symmetric and uniform interfacial termination, it is demonstrated for the first time that the FE critical thickness can reach the theoretical limit of 3.5 unit cells. © 2017 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

Optical and electrical properties of polycrystalline and amorphous Al-Ti thin films

DEFF Research Database (Denmark)

Canulescu, Stela; Borca, C. N.; Rechendorff, Kristian

2016-01-01

The structural, optical, and transport properties of sputter-deposited Al-Ti thin films have been investigated as a function of Ti alloying with a concentration ranging from 2% to 46%. The optical reflectivity of Al-Ti films at visible and near-infrared wavelengths decreases with increasing Ti...... content. Xray absorption fine structure measurements reveal that the atomic ordering around Ti atoms increases with increasing Ti content up to 20% and then decreases as a result of a transition from a polycrystalline to amorphous structure. The transport properties of the Al-Ti films are influenced...... by electron scattering at the grain boundaries in the case of polycrystalline films and static defects, such as antisite effects and vacancies in the case of the amorphous alloys. The combination of Ti having a real refractive index (n) comparable with the extinction coefficient (k) and Al with n much smaller...

Substitution behavior of x(Na0.5K0.5)NbO3-(1 - x)BaTiO3 ceramics for multilayer ceramic capacitors by a near edge x-ray absorption fine structure analysis

Science.gov (United States)

Ha, Jooyeon; Ryu, Jiseung; Lee, Heesoo

2014-06-01

The doping effect of (Na0.5K0.5)NbO3 (NKN) as alternatives for rare-earth elements on the electrical properties of BaTiO3 has been investigated, in terms of their substitution behavior. The dielectric constant of a specimen with x = 0.05 was about 79% higher than that of pure BaTiO3, and the temperature coefficient of capacitance was satisfied by the X7R specification. The specimen with x = 0.05 showed the lowest tetragonality among the four compositions and had a fine grain size of x-ray absorption fine structure spectroscopy, the practical substitution behavior was defined by the change in Ti 3d orbital states. The energy separation of the Ti 3d orbitals was more apparent with the specimen of x = 0.05, which is related to the donor level from the donor substitution of Nb5+ ion for Ti-sites. Therefore, the simultaneous substitution of Na+/K+ and Nb5+ ions into BaTiO3 can improve dielectric properties, based on the charge-transfer process.

Low-field tunnel-type magnetoresistance properties of polycrystalline and epitaxial La sub 0 sub . sub 6 sub 7 Sr sub 0 sub . sub 3 sub 3 MnO sub 3 thin films

CERN Document Server

Shim, I B; Choi, S Y

2000-01-01

The low-field tunnel-type magnetoresistance (TMB) properties of sol-gel derived polycrystalline and epitaxial La sub 0 sub . sub 6 sub 7 Sr sub 0 sub . sub 3 sub 3 MnO sub 3 (LSMO) thin films were investigated. The polycrystalline thin films were fabricated on Si (100) with a thermally oxidized SiO sub 2 layer while the epitaxial thin films were grown on LaAlO sub 3 (001) single-crystal substrates. The epitaxial thin films displayed both typical intrinsic colossal magnetoresistance (CMR) and abnormal extrinsic tunnel-type magnetoresistance behaviors. Tunnel-type MR ratio as high as 0.4% were observed in the polycrystalline thin films at a field of 120 Oe at room temperature (300 K) whereas the ratios were less than 0.1% for the epitaxial films in the same field range. The low-field tunnel-type MR of polycrystalline LSMO/SiO sub 2 ?Si (100) thin films originated from the behaviors of the grain-boundary properties.

Effect of calcination routes on phase formation of BaTiO3 and their electronic and magnetic properties

Science.gov (United States)

Majumder, Supriyo; Choudhary, R. J.; Tripathi, M.; Phase, D. M.

2018-05-01

We have investigated the phase formation and correlation between electronic and magnetic properties of oxygen deficient BaTiO3 ceramics, synthesized by solid state reaction method, following different calcination paths. The phase analysis divulge that a higher calcination temperature above 1000° C is favored for tetragonal phase formation than the cubic phase. The core level X-ray photo electron spectroscopy measurements confirm the presence of oxygen vacancies and oxygen vacancy mediated Ti3+ states. As the calcination temperature and calcination time increases these oxygen vacancies and hence Ti3+ concentrations reduce in the sample. The temperature dependent magnetization curves suggest unexpected magnetic ordering, which may be due to the presence of unpaired electron at the t2g state (d1) of nearest-neighbor Ti atoms. In magnetization vs magnetic field isotherms, the regular decrease of saturation moment value with increasing calcination temperature and calcination time, can be discussed considering the amount of oxygen deficiency induced Ti3+ concentrations, present in the sample.

Mechanical properties of amorphous and polycrystalline multilayer systems

International Nuclear Information System (INIS)

Barzen, I.; Edinger, M.; Scherer, J.; Ulrich, S.; Jung, K.; Ehrhardt, H.

1993-01-01

Amorphous and polycrystalline multilayer structures containing materials with metallic (Cr, Cr 3 C 2 ), ionic (Al 2 O 3 ) and covalent (SiC) bonding have been prepared by magnetron sputtering and ion plating in a dual-source apparatus. Up to 1000 layers have been deposited with a constant total thickness of 2.3 μm. Below a single-layer thickness of 10-30 nm the mechanical properties stress and hardness show strong variations. On one hand it is possible that below a certain thickness the mechanical properties of a single layer change. On the other hand electrical resistance and electron spin density measurements indicate that electronic effects may be involved. An attempt is made to explain the observed correlations by transport mechanisms of the electrons, by saturation of dangling bonds with delocalized electrons and by changes in the electronic band structure. (orig.)

Metastable Electrical Characteristics of Polycrystalline Thin-Film Photovoltaic Modules upon Exposure and Stabilization: Preprint

Energy Technology Data Exchange (ETDEWEB)

Deline, C. A.; del Cueto, J. A.; Albin, D. S.; Rummel, S. R.

2011-09-01

The significant features of a series of stabilization experiments conducted at the National Renewable Energy Laboratory (NREL) between May 2009 and the present are reported. These experiments evaluated a procedure to stabilize the measured performance of thin-film polycrystalline cadmium telluride (CdTe) and copper indium gallium diselenide (CIGS) thin-film photovoltaic (PV) modules. The current-voltage (I-V) characteristics of CdTe and CIGS thin-film PV devices and modules exhibit transitory changes in electrical performance after thermal exposure in the dark and/or bias and light exposures. We present the results of our case studies of module performance versus exposure: light-soaked at 65 degrees C; exposed in the dark under forward bias at 65 degrees C; and, finally, longer-term outdoor exposure. We find that stabilization can be achieved to varying degrees using either light-soaking or dark bias methods and that the existing IEC 61646 light-soaking interval may be appropriate for CdTe and CIGS modules with one caveat: it is likely that at least three exposure intervals are required for stabilization.

Mnx/2Nbx/2O3 ceramics

Indian Academy of Sciences (India)

Unknown

Abstract. The paper reports investigations of relative permittivity, εr, electrical conductivity, σ, saturation polarization, Ps, infrared absorption and structural properties of compensating valency substituted BaTiO3. The compositions investigated are BaTi(1–x)Mnx/2Nbx/2O3 for x = 0⋅00; 0⋅025; 0⋅05; 0⋅1; 0⋅2; 0⋅4.

Polycrystalline Mg2Si thin films: A theoretical investigation of their electronic transport properties

International Nuclear Information System (INIS)

Balout, H.; Boulet, P.; Record, M.-C.

2015-01-01

The electronic structures and thermoelectric properties of a polycrystalline Mg 2 Si thin film have been investigated by first-principle density-functional theory (DFT) and Boltzmann transport theory calculations within the constant-relaxation time approximation. The polycrystalline thin film has been simulated by assembling three types of slabs each having the orientation (001), (110) or (111) with a thickness of about 18 Å. The effect of applying the relaxation procedure to the thin film induces disorder in the structure that has been ascertained by calculating radial distribution functions. For the calculations of the thermoelectric properties, the energy gap has been fixed at the experimental value of 0.74 eV. The thermoelectric properties, namely the Seebeck coefficient, the electrical conductivity and the power factor, have been determined at three temperatures of 350 K, 600 K and 900 K with respect to both the energy levels and the p-type and n-type doping levels. The best Seebeck coefficient is obtained at 350 K: the S yy component of the tensor amounts to about ±1000 μV K −1 , depending on the type of charge carriers. However, the electrical conductivity is much too small which results in low values of the figure of merit ZT. Structure–property relationship correlations based on directional radial distribution functions allow us to tentatively draw some explanations regarding the anisotropy of the electrical conductivity. Finally, the low ZT values obtained for the polycrystalline Mg 2 Si thin film are paralleled with those recently reported in the literature for bulk chalcogenide glasses. - Graphical abstract: Structure of the polycrystalline thin film of Mg 2 Si. - Author-Highlights: • Polycrystalline Mg 2 Si film has been modelled by DFT approach. • Thermoelectric properties have been evaluated by semi-classical Boltzmann theory. • The structure was found to be slightly disordered after relaxation. • The highest value of Seebeck

Synthesis of 1D, 2D, and 3D ZnO Polycrystalline Nanostructures Using the Sol-Gel Method

Directory of Open Access Journals (Sweden)

Yung-Kuan Tseng

2012-01-01

Full Text Available This study employed various polyol solvents to synthesize zinc oxide polycrystalline nanostructures in the form of fibers (1D, rhombic flakes (2D, and spheres (3D. The synthetic process primarily involved the use of zinc acetate dihydrate in polyol solutions, which were used to derive precursors of zinc alkoxides. Following hydrolysis at 160°C, the zinc alkoxide particles self-assembled into polycrystalline nanostructures with different morphologies. Following calcination at 500°C for 1 h, polycrystalline ZnO with good crystallinity was obtained. FE-SEM explored variations in surface morphology; XRD was used to analyze the crystalline structures and crystallinity of the products, which were confirmed as ZnO wurtzite structures. FE-TEM verified that the ZnO nanostructures were polycrystalline. Furthermore, we employed TGA/DSC to observe the phase transition. According to the results of property analyses, we proposed models of the relevant formation mechanisms. Finally, various ZnO structures were applied in the degradation of methylene blue to compare their photocatalytic efficiency.

Nanocomposite multilayer capacitors comprising BaTiO3@TiO2 and poly(vinylidene fluoride-hexafluoropropylene for dielectric-based energy storage

Directory of Open Access Journals (Sweden)

Mojtaba Rahimabady

2014-04-01

Full Text Available Multilayer dielectric capacitors were fabricated from nanocomposite precursor comprised of BaTiO3@TiO2 core–shell nanosized particles and poly(vinylidene fluoride–hexafluoropropylene (P(VDF–HFP polymer matrix (20 vol%. The multilayer capacitors showed very high discharge speed and high discharged energy density of around 2.5 J/cm3 at its breakdown field (~ 166 MV/m. The energy density of the nanocomposite multilayer capacitors was substantially higher than the energy density of commercially used power capacitors. Low cost, flexible structure, high discharge rate and energy density suggest that the nanocomposite multilayer capacitors are promising for energy storage applications in many power devices and systems.

Synthesis and Piezoelectric Properties of Li, Ca and Mn-codoped BaTiO3 by a Solvothermal Approach

International Nuclear Information System (INIS)

Kimura, T; Dong, Q; Yin, S; Sato, T; Hashimoto, T; Sasaki, A; Aisawa, S

2013-01-01

3 at.% Li-doped (Ba 1-x Ca x )(Ti 1-y Mn y )O 3 particles with the Ca 2+ mole fraction, x, of 0–0.09 and Mn mole fraction, y, of 0 and 0.0005 were synthesized by a solvothermal approach at 200°C. The products consisted of nanoparticles of 50–100 nm in diameter, and did not change very much depending on the amount of Li, Ca and Mn-codoping. The change in relative dielectric constant, Δε r , in around room temperature decreased by doping Ca 2+ , and the lowest Δε r (4.51%) could be realized at x value of 0.03. The mechanical quality factor, Q m , of 3 at.% Li-doped (Ba 0.97 Ca 0.03 )(Ti 0.9995 Mn 0.0005 )O 3 increased to 521, and Δε r decreased to 1.72%, while the piezoelectric constant, d 33 (234pC/N), and electromechanical coupling factor, k p (40.0%), did not change very much compared with 3 at.% Li-doped BaTiO 3

Nd:YAG laser irradiation effects on electrical properties of polycrystalline Li{sub 0.5}Fe{sub 2.5}O{sub 4}

Energy Technology Data Exchange (ETDEWEB)

Mane, Maheshkumar L., E-mail: mane.maheshkumar@hotmail.com [Department of physics, Dr. Babasaheb Ambedkar Marathwada University, Aurangabad (M.S.) 431 004 (India); Dhage, V.N.; Shirsath, Sagar E. [Department of physics, Dr. Babasaheb Ambedkar Marathwada University, Aurangabad (M.S.) 431 004 (India); Sundar, R.; Ranganathan, K.; Oak, S.M. [Solid State Laser Division, Raja Ramanna Centre for Advanced Technology, Indore (M.P.) (India); Jadhav, K.M. [Department of physics, Dr. Babasaheb Ambedkar Marathwada University, Aurangabad (M.S.) 431 004 (India)

2012-01-15

Highlights: > Standard double sintering ceramic method. > Infrared and electrical properties of spinel ferrite. > Laser irradiation study. > Conduction mechanism. > Temperature dependence dielectric properties. - Abstract: The polycrystalline spinel structured Li{sub 0.5}Fe{sub 2.5}O{sub 4} ferrite have been prepared by conventional double sintering ceramic method. The samples were palletized and irradiated by Nd:YAG laser with different laser fluencies and characterized by infrared spectroscopy and DC electrical resistivity in order to obtain phase, crystal structure and conduction mechanism in pristine and irradiated samples. The infrared spectroscopy is employed to study the local symmetry and conduction mechanism in crystalline solids before and after irradiation. The DC electrical resistivity measured by two-probe technique from room temperature to beyond Curie temperature with steps of 10 K increases after laser irradiation. Variation of dielectric properties like dielectric constant and dielectric loss tangent is also measured as a function of temperature. A significant reduction in the values of dielectric constant and dielectric loss tangent has been observed with the increase of laser dose.

Activation of boron and phosphorus atoms implanted in polycrystalline silicon films at low temperatures

International Nuclear Information System (INIS)

Andoh, Nobuyuki; Sameshima, Toshiyuki; Andoh, Yasunori

2005-01-01

Phosphorus atoms implanted in laser crystallized polycrystalline silicon films were activated by a heat treatment in air at 260 deg. C for 1, 3 and 24 h. Analysis of ultraviolet reflectivity of phosphorus-doped silicon films implanted by ion doping method at 4 keV revealed that the thickness of the top disordered layer formed by ion bombardment was 6 nm. It is reduced to 4 nm by a 3 h heat treatment at 260 deg. C by recrystallization of disordered region. The electrical conductance of silicon films implanted increased to 1.7x10 5 S/sq after 3 h heat treatment

Structural characterization and dielectric properties of BaTiO3 thin films obtained by spin coating

Directory of Open Access Journals (Sweden)

Branimir Bajac

2014-12-01

Full Text Available Barium titanate thin films were prepared by spin coating deposition technique of an acetic precursor sol and sintered at 750, 900 and 1050 °C. Phase composition of the obtained thin films was characterized by X-ray diffraction and Raman spectroscopy. Their morphology was analysed by scanning electron microscopy and atomic force microscopy. Dielectric properties of thin films sintered at 750 and 900 °C were characterized by LCD device, where the influence of sintering temperature on dielectric permittivity and loss tangent was inspected. It was concluded that higher sintering temperature increases grain size and amount of tetragonal phase, hence higher relative permittivity was recorded. The almost constant relative permittivity in the measured frequency (800 Hz–0.5 MHz and temperature (25–200 °C ranges as well as low dielectric loss are very important for the application of BaTiO3 films in microelectronic devices.

Dielectric properties of a BaTiO3 ceramic prepared by using the freeze drying method

International Nuclear Information System (INIS)

Al-Shakarchi, Emad K.

2010-01-01

A modified catecholate process has been developed to synthesize high-purity barium titanate by using a freeze drying method to produce ultra-fine powders from a barium titanium catechol complex, Ba[Ti(C 6 H 4 O 2 ) 3 ]. The complex prepared from TiCl 4 , C 6 H 4 (OH) 2 and BaCO 3 . The freeze drying of the complex Ba[Ti(C 6 H 4 O 2 ) 3 ] under a primary vacuum at a freezing temperature of -50 .deg. C for a long time 24 hrs is necessary to transfer the complex Ba[Ti(C 6 H 4 O 2 ) 3 ] from a liquid phase to a solid phase. A subsequent calcination of the complex for 12 hrs at a temperature of 700 .deg. C was very important to remove the acetates from the mixture. Finally, a sintering process was required for the pellets so that high density samples could be investigated. The dielectric properties, the structural phase, and the particle size of the sintered pellets have investigated as functions of frequency and temperature in order to determine the critical temperature for the phase transition. X-ray diffraction was used to investigate the structural properties and the particle size. The tetragonal phase of BaTiO 3 with the lattice constants a = b = 3.9734 A, and c = 4.012 A was successfully obtained.

Aluminum-doped Zn O polycrystalline films prepared by co-sputtering of a Zn O-Al target

Energy Technology Data Exchange (ETDEWEB)

Becerril, M.; Silva L, H.; Guillen C, A.; Zelaya A, O. [Instituto Politecnico Nacional, Centro de Investigacion y de Estudios Avanzados, Departamento de Fisica, Apdo. Postal 14-740, 07000 Mexico D. F. (Mexico)

2014-07-01

Aluminum-doped Zinc oxide polycrystalline thin films (Azo) were grown on 7059 Corning glass substrates at room temperature by co-sputtering from a Zn O-Al target. The target was designed as follows, high purity elemental Aluminum was evaporated onto a Zn O target covering small areas. The structural, optical and electrical properties were analyzed as a function of Al content. The Al doped Zn O polycrystalline films showed an n-type conductivity. It was found that the electrical resistivity drops and the carrier concentration increases as a consequence of Al incorporation within the Zn O lattice. In both cases, the changes are of several orders of magnitude. From the results, we conclude that, using these Zn O-Al targets, n-type Al doped Zn O polycrystalline films with high transmittance and low resistivity can be obtained. The crystalline structure of the films was determined by X-ray diffraction. Atomic Force Microscopy images were obtained with an Auto probe C P (Veeco Metrology Group) Microscope. (Author)

Surface polarization, rumpling, and domain ordering of strained ultrathin BaTiO_3(001) films with in-plane and out-of-plane polarization

International Nuclear Information System (INIS)

Dionot, Jelle; Mathieu, Claire; Barrett, Nick; Geneste, Gregory

2014-01-01

BaTiO_3 ultrathin films (thickness ≅1.6 nm) with in- and out-of-plane polarization are studied by first-principles calculations. Out-of-plane polarization is simulated using the method proposed by Shimada et al. [Phys. Rev. B 81, 144116 (2010)], which consists in building a supercell containing small domains with alternating up and down polarization. This allows one to investigate the properties of defect free BaTiO_3 ultrathin films with polarization perpendicular to the surface, as a function of in-plane lattice constant, i.e., epitaxial strain. The configurations with polarization perpendicular to the surface (c phase) are found stable under compressive strain, while under tensile strain, the polarization tends to lie in-plane (aa phase), along [110]. In the c phase, the most stable domain width is predicted to be 1 to 2 lattice constants, and the magnitude of the surface rumpling varies according to the direction of the polarization (upwards versus downwards), though its sign is unchanged, the oxygen anions pointing in all cases outwards. Finally, all the surfaces studied are found to be insulating. Analysis of the atom-projected electronic density of states gives insight into the surface contributions to the electronic structure. An important reduction of the Kohn-Sham band gap is predicted at TiO_2 terminations in the c phase (≅1 eV with respect to the aa phase). The Madelung potential at the surface plays the dominant role in modifications of the surface electronic structure. (authors)

Diffraction Contrast Tomography: A Novel 3D Polycrystalline Grain Imaging Technique

Energy Technology Data Exchange (ETDEWEB)

Kuettner, Lindsey Ann [Los Alamos National Lab. (LANL), Los Alamos, NM (United States)

2017-06-06

Diffraction contrast tomography (DCT) is a non-destructive way of imaging microstructures of polycrystalline materials such as metals or crystalline organics. It is a useful technique to map 3D grain structures as well as providing crystallographic information such as crystal orientation, grain shape, and strain. Understanding the internal microstructure of a material is important in understanding the bulk material properties. This report gives a general overview of the similar techniques, DCT data acquisition, and analysis processes. Following the short literature review, potential work and research at Los Alamos National Laboratory (LANL) is discussed.

Vapor transport deposition of large-area polycrystalline CdTe for radiation image sensor application

Energy Technology Data Exchange (ETDEWEB)

Yang, Keedong; Cha, Bokyung; Heo, Duchang; Jeon, Sungchae [Korea Electrotechnology Research Institute, 111 Hanggaul-ro, Ansan-si, Gyeonggi-do 426-170 (Korea, Republic of)

2014-07-15

Vapor transport deposition (VTD) process delivers saturated vapor to substrate, resulting in high-throughput and scalable process. In addition, VTD can maintain lower substrate temperature than close-spaced sublimation (CSS). The motivation of this work is to adopt several advantages of VTD for radiation image sensor application. Polycrystalline CdTe films were obtained on 300 mm x 300 mm indium tin oxide (ITO) coated glass. The polycrystalline CdTe film has columnar structure with average grain size of 3 μm ∝ 9 μm, which can be controlled by changing the substrate temperature. In order to analyze electrical and X-ray characteristics, ITO-CdTe-Al sandwich structured device was fabricated. Effective resistivity of the polycrystalline CdTe film was ∝1.4 x 10{sup 9}Ωcm. The device was operated under hole-collection mode. The responsivity and the μτ product estimated to be 6.8 μC/cm{sup 2}R and 5.5 x 10{sup -7} cm{sup 2}/V. The VTD can be a process of choice for monolithic integration of CdTe thick film for radiation image sensor and CMOS/TFT circuitry. (copyright 2014 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)

Electronic structures and abnormal phonon behaviors of cobalt-modified Na0.5Bi0.5TiO3-6%BaTiO3 single crystals

Science.gov (United States)

Huang, T.; Zhang, P.; Xu, L. P.; Chen, C.; Zhang, J. Z.; Hu, Z. G.; Luo, H. S.; Chu, J. H.

2016-10-01

Optical properties, electronic structures, and structural variations of x wt% cobalt (Co) doped Na0.5Bi0.5TiO3-6%BaTiO3 (x=0%, 0.5%, 0.8%) single crystals have been studied by temperature-dependent optical ellipsometry and Raman spectra from 250 to 650 K. Based on the temperature evolution of electronic transitions (Ecp1 and Ecp2) and the phonon modes involving Ti-O vibrations, two critical temperature points exhibit an increasing trend with Co dopants, which are related to structural variations for ferroelectric to anti-ferroelectric, and anti-ferroelectric to paraelectric transition, respectively. Additionally, distinguishing abnormal phonon behaviors can be observed from Raman spectra for the crystal of x=0.5% and 0.8%, which show reverse frequency shift of the modes involving Ti-O vibration. It can be ascribed to different relative concentration of Co2+ and Co3+ in the crystals, which has been confirmed by X-ray Photoelectron Spectroscopy data.

Electronic structures and abnormal phonon behaviors of cobalt-modified Na0.5Bi0.5TiO3-6%BaTiO3 single crystals

Directory of Open Access Journals (Sweden)

T. Huang

2016-10-01

Full Text Available Optical properties, electronic structures, and structural variations of x wt% cobalt (Co doped Na0.5Bi0.5TiO3-6%BaTiO3 (x=0%, 0.5%, 0.8% single crystals have been studied by temperature-dependent optical ellipsometry and Raman spectra from 250 to 650 K. Based on the temperature evolution of electronic transitions (Ecp1 and Ecp2 and the phonon modes involving Ti-O vibrations, two critical temperature points exhibit an increasing trend with Co dopants, which are related to structural variations for ferroelectric to anti-ferroelectric, and anti-ferroelectric to paraelectric transition, respectively. Additionally, distinguishing abnormal phonon behaviors can be observed from Raman spectra for the crystal of x=0.5% and 0.8%, which show reverse frequency shift of the modes involving Ti-O vibration. It can be ascribed to different relative concentration of Co2+ and Co3+ in the crystals, which has been confirmed by X-ray Photoelectron Spectroscopy data.

Physically-based modelling of polycrystalline semiconductor devices

International Nuclear Information System (INIS)

Lee, S.

2000-01-01

Thin-film technology using polycrystalline semiconductors has been widely applied to active-matrix-addressed liquid crystal displays (AMLCDs) where thin-film transistors act as digital pixel switches. Research and development is in progress to integrate the driver circuits around the peripheral of the display, resulting in significant cost reduction of connections between rows and columns and the peripheral circuitry. For this latter application, where for instance it is important to control the greyscale voltage level delivered to the pixel, an understanding of device behaviour is required so that models can be developed for analogue circuit simulation. For this purpose, various analytical models have been developed based on that of Seto who considered the effect of monoenergetic trap states and grain boundaries in polycrystalline materials but not the contribution of the grains to the electrical properties. The principal aim of this thesis is to describe the use of a numerical device simulator (ATLAS) as a tool to investigate the physics of the trapping process involved in the device operation, which additionally takes into account the effect of multienergetic trapping levels and the contribution of the grain into the modelling. A study of the conventional analytical models is presented, and an alternative approach is introduced which takes into account the grain regions to enhance the accuracy of the analytical modelling. A physically-based discrete-grain-boundary model and characterisation method are introduced to study the effects of the multienergetic trap states on the electrical characteristics of poly-TFTs using CdSe devices as the experimental example, and the electrical parameters such as the density distribution of the trapping states are extracted. The results show excellent agreement between the simulation and experimental data. The limitations of this proposed physical model are also studied and discussed. (author)

Impact of Joule heating, roughness, and contaminants on the relative hardness of polycrystalline gold

International Nuclear Information System (INIS)

Freeze, Christopher R; Ji, Xiaoyin; Irving, Douglas L; Kingon, Angus I

2013-01-01

Asperities play a central role in the mechanical and electrical properties of contacting surfaces. Changes in trends of uniaxial compression of an asperity tip in contact with a polycrystalline substrate as a function of substrate geometry, compressive stress and applied voltage are investigated here by implementation of a coupled continuum and atomistic approach. Surprisingly, an unmodified Au polycrystalline substrate is found to be softer than one containing a void for conditions of high stress and an applied voltage of 0.2 V. This is explained in terms of the temperature distribution and weakening of Au as a function of temperature. The findings in this communication are important to the design of materials for electrical contacts because applied conditions may play a role in reversing relative hardness of the materials for conditions experienced during operation. (fast track communication)

Three-dimensional imaging of vortex structure in a ferroelectric nanoparticle driven by an electric field.

Science.gov (United States)

Karpov, D; Liu, Z; Rolo, T Dos Santos; Harder, R; Balachandran, P V; Xue, D; Lookman, T; Fohtung, E

2017-08-17

Topological defects of spontaneous polarization are extensively studied as templates for unique physical phenomena and in the design of reconfigurable electronic devices. Experimental investigations of the complex topologies of polarization have been limited to surface phenomena, which has restricted the probing of the dynamic volumetric domain morphology in operando. Here, we utilize Bragg coherent diffractive imaging of a single BaTiO 3 nanoparticle in a composite polymer/ferroelectric capacitor to study the behavior of a three-dimensional vortex formed due to competing interactions involving ferroelectric domains. Our investigation of the structural phase transitions under the influence of an external electric field shows a mobile vortex core exhibiting a reversible hysteretic transformation path. We also study the toroidal moment of the vortex under the action of the field. Our results open avenues for the study of the structure and evolution of polar vortices and other topological structures in operando in functional materials under cross field configurations.Imaging of topological states of matter such as vortex configurations has generally been limited to 2D surface effects. Here Karpov et al. study the volumetric structure and dynamics of a vortex core mediated by electric-field induced structural phase transition in a ferroelectric BaTiO 3 nanoparticle.

Passivation of defects in polycrystalline Cu2O thin films by hydrogen or cyanide treatment

International Nuclear Information System (INIS)

Ishizuka, S.; Kato, S.; Okamoto, Y.; Sakurai, T.; Akimoto, K.; Fujiwara, N.; Kobayashi, H.

2003-01-01

The effects of the passivation of defects in polycrystalline nitrogen-doped cuprous oxide (Cu 2 O) thin films with hydrogen or cyanide treatment were studied. In the photoluminescence (PL) measurements, although the emission was not observed before treatment, luminescence of Cu 2 O at around 680 nm was observed after each treatment. This improvement in the luminescence property may be due to the passivation of non-radiative recombination centers by H or CN. The hole carrier concentration increased from the order of 10 16 to 10 17 cm -3 with hydrogen or cyanide treatment. From these results, both the hydrogen and cyanide treatments were found to be very effective to passivate defects and improve the optical and electrical properties of polycrystalline Cu 2 O thin films. The thermal stability of the passivation effects by the cyanide treatment is, however, superior to that by the hydrogen treatment

Dominant pinning mechanisms in YBa2Cu3O7-x films on single and polycrystalline yttria stabilized zirconia substrates

Science.gov (United States)

Harshavardhan, K. S.; Rajeswari, M.; Hwang, D. M.; Chen, C. Y.; Sands, T.; Venkatesan, T.; Tkaczyk, J. E.; Lay, K. W.; Safari, A.

1992-04-01

Critical-current densities have been measured in YBa2Cu3O7-x films deposited on (100) yttria stabilized zirconia (YSZ) and polycrystalline YSZ substrates as a function of temperature (4.5-88 K), magnetic field (0-1 T) and orientation relative to the applied field. The results indicate that in films on polycrystalline substrates, surface and interface pinning play a dominant role at high temperatures. In films on (100) YSZ, pinning is mainly due to intrinsic layer pinning as well as extrinsic pinning associated with the interaction of the fluxoids with point defects and low energy planar (2D) boundaries. The differences are attributed to the intrinsic rigidity of single fluxoids which is reduced in films on polycrystalline substrates thereby weakening the intrinsic layer pinning.

Theoretical Study of the BaTiO3 Powder’s Volume Ratio’s Influence on the Output of Composite Piezoelectric Nanogenerator

Directory of Open Access Journals (Sweden)

Xi Zhou

2017-06-01

Full Text Available The combination of the piezoelectric materials and polymer is an effective way to make the piezoelectric nanogenerator (PENG possess both the polymer’s good flexibility and ferroelectric material’s high piezoelectric coefficient. The volume ratio of ferroelectric material in the composite is an important factor that determines the PENG’s output performance. In this paper, the BaTiO3/polydimethylsiloxane (PDMS composite PENG was demonstrated as having an optimal volume ratio (46% at which the PENG can output its highest voltage, and this phenomenon can be ascribed to the trade-off between the composite PENG’s top electrode charge and its capacitance. These results are of practical importance for the composite PENG’s performance optimization.

Measurement of AC electrical conductivity of single crystal Al2O3 during spallation-neutron irradiation

International Nuclear Information System (INIS)

Kennedy, J.C. III; Farnum, E.H.; Sommer, W.F.; Clinard, F.W. Jr.

1993-01-01

Samples of single crystal Al 2 O 3 , commonly known as sapphire, and polycrystalline Al 2 O 3 were irradiated with spallation neutrons at the Los Alamos Spallation Radiation Effects Facility (LASREF) under various temperature conditions and with a continuously applied alternating electric field. This paper describes the results of measurements on the sapphire samples. Neutron fluence and flux values are estimated values pending recovery and analysis of dosimetry packages. The conductivity increased approximately with the square root of the neutron flux at fluences less than 3 x 10 21 n/m 2 . The increase in conductivity reached saturated levels as high as 2 x 10 -2 (ohm-m) -1 at fluences as low as 2 x 10 22 n/m 2 . Frequency swept impedance measurements indicated a change in the electrical properties from capacitive to resistive behavior with increasing fluence

High-frequency thermal-electrical cycles for pyroelectric energy conversion

International Nuclear Information System (INIS)

Bhatia, Bikram; Damodaran, Anoop R.; Cho, Hanna; Martin, Lane W.; King, William P.

2014-01-01

We report thermal to electrical energy conversion from a 150 nm thick BaTiO 3 film using pyroelectric cycles at 1 kHz. A microfabricated platform enables temperature and electric field control with temporal resolution near 1 μs. The rapid electric field changes as high as 11 × 10 5  kV/cm-s, and temperature change rates as high as 6 × 10 5  K/s allow exploration of pyroelectric cycles in a previously unexplored operating regime. We investigated the effect of phase difference between electric field and temperature cycles, and electric field and temperature change rates on the electrical energy generated from thermal-electrical cycles based on the pyroelectric Ericsson cycle. Complete thermodynamic cycles are possible up to the highest cycle rates tested here, and the energy density varies significantly with phase shifts between temperature and electric field waveforms. This work could facilitate the design and operation of pyroelectric cycles at high cycle rates, and aid in the design of new pyroelectric systems

The X-ray sensitivity of semi-insulating polycrystalline CdZnTe thick films

International Nuclear Information System (INIS)

Won, Jae Ho; Kim, Ki Hyun; Suh, Jong Hee; Cho, Shin Hang; Cho, Pyong Kon; Hong, Jin Ki; Kim, Sun Ung

2008-01-01

The X-ray sensitivity is one of the important parameters indicating the detector performance. The X-ray sensitivity of semi-insulating polycrystalline CdZnTe:Cl thick films was investigated as a function of electric field, mean photon energy, film thickness, and charge carrier transport parameters and, compared with another promising detector materials. The X-ray sensitivities of the polycrystalline CdZnTe films with 350 μm thickness were about 2.2 and 6.2 μC/cm 2 /R in the ohmic-type and Schottky-type detector at 0.83 V/μm, respectively

UV-laser-light-controlled photoluminescence of metal oxide nanoparticles in different gas atmospheres: BaTiO3, SrTiO3 and HfO2

International Nuclear Information System (INIS)

Mochizuki, Shosuke; Saito, Takashi; Yoshida, Kaori

2012-01-01

The photoluminescence (PL) enhancement has been studied at room temperature using various specimen atmospheres (O 2 gas, CO 2 gas, CO 2 -H 2 mixture gas, Ar-H 2 mixture gas and vacuum) under 325 nm laser light irradiation on various metal oxides. Of them, the results obtained for BaTiO 3 nanocrystals, SrTiO 3 ones and HfO 2 powder crystal are given in the present paper. Their PL were considerably increased in intensity by irradiation of 325 nm laser light in CO 2 gas and CO 2 -H 2 mixture gas. The cause of the PL intensity enhancements is discussed in the light of the exciton theory, the defect chemistry and the photocatalytic theory. The results may be applied for the utilization of greenhouse gas (CO 2 ) and the optical sensor for CO 2 gas.

Study of the structural and electrical behavior of Bi(Mg,TiO3 modified (Ba,CaTiO3 ceramics

Directory of Open Access Journals (Sweden)

Md. Kashif Shamim

2016-12-01

Full Text Available The ability of BaTiO3 to form solid solutions with different dopants (both iso- and aliovalent makes it versatile for various applications. In the present study, (Ba,CaTiO3 (BCT is modified with Bi(MgTiO3 (BMT in search for new lead-free ferroelectric material and improve their properties. For this purpose, BCT acts as a main base material and BMT acts as a modifier to fabricate a multifunctional material. In this study, we report the structural and electrical properties of lead free piezo-ceramics (1−x(Ba0.8Ca0.2TiO3–xBi(Mg0.5Ti0.5O3 with x=0.2, 0.4, 0.5 prepared by solid-state sintering technique. Single perovskite phase with tetragonal structure is obtained for all the compositions, which is reconfirmed by the Raman Spectroscopic study. Dielectric study confirm the temperature stable behavior of the dielectric permittivity values above 300∘C. The dielectric constant value decreases with increase in BMT doping content. Impedance Spectroscopic study confirms non-Debye type dielectric relaxation in the specimen. The Nyquist plot and conductivity studies show the negative temperature coefficient of resistance behavior (NTCR of the samples.

Characterization of electrochemically modified polycrystalline platinum surfaces

Energy Technology Data Exchange (ETDEWEB)

Krebs, L.C.; Ishida, Takanobu.

1991-12-01

The characterization of electrochemically modified polycrystalline platinum surfaces has been accomplished through the use of four major electrochemical techniques. These were chronoamperometry, chronopotentiommetry, cyclic voltammetry, and linear sweep voltammetry. A systematic study on the under-potential deposition of several transition metals has been performed. The most interesting of these were: Ag, Cu, Cd, and Pb. It was determined, by subjecting the platinum electrode surface to a single potential scan between {minus}0.24 and +1.25 V{sub SCE} while stirring the solution, that the electrocatalytic activity would be regenerated. As a consequence of this study, a much simpler method for producing ultra high purity water from acidic permanganate has been developed. This method results in water that surpasses the water produced by pyrocatalytic distillation. It has also been seen that the wettability of polycrystalline platinum surfaces is greatly dependent on the quantity of oxide present. Oxide-free platinum is hydrophobic and gives a contact angle in the range of 55 to 62 degrees. We have also modified polycrystalline platinum surface with the electrically conducting polymer poly-{rho}-phenylene. This polymer is very stable in dilute sulfuric acid solutions, even under applied oxidative potentials. It is also highly resistant to electrochemical hydrogenation. The wettability of the polymer modified platinum surface is severely dependent on the choice of supporting electrolyte chosen for the electrochemical polymerization. Tetraethylammonium tetrafluoroborate produces a film that is as hydrophobic as Teflon, whereas tetraethylammonium perchlorate produces a film that is more hydrophilic than oxide-free platinum.

Characterization of electrochemically modified polycrystalline platinum surfaces

Energy Technology Data Exchange (ETDEWEB)

Krebs, Leonard C. [State Univ. of New York (SUNY), Stony Brook, NY (United States); Ishida, Takanobu [State Univ. of New York (SUNY), Stony Brook, NY (United States)

1991-12-01

The characterization of electrochemically modified polycrystalline platinum surfaces has been accomplished through the use of four major electrochemical techniques. These were chronoamperometry, chronopotentiommetry, cyclic voltammetry, and linear sweep voltammetry. A systematic study on the under-potential deposition of several transition metals has been performed. The most interesting of these were: Ag, Cu, Cd, and Pb. It was determined, by subjecting the platinum electrode surface to a single potential scan between -0.24 and +1.25 V_SCE while stirring the solution, that the electrocatalytic activity would be regenerated. As a consequence of this study, a much simpler method for producing ultra high purity water from acidic permanganate has been developed. This method results in water that surpasses the water produced by pyrocatalytic distillation. It has also been seen that the wettability of polycrystalline platinum surfaces is greatly dependent on the quantity of oxide present. Oxide-free platinum is hydrophobic and gives a contact angle in the range of 55 to 62 degrees. We have also modified polycrystalline platinum surface with the electrically conducting polymer poly-ρ-phenylene. This polymer is very stable in dilute sulfuric acid solutions, even under applied oxidative potentials. It is also highly resistant to electrochemical hydrogenation. The wettability of the polymer modified platinum surface is severely dependent on the choice of supporting electrolyte chosen for the electrochemical polymerization. Tetraethylammonium tetrafluoroborate produces a film that is as hydrophobic as Teflon, whereas tetraethylammonium perchlorate produces a film that is more hydrophilic than oxide-free platinum.

Quantitative determination of charge transfer parameters of photorefractive BaTiO3:Rh from EPR-based defect studies

International Nuclear Information System (INIS)

Veber, C; Meyer, M; Schirmer, O F; Kaczmarek, M

2003-01-01

Optical absorption bands can be used as fingerprints of defects and their charge states in insulators and semiconductors. On the basis of the photochromicity usually shown by such materials, a method is introduced by which the optical bands are assigned to the defects and their charge states. It is based on simultaneous measurements of the light-induced changes of the optical absorption and of the corresponding EPR signals. Moreover, indirectly optical bands of EPR-silent defects can also be labelled in this way, strongly widening the scope of EPR based defect studies. We apply this method to the infrared-sensitive photorefractive system BaTiO 3 :Rh, where illumination leads to recharging among the valence states Rh 5+ , Rh 4+ and Rh 3+ . The values of all parameters governing the charge transfers responsible are inferred from the magnitude of the absorption bands, the absolute determination of their absorption cross-sections and the kinetics of the absorption changes under illumination. In contrast to previous investigations, these parameters are deduced independently of photorefractive measurements

Synthesis of polycrystalline Co{sub 3}O{sub 4} nanowires with excellent ammonium perchlorate catalytic decomposition property

Energy Technology Data Exchange (ETDEWEB)

Zhou, Hai [State Key Laboratory of Coal Conversion, Institute of Coal Chemistry, Chinese Academy of Sciences, Taiyuan 030001 (China); University of Chinese Academy of Sciences, Beijing 100049 (China); Lv, Baoliang, E-mail: lbl604@sxicc.ac.cn [State Key Laboratory of Coal Conversion, Institute of Coal Chemistry, Chinese Academy of Sciences, Taiyuan 030001 (China); Wu, Dong; Xu, Yao [State Key Laboratory of Coal Conversion, Institute of Coal Chemistry, Chinese Academy of Sciences, Taiyuan 030001 (China)

2014-12-15

Graphical abstract: Co{sub 3}O{sub 4} nanowires with excellent ammonium perchlorate catalytic decomposition property were synthesized via a methanamide-assisted hydrolysis and subsequent dissolution–recrystallization process in the presence of methanamide. - Abstract: Co{sub 3}O{sub 4} nanowires, with the length of tens of micrometers and the width of several hundred nanometers, were produced by a hydrothermal treatment and a post-anneal process. X-ray diffraction (XRD) result showed that the Co{sub 3}O{sub 4} nanowires belong to cubic crystal system. Scanning electron microscopy (SEM) and high-resolution transmission electron microscopy (HRTEM) analysis indicated that the Co{sub 3}O{sub 4} nanowires, composed by single crystalline nanoparticles, were of polycrystalline nature. On the basis of time-dependent experiments, methanamide-assisted hydrolysis and subsequent dissolution–recrystallization process were used to explain the precursors' formation process of the polycrystalline Co{sub 3}O{sub 4} nanowires. The TGA experiments showed that the as-obtained Co{sub 3}O{sub 4} nanowires can catalyze the thermal decomposition of ammonium perchlorate (AP) effectively.

Temperature-dependent high energy-resolution EELS of ferroelectric and paraelectric BaTiO3 phases

Science.gov (United States)

Bugnet, Matthieu; Radtke, Guillaume; Woo, Steffi Y.; Zhu, Guo-zhen; Botton, Gianluigi A.

2016-01-01

Probing the ferroelectricity at the nanometer scale is of particular interest for a wide range of applications. In this Rapid Communication, the structural distortion of BaTiO3 (BTO) is studied in its ferroelectric (rhombohedral and tetragonal), and paraelectric phases from the O K near edge structures in electron energy loss spectroscopy. Modifications of the electronic structure are detected in the lowest energy fine structure (FS) of the O K edge in the ferroelectric phases, and are interpreted by core-hole valence-electron screening geometry. For the paraelectric phase, the lowest energy FS of the O K edge is comparable to the one obtained at room temperature, which is inconsistent with an expected cubic structure. The variations observed in the O K near edge structures, such as a broader and more asymmetric lowest energy FS at low temperature, suggest that the magnitude of the Ti+4 off-centering along increases in lower-temperature phases. These findings demonstrate the sensitivity of the O K near edge structures to the structural distortions of BTO polymorphs, and form a basis for further investigations on defective or strained BTO at the nanoscale.

Formation of photovoltaic modules based on polycrystalline solar cells

OpenAIRE

L. A. Dobrzański; A. Drygała; A. Januszka

2009-01-01

Purpose: The main aim of the paper is formation of photovoltaic modules and analysis of their main electric parameters.Design/methodology/approach: Photovoltaic modules were produced from four polycrystalline silicon solar cells, that were cut and next joined in series. Soft soldering technique and copper-tin strip were used for joining cells.Findings: In order to provide useful power for any application, the individual solar cells must be connected together to give the appropriate current an...

Magnetoelectric coupling effect in transition metal modified polycrystalline BiFeO3 thin films

International Nuclear Information System (INIS)

Sreenivas Puli, Venkata; Kumar Pradhan, Dhiren; Gollapudi, Sreenivasulu; Coondoo, Indrani; Panwar, Neeraj; Adireddy, Shiva; Chrisey, Douglas B.; Katiyar, Ram S.

2014-01-01

Rare-earth (Sm) and transition metal (Co) modified polycrystalline BiFeO 3 (BFO) thin films have been deposited on Pt/TiO 2 /SiO 2 /Si substrate successfully through pulsed laser deposition (PLD) technique. Piezoelectric, leakage current and temperature dependent dielectric and magnetic behaviour were investigated for the films. Typical “butterfly-shaped” loop were observed in BSFCO films with an effective piezoelectric constant (d 33 ) ∼94 pm/V at 0.6 MV/cm. High dielectric constant ∼900 and low dielectric loss ∼0.25 were observed at room temperature. M–H loops have shown relatively high saturation magnetization ∼35 emu/cm 3 at a maximum field of H ∼20 kOe. Enhanced magnetoelectric coupling response is observed under applied magnetic field. The multiferroic, piezoelectric, leakage current behaviours were explored. Such studies should be helpful in designing multiferroic materials based on BSFCO films. - Highlights: • Transition metal modified polycrystalline BiFeO 3 thin films prepared using PLD. • High ME-coupling response was observed in co-substituted BiFeO 3 thin films. • High magnetization ∼35 emu/cm 3 at a maximum field of H ∼20 kOe. • Low leakage current might be due to co-substitution in BiFeO 3 thin films. • A notable piezoelectric constant d 33 ∼94 pm/V was found in BiFeO 3 thin films

Epitaxial c-axis oriented BaTiO3 thin films on SrTiO3-buffered Si(001) by atomic layer deposition

International Nuclear Information System (INIS)

Ngo, Thong Q.; McDaniel, Martin D.; Ekerdt, John G.; Posadas, Agham B.; Demkov, Alexander A.; Hu, Chengqing; Yu, Edward T.; Bruley, John

2014-01-01

Atomic layer deposition (ALD) of epitaxial c-axis oriented BaTiO 3 (BTO) on Si(001) using a thin (1.6 nm) buffer layer of SrTiO 3 (STO) grown by molecular beam epitaxy is reported. The ALD growth of crystalline BTO films at 225  °C used barium bis(triisopropylcyclopentadienyl), titanium tetraisopropoxide, and water as co-reactants. X-ray diffraction (XRD) reveals a high degree of crystallinity and c-axis orientation of as-deposited BTO films. Crystallinity is improved after vacuum annealing at 600  °C. Two-dimensional XRD confirms the tetragonal structure and orientation of 7–20-nm thick films. The effect of the annealing process on the BTO structure is discussed. A clean STO/Si interface is found using in-situ X-ray photoelectron spectroscopy and confirmed by cross-sectional scanning transmission electron microscopy. The capacitance-voltage characteristics of 7–20 nm-thick BTO films are examined and show an effective dielectric constant of ∼660 for the heterostructure

Size effect on the dielectric properties of BaTiO3 nanoceramics in a modified Ginsburg-Landau-Devonshire thermodynamic theory

Science.gov (United States)

Lin, Shan; Lü, Tianquan; Jin, Changqing; Wang, Xiaohui

2006-10-01

Grain size effects on the dielectric properties of BaTiO3 nanoceramics have been studied by using the modified Ginsburg-Landau-Devonshire (GLD) thermodynamic theory. Considering the existence of internal stresses, it is found that with decreasing grain size the transition temperature of cubic-tetragonal phase decreases, while those of tetragonal-orthorhombic and orthorhombic-rhombohedral phases increase. With further reducing grain size, our model predicts that the two ferroelectric structures of orthorhombic and tetragonal phases will become unstable and disappear at a critical size, leaving only one stable ferroelectric phase of rhombohedral structure. Consequently, a theoretical phase diagram of the transition temperature versus grain size is established wherein two triple points and a reentrance behavior are indicated. The results are compared with experimental data.

Mesoscopic approach to modeling elastic-plastic polycrystalline material behaviour

International Nuclear Information System (INIS)

Kovac, M.; Cizelj, L.

2001-01-01

Extreme loadings during severe accident conditions might cause failure or rupture of the pressure boundary of a reactor coolant system. Reliable estimation of the extreme deformations can be crucial to determine the consequences of such an accident. One of important drawbacks of classical continuum mechanics is idealization of inhomogenous microstructure of materials. This paper discusses the mesoscopic approach to modeling the elastic-plastic behavior of a polycrystalline material. The main idea is to divide the continuum (e.g., polycrystalline aggregate) into a set of sub-continua (grains). The overall properties of the polycrystalline aggregate are therefore determined by the number of grains in the aggregate and properties of randomly shaped and oriented grains. The random grain structure is modeled with Voronoi tessellation and random orientations of crystal lattices are assumed. The elastic behavior of monocrystal grains is assumed to be anisotropic. Crystal plasticity is used to describe plastic response of monocrystal grains. Finite element method is used to obtain numerical solutions of strain and stress fields. The analysis is limited to two-dimensional models.(author)

Polycrystalline diamond detectors with three-dimensional electrodes

Energy Technology Data Exchange (ETDEWEB)

Lagomarsino, S., E-mail: lagomarsino@fi.infn.it [University of Florence, Department of Physics, Via Sansone 1, 50019 Sesto Fiorentino (Italy); INFN Firenze, Via B. Rossi 1, 50019 Sesto Fiorentino (Italy); Bellini, M. [INO-CNR Firenze, Largo E. Fermi 6, 50125 Firenze (Italy); Brianzi, M. [INFN Firenze, Via B. Rossi 1, 50019 Sesto Fiorentino (Italy); Carzino, R. [Smart Materials-Nanophysics, Istituto Italiano di Tecnologia, Genova, Via Morego 30, 16163 Genova (Italy); Cindro, V. [Joseph Stefan Institute, Jamova Cesta 39, 1000 Ljubljana (Slovenia); Corsi, C. [University of Florence, Department of Physics, Via Sansone 1, 50019 Sesto Fiorentino (Italy); LENS Firenze, Via N. Carrara 1, 50019 Sesto Fiorentino (Italy); Morozzi, A.; Passeri, D. [INFN Perugia, Perugia (Italy); Università degli Studi di Perugia, Dipartimento di Ingegneria, via G. Duranti 93, 06125 Perugia (Italy); Sciortino, S. [University of Florence, Department of Physics, Via Sansone 1, 50019 Sesto Fiorentino (Italy); INFN Firenze, Via B. Rossi 1, 50019 Sesto Fiorentino (Italy); Servoli, L. [INFN Perugia, Perugia (Italy)

2015-10-01

The three-dimensional concept in diamond detectors has been applied, so far, to high quality single-crystal material, in order to test this technology in the best available conditions. However, its application to polycrystalline chemical vapor deposited diamond could be desirable for two reasons: first, the short inter-electrode distance of three-dimensional detectors should improve the intrinsically lower collection efficiency of polycrystalline diamond, and second, at high levels of radiation damage the performances of the poly-crystal material are not expected to be much lower than those of the single crystal one. We report on the fabrication and test of three-dimensional polycrystalline diamond detectors with several inter-electrode distances, and we demonstrate that their collection efficiency is equal or higher than that obtained with conventional planar detectors fabricated with the same material. - Highlights: • Pulsed laser fabrication of polycristalline diamond detectors with 3D electrodes. • Measurement of the charge collection efficiency (CCE) under beta irradiation. • Comparation between the CCE of 3D and conventional planar diamond sensors. • A rationale for the behavior of three-dimensional and planar sensors is given.

Anelasticity of polycrystalline indium

Energy Technology Data Exchange (ETDEWEB)

Sapozhnikov, K., E-mail: k.sapozhnikov@mail.ioffe.ru [A.F.Ioffe Physical-Technical Institute, Politekhnicheskaya 26, 194021 St. Petersburg (Russian Federation); Golyandin, S. [A.F.Ioffe Physical-Technical Institute, Politekhnicheskaya 26, 194021 St. Petersburg (Russian Federation); Kustov, S. [Dept. de Fisica, Universitat de les Illes Balears, Cra Valldemossa km 7.5, E 07122 Palma de Mallorca (Spain)

2009-09-15

Mechanisms of anelasticity of polycrystalline indium have been studied over wide ranges of temperature (7-320 K) and strain amplitude (2 x 10{sup -7}-3.5 x 10{sup -4}). Measurements of the internal friction and Young's modulus have been performed by means of the piezoelectric resonant composite oscillator technique using longitudinal oscillations at frequencies of about 100 kHz. The stages of the strain amplitude dependence of the internal friction and Young's modulus defect, which can be attributed to dislocation - point defect and dislocation - dislocation interactions, have been revealed. It has been shown that thermal cycling gives rise to microplastic straining of polycrystalline indium due to the anisotropy of thermal expansion and to appearance of a 'recrystallization' internal friction maximum in the temperature spectra of amplitude-dependent anelasticity. The temperature range characterized by formation of Cottrell's atmospheres of point defects around dislocations has been determined from the acoustic data.

Electromechanical Response of Polycrystalline Barium Titanate Resolved at the Grain Scale

DEFF Research Database (Denmark)

Majkut, Marta; Daniels, John E.; Wright, Jonathan P.

2017-01-01

critical for understanding bulk polycrystalline ferroic behavior. Here, three-dimensional X-ray diffraction is used to reconstruct a 3D grain map (grain orientations and neighborhoods) of a polycrystalline barium titanate sample and track the grain-scale non-180° ferroelectric domain switching strains...

Ultrafast Electric Field Pulse Control of Giant Temperature Change in Ferroelectrics

Science.gov (United States)

Qi, Y.; Liu, S.; Lindenberg, A. M.; Rappe, A. M.

2018-01-01

There is a surge of interest in developing environmentally friendly solid-state-based cooling technology. Here, we point out that a fast cooling rate (≈1011 K /s ) can be achieved by driving solid crystals to a high-temperature phase with a properly designed electric field pulse. Specifically, we predict that an ultrafast electric field pulse can cause a giant temperature decrease up to 32 K in PbTiO3 occurring on few picosecond time scales. We explain the underlying physics of this giant electric field pulse-induced temperature change with the concept of internal energy redistribution: the electric field does work on a ferroelectric crystal and redistributes its internal energy, and the way the kinetic energy is redistributed determines the temperature change and strongly depends on the electric field temporal profile. This concept is supported by our all-atom molecular dynamics simulations of PbTiO3 and BaTiO3 . Moreover, this internal energy redistribution concept can also be applied to understand electrocaloric effect. We further propose new strategies for inducing giant cooling effect with ultrafast electric field pulse. This Letter offers a general framework to understand electric-field-induced temperature change and highlights the opportunities of electric field engineering for controlled design of fast and efficient cooling technology.

Microcolumnar and polycrystalline growth of LaBr3:Ce scintillator

Science.gov (United States)

Nagarkar, V. V.; Miller, S.; Sia, R.; Gaysinskiy, V.

2011-05-01

While a wide variety of new scintillators are now available, cerium-doped lanthanide halide scintillators have shown a strong potential toward fulfilling the needs of highly demanding applications such as radioisotope identification at room temperature, homeland security, quantitative molecular imaging for medical diagnostics, and disease staging and research. Despite their extraordinary advantages in terms of light yield and response uniformity over a wide energy range, issues related to reliable, large volume manufacturing of these high-light-yield materials in a rapid and economic manner has not been resolved or purposefully addressed. Here we report on synthesizing LaBr3:Ce scintillator using a thermal evaporation technique, which offers the potential to synthesize large quantities of small-to-large volume, high-quality material in a time-efficient and cost-effective manner. To date we have successfully applied this method to form both microcolumnar films and thick polycrystalline slabs of LaBr3:Ce, and have characterized their light yield, response linearity, decay time and afterglow.

Surface damages of polycrystalline W and La2O3-doped W induced by high-flux He plasma irradiation

Science.gov (United States)

Liu, Lu; Li, Shouzhe; Liu, Dongping; Benstetter, Günther; Zhang, Yang; Hong, Yi; Fan, Hongyu; Ni, Weiyuan; Yang, Qi; Wu, Yunfeng; Bi, Zhenhua

2018-04-01

In this study, polycrystalline tungsten (W) and three oxide dispersed strengthened W with 0.1 vol %, 1.0 vol % and 5.0 vol % lanthanum trioxide (La2O3) were irradiated with low-energy (200 eV) and high-flux (5.8 × 1021 or 1.4 × 1022 ions/m2ṡs) He+ ions at elevated temperature. After He+ irradiation at a fluence of 3.0 × 1025/m2, their surface damages were observed by scanning electron microscopy, energy dispersive spectroscopy, scanning electron microscopy-electron backscatter diffraction, and conductive atomic force microscopy. Micron-sized holes were formed on the surface of W alloys after He+ irradiation at 1100 K. Analysis shows that the La2O3 grains doped in W were sputtered preferentially by the high-flux He+ ions when compared with the W grains. For irradiation at 1550 K, W nano-fuzz was formed at the surfaces of both polycrystalline W and La2O3-doped W. The thickness of the fuzz layers formed at the surface of La2O3-doped W is 40% lower than the one of polycrystalline W. The presence of La2O3 could suppress the diffusion and coalescence of He atoms inside W, which plays an important role in the growth of nanostructures fuzz.

Synthesis of BaTiO3 and SrTiO3 by microwave assisted hydrothermal method (MAH) using anatase as titanium precursor

International Nuclear Information System (INIS)

Magalhães, Renata da Silva; Macedo Junior, Wagner Dias; Souza, Agda Eunice de; Teixeira, Silvio Rainho; Li, Maximo Siu; Longo, Elson

2016-01-01

Full text: Strontium and barium titanates (SrTiO 3 (ST) and BaTiO 3 (BT)) in their crystalline form belong to the perovskite (ABO 3 ) class. Both display a semiconductor behavior with many interesting properties. The method of synthesis employed and different precursors may influence the morphology and properties of ceramic materials [1,2]. Barium (BT) and strontium (St) titanates were produced using the Microwave Assisted Hydrothermal Method (MAH), different concentrations (1,3 and 6 molL -1 ) of mineralizer (KOH) and a different titanium precursor: a complex anatase-hydrogen peroxide. Barium and strontium chloride were used as the other metal precursors. The resulting material were characterized by different techniques such as: X-ray diffraction (XRD), Micro-Raman Spectroscopy (MR), UV-Vis, Scanning Electron microscopy (SEM) and finally their photoluminescent emissions (FL) were recorded at room temperature. The results show that there were differences in crystallinity, morphology, number of formed phases and photoluminescent emission, among the titanate produced with different concentrations of mineralizer. References: [1] A.E. Souza et al., Order–disorder degree of self-assembled clusters: Influence on photoluminescence emission and morphology of Ba x Sr 1-x TiO 3 nanocrystals, Chemical Physics Letters 514 (2011) 301–306. [2] T. M. Mazzo et al., Influence of titanium precursor on photoluminescent emission of micro-cube-shaped CaTiO 3 , Journal of Luminescence 165 (2015). (author)

Role of A-site Ca and B-site Zr substitution in BaTiO3 lead-free compounds: Combined experimental and first principles density functional theoretical studies

Science.gov (United States)

Keswani, Bhavna C.; Saraf, Deepashri; Patil, S. I.; Kshirsagar, Anjali; James, A. R.; Kolekar, Y. D.; Ramana, C. V.

2018-05-01

We report on the combined experimental and theoretical simulation results of lead-free ferroelectrics, Ba(1-x)CaxTiO3 (x = 0.0-0.3) and BaTi(1-y)ZryO3 (y = 0.0-0.2), synthesized by standard solid state reaction method. First principles density functional calculations are used to investigate the electronic structure, dynamical charges, and spontaneous polarization of these compounds. In addition, the structural, ferroelectric, piezoelectric, and dielectric properties are studied using extensive experiments. The X-ray diffraction and temperature dependent Raman spectroscopy studies indicate that the calcium (Ca) substituted compositions exhibit a single phase crystal structure, while zirconium (Zr) substituted compositions are biphasic. The scanning electron micrographs reveal the uniform and highly dense microstructure. The presence of polarization-electric field and strain-electric field hysteresis loops confirms the ferroelectric and piezoelectric nature of all the compositions. Our results demonstrate higher values for polarization, percentage strain, piezoelectric coefficients, and electrostrictive coefficient compared to those existing in the literature. For smaller substitutions of Ca and Zr in BaTiO3, a direct piezoelectric coefficient (d33) is enhanced, while the highest d33 value (˜300 pC/N) is observed for BaTi0.96Zr0.04O3 due to the biphasic ferroelectric behavior. Calculation of Born effective charges indicates that doping with Ca or Zr increases the dynamical charges on Ti as well as on O and decreases the dynamical charge on Ba. An increase in the dynamical charges on Ti and O is ascribed to the increase in covalency of Ti-O bond that reduces the polarizability of the crystal. A broader range of temperatures is demonstrated to realize the stable phase in the Ca substituted compounds. The results indicate enhancement in the temperature range of applicability of these compounds for device applications. The combined theoretical and experimental study is

The relationship between structural evolution and electrical percolation of the initial stages of tungsten chemical vapor deposition on polycrystalline TiN

International Nuclear Information System (INIS)

Rozenblat, A.; Haimson, S.; Shacham-Diamand, Y.; Horvitz, D.

2012-01-01

This paper presents experimental results and a geometric model of the evolution of sheet resistance and surface morphology during the transition from nucleation to percolation of tungsten chemical vapor deposition over ultrathin polycrystalline titanium nitride (TiN). We observed two mechanisms of reduction in sheet resistance. At deposition temperatures higher than 310 deg. C, percolation effect is formed at ∼35% of surface coverage, θ, and characterized with a sharp drop in resistance. At temperature below 310 deg. C, a reduction in resistance occurs in two steps. The first step occurs when θ = 35% and the second step at θ = 85%. We suggest a geometric model in which the electrical percolation pass is modulated by the thickness threshold of the islands at the instant of collision.

Magnetoelectric coupling effect in transition metal modified polycrystalline BiFeO{sub 3} thin films

Energy Technology Data Exchange (ETDEWEB)

Sreenivas Puli, Venkata, E-mail: pvsri123@gmail.com [Department of Physics and Engineering Physics, Tulane University, New Orleans, LA 70118 (United States); Department of Physics and Institute of Functional Nanomaterials, University of Puerto Rico, San Juan, PR 00936 (United States); Kumar Pradhan, Dhiren [Department of Physics and Institute of Functional Nanomaterials, University of Puerto Rico, San Juan, PR 00936 (United States); Gollapudi, Sreenivasulu [Department of Physics, Oakland University, Rochester, MI 48309-4401 (United States); Coondoo, Indrani [Department of Materials and Ceramic and CICECO, University of Aveiro, 3810-193 Aveiro (Portugal); Panwar, Neeraj [Department of Physics, Central University of Rajasthan, Bandar Sindri, Kishangarh 305801, Rajasthan (India); Adireddy, Shiva; Chrisey, Douglas B. [Department of Physics and Engineering Physics, Tulane University, New Orleans, LA 70118 (United States); Katiyar, Ram S. [Department of Physics and Institute of Functional Nanomaterials, University of Puerto Rico, San Juan, PR 00936 (United States)

2014-11-15

Rare-earth (Sm) and transition metal (Co) modified polycrystalline BiFeO{sub 3} (BFO) thin films have been deposited on Pt/TiO{sub 2}/SiO{sub 2}/Si substrate successfully through pulsed laser deposition (PLD) technique. Piezoelectric, leakage current and temperature dependent dielectric and magnetic behaviour were investigated for the films. Typical “butterfly-shaped” loop were observed in BSFCO films with an effective piezoelectric constant (d{sub 33}) ∼94 pm/V at 0.6 MV/cm. High dielectric constant ∼900 and low dielectric loss ∼0.25 were observed at room temperature. M–H loops have shown relatively high saturation magnetization ∼35 emu/cm{sup 3} at a maximum field of H ∼20 kOe. Enhanced magnetoelectric coupling response is observed under applied magnetic field. The multiferroic, piezoelectric, leakage current behaviours were explored. Such studies should be helpful in designing multiferroic materials based on BSFCO films. - Highlights: • Transition metal modified polycrystalline BiFeO{sub 3} thin films prepared using PLD. • High ME-coupling response was observed in co-substituted BiFeO{sub 3} thin films. • High magnetization ∼35 emu/cm{sup 3} at a maximum field of H ∼20 kOe. • Low leakage current might be due to co-substitution in BiFeO{sub 3} thin films. • A notable piezoelectric constant d{sub 33} ∼94 pm/V was found in BiFeO{sub 3} thin films.

Origin of thermally stable ferroelectricity in a porous barium titanate thin film synthesized through block copolymer templating

Directory of Open Access Journals (Sweden)

Norihiro Suzuki

2017-07-01

Full Text Available A porous barium titanate (BaTiO3 thin film was chemically synthesized using a surfactant-assisted sol-gel method in which micelles of amphipathic diblock copolymers served as structure-directing agents. In the Raman spectrum of the porous BaTiO3 thin film, a peak corresponding to the ferroelectric tetragonal phase was observed at around 710 cm−1, and it remained stable at much higher temperature than the Curie temperature of bulk single-crystal BaTiO3 (∼130 °C. Measurements revealed that the ferroelectricity of the BaTiO3 thin film has high thermal stability. By analyzing high-resolution transmission electron microscope images of the BaTiO3 thin film by the fast Fourier transform mapping method, the spatial distribution of stress in the BaTiO3 framework was clearly visualized. Careful analysis also indicated that the porosity in the BaTiO3 thin film introduced anisotropic compressive stress, which deformed the crystals. The resulting elongated unit cell caused further displacement of the Ti4+ cation from the center of the lattice. This displacement increased the electric dipole moment of the BaTiO3 thin film, effectively enhancing its ferro(piezoelectricity.

Mechanical properties of polycrystalline RuSr2GdCu2O8 superconductor

International Nuclear Information System (INIS)

Brum Leite Gusmao Pinheiro, Lincoln; Serbena, Francisco Carlos; Foerster, Carlos Eugenio; Rodrigues, Pedro Junior; Jurelo, Alcione Roberto; Chinelatto, Adilson Luiz; Junior, Jorge Luiz Pimentel

2011-01-01

Research highlights: → Hardness and elastic modulus of Ru-1212 phase measured by instrumented indentation are reported. → Polycrystalline samples were produced by a solid state reaction technique. → Samples were also characterized by SEM, XRD and electrical resistivity measurements. → Hardness and elastic modulus were 8.6 GPa and 145 GPa, respectively. → These values are comparable with those of Y-123. - Abstract: The main objective of this paper is to report the room temperature hardness and elastic modulus of the RuSr 2 GdCu 2 O 8 superconductor phase by instrumented indentation. Polycrystalline samples were produced by a solid state reaction technique. The samples were also characterized by scanning electron microscopy, X-ray diffraction and electrical resistivity measurements. The influence of porosity on the mechanical properties was avoided by considering only those indentations inside the grains. The hardness and elastic modulus were 8.6 GPa and 145 GPa, respectively. These values are comparable with those of Y-123. The indentation fracture toughness evaluated after conventional Vickers indentation was 1.9 MPa m 1/2 .

Poly-crystallinity of indium-tin-oxide films improved by using simultaneous ion beam and heat treatment of the plastic substrate

International Nuclear Information System (INIS)

Son, Phil Kook; Kim, Tae Hyung; Choi, Suk Won; Gwag, Jin Seog

2012-01-01

The combined treatment effects of an ion beam with directionality and heat of a low temperature on a plastic substrate was investigated as a method to increase the electrical conductivity of indium tinoxide (ITO) films deposited on plastic substrate surfaces at low temperatures. Polyethylene terephthalate (PET) surface treatment by using an ion beam at low temperature (120 .deg. C), which can be applied to plastic substrates, improves the conductivity of ITO films. X-ray diffraction indicates that ITO films deposited on PET surfaces treated simultaneously by using an ion beam and heat of a low temperature have an almost polycrystalline structure even though they have small amorphous party on. As a supplementary measurement, the contact angle showed that the polycrystalline structure was due to a self-assembly effect at the PET surfaces. Consequently, the electrical conductivity of an ITO film deposited by using the proposed technique is three times higher than that of an ITO film treated only with heat of low temperature due to the improved polycrystalline structure.

Poly-crystallinity of indium-tin-oxide films improved by using simultaneous ion beam and heat treatment of the plastic substrate

Science.gov (United States)

Son, Phil Kook; Kim, Taehyung; Choi, Suk-Won; Gwag, Jin Seog

2012-08-01

The combined treatment effects of an ion beam with directionality and heat of a low temperature on a plastic substrate was investigated as a method to increase the electrical conductivity of indiumtin-oxide (ITO) films deposited on plastic substrate surfaces at low temperatures. Polyethylene terephthalate (PET) surface treatment by using an ion beam at low temperature (120 °C), which can be applied to plastic substrates, improves the conductivity of ITO films. X-ray diffraction indicates that ITO films deposited on PET surfaces treated simultaneously by using an ion beam and heat of a low temperature have an almost polycrystalline structure even though they have small amorphous party on. As a supplementary measurement, the contact angle showed that the polycrystalline structure was due to a self-assembly effect at the PET surfaces. Consequently, the electrical conductivity of an ITO film deposited by using the proposed technique is three times higher than that of an ITO film treated only with heat of low temperature due to the improved polycrystalline structure.

Simulation of inter- and transgranular crack propagation in polycrystalline aggregates due to stress corrosion cracking

International Nuclear Information System (INIS)

Musienko, Andrey; Cailletaud, Georges

2009-01-01

The motivation of the study is the development of a coupled approach able to account for the interaction between environment and plasticity in a polycrystalline material. The paper recalls first the constitutive equations used to describe the behavior of the grain core and of the grain boundary (GB). The procedure that is applied to generate synthetic polycrystalline aggregates with an explicit representation of the grain boundary area by 2D or 3D finite elements is then described. The approach is applied to the modeling of iodine-assisted stress corrosion cracking (IASCC) in Zircaloy tubes used in nuclear power plants.

High dielectric constant and energy density induced by the tunable TiO2 interfacial buffer layer in PVDF nanocomposite contained with core-shell structured TiO2@BaTiO3 nanoparticles

Science.gov (United States)

Hu, Penghao; Jia, Zhuye; Shen, Zhonghui; Wang, Peng; Liu, Xiaoru

2018-05-01

To realize application in high-capacity capacitors and portable electric devices, large energy density is eagerly desired for polymer-based nanocomposite. The core-shell structured nanofillers with inorganic buffer layer are recently supposed to be promising in improving the dielectric property of polymer nanocomposite. In this work, core-shell structured TO@BT nanoparticles with crystalline TiO2 buffer layer coated on BaTiO3 nanoparticle were fabricated via solution method and heat treatment. The thickness of the TO buffer layer can be tailored by modulating the additive amount of the titanate coupling agent in preparation process, and the apparent dielectric properties of nanocomposite are much related to the thickness of the TO layer. The relatively thin TO layer prefer to generate high polarization to increase dielectric constant while the relatively thick TO layer would rather to homogenize field to maintain breakdown strength. Simulation of electric field distribution in the interfacial region reveals the improving effect of the TO buffer layer on the dielectric properties of nanocomposite which accords with the experimental results well. The optimized nanoparticle TO@BT-2 with a mean thickness of 3-5 nm buffer layer of TO is effective in increasing both the ε and Eb in the PVDF composite film. The maximal discharged energy density of 8.78 J/cm3 with high energy efficiency above 0.6 is obtained in TO@BT-2/PVDF nanocomposite with 2.5 vol% loading close to the breakdown strength of 380 kV/mm. The present study demonstrates the approach to optimize the structure of core-shell nanoparticles by modulating buffer layer and provides a new way to further enlarge energy density in polymer nanocomposite.

An impedance spectroscopy study of magnetodielectric coupling in BaTiO3-CoFe2O4 nanostructured multiferroics

Directory of Open Access Journals (Sweden)

Ulises Acevedo

2017-05-01

Full Text Available Granular BaTiO3-CoFe2O4 (BTO-CFO nanocomposites were prepared by combining polyol synthesis and spark plasma sintering (SPS. This method allows samples with a high density and a very small grain size (less than 150 nm, and thus a large interface area between phases. In order to study the involved magnetoelectric effects, the impedance response of these nanomaterials was measured in the 5 Hz-10 MHz frequency range, under 0-7.5 kOe magnetic applied fields, and in the 40-170°C temperature range. The best agreement to model these results by an equivalent circuit was achieved by means of three parallel RC arrangements connected in series; by their RC values, these circuits are representative of grain boundaries. An association between each RC circuit and each interface (or grain boundary, i. e., BTO-BTO, BTO-CFO, and CFO-CFO, is proposed on the basis of their temperature and magnetic behavior.

Thermal transport properties of polycrystalline tin-doped indium oxide films

International Nuclear Information System (INIS)

Ashida, Toru; Miyamura, Amica; Oka, Nobuto; Sato, Yasushi; Shigesato, Yuzo; Yagi, Takashi; Taketoshi, Naoyuki; Baba, Tetsuya

2009-01-01

Thermal diffusivity of polycrystalline tin-doped indium oxide (ITO) films with a thickness of 200 nm has been characterized quantitatively by subnanosecond laser pulse irradiation and thermoreflectance measurement. ITO films sandwiched by molybdenum (Mo) films were prepared on a fused silica substrate by dc magnetron sputtering using an oxide ceramic ITO target (90 wt %In 2 O 3 and 10 wt %SnO 2 ). The resistivity and carrier density of the ITO films ranged from 2.9x10 -4 to 3.2x10 -3 Ω cm and from 1.9x10 20 to 1.2x10 21 cm -3 , respectively. The thermal diffusivity of the ITO films was (1.5-2.2)x10 -6 m 2 /s, depending on the electrical conductivity. The thermal conductivity carried by free electrons was estimated using the Wiedemann-Franz law. The phonon contribution to the heat transfer in ITO films with various resistivities was found to be almost constant (λ ph =3.95 W/m K), which was about twice that for amorphous indium zinc oxide films

Influence of ammonia flow rate for improving properties of polycrystalline GaN

Science.gov (United States)

Ariff, A.; Ahmad, M. A.; Hassan, Z.; Zainal, N.

2018-06-01

Post-annealing treatment in ammonia ambient is widely accepted for GaN material, but less works have been done to investigate the influence of the ammonia (NH3) flow rate for reducing the N-deficiency as well as improving the quality of the material. In this work, we investigated the influence of NH3 flow rate at 1, 2, 3, and 4 slm in improving properties of a ∼1 μm thick polycrystalline GaN layer. Our simulation work suggested that the uniformity of temperature and pressure gradient of the NH3 gas did not lead to the reduction of N-deficiency of the polycrystalline GaN layer. Instead, it was found that the mitigation of the N-deficiency was strongly influenced by the fluid velocity of the NH3 gas, which had passed over the layer. Either at lower or higher fluid velocity, the chance for the active N atoms to incorporate into the GaN lattice structure was low. Therefore, the N-deficiency on the polycrystalline GaN layer could not be minimized under these conditions. As measured by EDX, the N atoms incorporation was the most effective when the NH3 flow rate at 3 slm, suggesting the flow rate significantly improved the N-deficiency of the polycrystalline GaN layer. Furthermore, it favored the formation of larger hexagonal faceted grains, with the smallest FWHM of XRD peaks from the GaN diffractions in (10 1 bar 0), (0002) and (10 1 bar 1) orientations, while allowing the polycrystalline GaN layer to show sharp and intense emissions peak of NBE in a PL spectrum.

Electrical resistivity due to electron-phonon scattering in thin gadolinium films

International Nuclear Information System (INIS)

Urbaniak-Kucharczyk, A.

1988-01-01

The contribution to the electrical resistivity due to the electron-phonon scattering for the special case of h.c.p. structure is derived. The numerical results obtained for the case of polycrystalline gadolinum films show the resistivity dependence on the film thickness and the surface properties. (author)

Low-energy ion bombardment to tailor the interfacial and mechanical properties of polycrystalline 3C-silicon carbide

International Nuclear Information System (INIS)

Liu Fang; Li, Carolina H.; Pisano, Albert P.; Carraro, Carlo; Maboudian, Roya

2010-01-01

Low-energy Ar + ion bombardment of polycrystalline 3C-silicon carbide (poly-SiC) films is found to be a promising surface modification method to tailor the mechanical and interfacial properties of poly-SiC. The film average stress decreases as the ion energy and the bombardment time increase. Furthermore, this treatment is found to change the strain gradient of the films from positive to negative values. The observed changes in stress and strain gradient are explained by ion peening and thermal spikes models. In addition, the poly-SiC films show a significant enhancement in corrosion resistance by this treatment, which is attributed to a reduction in surface energy and to an increase in the compressive stress in the near-surface region.

Polycrystalline diamond RF MOSFET with MoO3 gate dielectric

Directory of Open Access Journals (Sweden)

Zeyang Ren

2017-12-01

Full Text Available We report the radio frequency characteristics of the diamond metal-oxide-semiconductor field effect transistor with MoO3 gate dielectric for the first time. The device with 2-μm gate length was fabricated on high quality polycrystalline diamond. The maximum drain current of 150 mA/mm at VGS = -5 V and the maximum transconductance of 27 mS/mm were achieved. The extrinsic cutoff frequency of 1.2 GHz and the maximum oscillation frequency of 1.9 GHz have been measured. The moderate frequency characteristics are attributed to the moderate transconductance limited by the series resistance along the channel. We expect that the frequency characteristics of the device can be improved by increasing the magnitude of gm, or fundamentally decreasing the gate-controlled channel resistance and series resistance along the channel, and down-scaling the gate length.

Transport properties of olivine grain boundaries from electrical conductivity experiments

Science.gov (United States)

Pommier, Anne; Kohlstedt, David L.; Hansen, Lars N.; Mackwell, Stephen; Tasaka, Miki; Heidelbach, Florian; Leinenweber, Kurt

2018-05-01

Grain boundary processes contribute significantly to electronic and ionic transports in materials within Earth's interior. We report a novel experimental study of grain boundary conductivity in highly strained olivine aggregates that demonstrates the importance of misorientation angle between adjacent grains on aggregate transport properties. We performed electrical conductivity measurements of melt-free polycrystalline olivine (Fo90) samples that had been previously deformed at 1200 °C and 0.3 GPa to shear strains up to γ = 7.3. The electrical conductivity and anisotropy were measured at 2.8 GPa over the temperature range 700-1400 °C. We observed that (1) the electrical conductivity of samples with a small grain size (3-6 µm) and strong crystallographic preferred orientation produced by dynamic recrystallization during large-strain shear deformation is a factor of 10 or more larger than that measured on coarse-grained samples, (2) the sample deformed to the highest strain is the most conductive even though it does not have the smallest grain size, and (3) conductivity is up to a factor of 4 larger in the direction of shear than normal to the shear plane. Based on these results combined with electrical conductivity data for coarse-grained, polycrystalline olivine and for single crystals, we propose that the electrical conductivity of our fine-grained samples is dominated by grain boundary paths. In addition, the electrical anisotropy results from preferential alignment of higher-conductivity grain boundaries associated with the development of a strong crystallographic preferred orientation of the grains.

The effect of crystal symmetry on the maximum polarization of polycrystalline ferroelectric materials

International Nuclear Information System (INIS)

Jones, Jacob L.

2010-01-01

In polycrystalline ceramics, the degree of domain orientation in all possible crystal orientations contributes to the total realizable polarization. The extent to which domains are oriented towards an applied field can be described by a polarization distribution function. Such representations are calculated and presented in the present work for several different crystal systems including monoclinic symmetries that exhibit a polarization rotation mechanism. The relationship between the polarization distribution functions and the attainable macroscopic polarization is also developed for polycrystalline ceramics that are initially randomly oriented. In these cases, polarization rotation allows a significant degree of preferred orientation parallel to the electric field (>1000 multiples of a random distribution). However, the fraction of single crystal polarization that can be achieved (97.5%) is only marginally better than those of higher crystal symmetry.

Application of polycrystalline diffusion barriers

International Nuclear Information System (INIS)

Tsymbal, V.A.; Kolupaev, I.N.

2010-01-01

Degradation of contacts of the electronic equipment at the raised temperatures is connected with active diffusion redistribution of components contact - metalized systems (CMS) and phase production on interphase borders. One of systems diffusion barriers (DB) are polycrystalline silicide a film, in particular silicides of the titan. Reception disilicide the titan (TiSi 2 ) which on the parameters is demanded for conditions of microelectronics from known silicides of system Ti-Si, is possible as a result of direct reaction of a film of the titan and a substrate of silicon, and at sedimentation of layer Ti-Si demanded stoichiometric structure. Simultaneously there is specific problem polycrystalline diffusion a barrier (PDB): the polycrystalline provides structural balance and metastability film disilicide, but leaves in it borders of grains - easy local ways of diffusion. In clause the analysis diffusion permeability polycrystalline and polyphase DB is made and recommendations for practical methods of increase of blocking properties PDB are made.

Preparation and characterization of carbonate terminated polycrystalline Al2O3/Al films

International Nuclear Information System (INIS)

Tornow, C.; Noeske, P.-L.M.; Dieckhoff, S.; Wilken, R.; Gaertner, K.

2005-01-01

X-ray photoelectron spectroscopy (XPS) was applied to investigate the surface reactivity of polycrystalline Al films in contact with a gas mixture of carbon dioxide and oxygen at room temperature. Based on the characterization of interactions between these substrates and the individual gases at selected exposures, various surface functionalities were identified. Simultaneously dosing both carbon dioxide and oxygen is shown to create surface-terminating carbonate species, which contribute to inhibiting the formation of an Al 2 O 3 layer. Finally, a reaction scheme is suggested to account for the observed dependence of surface group formation on the dosing conditions

Interfacial effects on the electrical properties of multiferroic BiFeO3/Pt/Si thin film heterostructures

International Nuclear Information System (INIS)

Yakovlev, S.; Zekonyte, J.; Solterbeck, C.-H.; Es-Souni, M.

2005-01-01

Polycrystalline BiFeO 3 thin films of various thickness were fabricated on (111)Pt/Ti/SiO 2 /Si substrates via chemical solution deposition. The electrical properties were investigated using impedance and leakage current measurements. X-ray photoelectron spectroscopy (XPS) combined with Ar ion milling (depth profiling) was used to investigate elemental distribution near the electrode-film interface. It is shown that the dielectric constant depends on film thickness due to the presence of an interfacial film-electrode layer evidenced by XPS investigation. Direct current conductivity is found to be governed by Schottky and/or Poole-Frenkel mechanisms

Effect of Grain Boundaries on the Performance of Thin-Film-Based Polycrystalline Silicon Solar Cells: A Numerical Modeling

Science.gov (United States)

Chhetri, Nikita; Chatterjee, Somenath

2018-01-01

Solar cells/photovoltaic, a renewable energy source, is appraised to be the most effective alternative to the conventional electrical energy generator. A cost-effective alternative of crystalline wafer-based solar cell is thin-film polycrystalline-based solar cell. This paper reports the numerical analysis of dependency of the solar cell parameters (i.e., efficiency, fill factor, open-circuit voltage and short-circuit current density) on grain size for thin-film-based polycrystalline silicon (Si) solar cells. A minority carrier lifetime model is proposed to do a correlation between the grains, grain boundaries and lifetime for thin-film-based polycrystalline Si solar cells in MATLAB environment. As observed, the increment in the grain size diameter results in increase in minority carrier lifetime in polycrystalline Si thin film. A non-equivalent series resistance double-diode model is used to find the dark as well as light (AM1.5) current-voltage (I-V) characteristics for thin-film-based polycrystalline Si solar cells. To optimize the effectiveness of the proposed model, a successive approximation method is used and the corresponding fitting parameters are obtained. The model is validated with the experimentally obtained results reported elsewhere. The experimentally reported solar cell parameters can be found using the proposed model described here.

Sensitization by UV light of α-Al2O3:C polycrystalline detectors

International Nuclear Information System (INIS)

Meira B, L. C.; Rubio F, H.; Neres de A, E.; Santos, A.

2014-08-01

This paper describes an increase in sensitivity to gamma and beta radiation on α-Al 2 O 3 :C polycrystalline detector, which has been produced by a sol-gel process, following previous exposure to ultraviolet light. The increased sensitivity of the detector as a function of the exposure time and ultraviolet wavelength was studied. Since the main luminescent centers have emission peaks at different wavelengths, selective measurements of thermoluminescent emission intensity were done, in order to investigate the possible conversion of centers as a result of the exposition to ultraviolet light. Experimental results indicate that the nature and parameters of the luminescent centers in α-Al 2 O 3 :C sol-gel material can be very different of those in α-Al 2 O 3 :C single crystal. (author)

Microscopic gate-modulation imaging of charge and field distribution in polycrystalline organic transistors

Science.gov (United States)

Matsuoka, Satoshi; Tsutsumi, Jun'ya; Kamata, Toshihide; Hasegawa, Tatsuo

2018-04-01

In this work, a high-resolution microscopic gate-modulation imaging (μ-GMI) technique is successfully developed to visualize inhomogeneous charge and electric field distributions in operating organic thin-film transistors (TFTs). We conduct highly sensitive and diffraction-limit gate-modulation sensing for acquiring difference images of semiconducting channels between at gate-on and gate-off states that are biased at an alternate frequency of 15 Hz. As a result, we observe unexpectedly inhomogeneous distribution of positive and negative local gate-modulation (GM) signals at a probe photon energy of 1.85 eV in polycrystalline pentacene TFTs. Spectroscopic analyses based on a series of μ-GMI at various photon energies reveal that two distinct effects appear, simultaneously, within the polycrystalline pentacene channel layers: Negative GM signals at 1.85 eV originate from the second-derivative-like GM spectrum which is caused by the effect of charge accumulation, whereas positive GM signals originate from the first-derivative-like GM spectrum caused by the effect of leaked gate fields. Comparisons with polycrystalline morphologies indicate that grain centers are predominated by areas with high leaked gate fields due to the low charge density, whereas grain edges are predominantly high-charge-density areas with a certain spatial extension as associated with the concentrated carrier traps. Consequently, it is reasonably understood that larger grains lead to higher device mobility, but with greater inhomogeneity in charge distribution. These findings provide a clue to understand and improve device characteristics of polycrystalline TFTs.

Ductility and fracture behavior of polycrystalline Ni/sub 3/Al alloys

International Nuclear Information System (INIS)

Liu, C.T.

1987-01-01

This paper provides a comprehensive review of the recent work on tensile ductility and fracture behavior of Ni/sub 3/Al alloys tested at ambient and elevated temperatures. Polycrystalline Ni/sub 3/Al is intrinsically brittle along grain boundaries, and the brittleness has been attributed to the large difference in valency, electronegativity, and atom size between nickel and aluminum atoms. Alloying with B, Mn, Fe, and Be significantly increases the ductility and reduces the propensity for intergranular fracture in Ni/sub 3/Al alloys. Boron is found to be most effective in improving room-temperature ductility of Ni/sub 3/Al with <24.5 at.% Al. The tensile ductility of Ni/sub 3/Al alloys depends strongly on test environments at elevated temperatures, with much lower ductilities observed in air than in vacuum. The loss in ductility is accompanied by a change in fracture mode from transgranular to intergranular. This embrittlement is due to a dynamic effect involving simultaneously high localized stress, elevated temperature, and gaseous oxygen. The embrittlement can be alleviated by control of grain shape or alloying with chromium additions. All the results are discussed in terms of localized stress concentration and grain-boundary cohesive strength

Electrical performance of phase change memory cells with Ge3Sb2Te6 deposited by molecular beam epitaxy

International Nuclear Information System (INIS)

Boschker, Jos E.; Riechert, Henning; Calarco, Raffaella; Boniardi, Mattia; Redaelli, Andrea

2015-01-01

Here, we report on the electrical characterization of phase change memory cells containing a Ge 3 Sb 2 Te 6 (GST) alloy grown in its crystalline form by Molecular Beam Epitaxy (MBE). It is found that the high temperature growth on the amorphous substrate results in a polycrystalline film exhibiting a rough surface with a grain size of approximately 80–150 nm. A detailed electrical characterization has been performed, including I-V characteristic curves, programming curves, set operation performance, crystallization activation at low temperature, and resistance drift, in order to determine the material related parameters. The results indicate very good alignment of the electrical parameters with the current state-of-the-art GST, deposited by physical vapor deposition. Such alignment enables a possible employment of the MBE deposition technique for chalcogenide materials in the phase change memory technology, thus leading to future studies of as-deposited crystalline chalcogenides as integrated in electrical vehicles

Nanopores creation in boron and nitrogen doped polycrystalline graphene: A molecular dynamics study

Science.gov (United States)

Izadifar, Mohammadreza; Abadi, Rouzbeh; Nezhad Shirazi, Ali Hossein; Alajlan, Naif; Rabczuk, Timon

2018-05-01

In the present paper, molecular dynamic simulations have been conducted to investigate the nanopores creation on 10% of boron and nitrogen doped polycrystalline graphene by silicon and diamond nanoclusters. Two types of nanoclusters based on silicon and diamond are used to investigate their effect for the fabrication of nanopores. Therefore, three different diameter sizes of the clusters with five kinetic energies of 10, 50, 100, 300 and 500 eV/atom at four different locations in boron or nitrogen doped polycrystalline graphene nanosheets have been perused. We also study the effect of 3% and 6% of boron doped polycrystalline graphene with the best outcome from 10% of doping. Our results reveal that the diamond cluster with diameter of 2 and 2.5 nm fabricates the largest nanopore areas on boron and nitrogen doped polycrystalline graphene, respectively. Furthermore, the kinetic energies of 10 and 50 eV/atom can not fabricate nanopores in some cases for silicon and diamond clusters on boron doped polycrystalline graphene nanosheets. On the other hand, silicon and diamond clusters fabricate nanopores for all locations and all tested energies on nitrogen doped polycrystalline graphene. The area sizes of nanopores fabricated by silicon and diamond clusters with diameter of 2 and 2.5 nm are close to the actual area size of the related clusters for the kinetic energy of 300 eV/atom in all locations on boron doped polycrystalline graphene. The maximum area and the average maximum area of nanopores are fabricated by the kinetic energy of 500 eV/atom inside the grain boundary at the center of the nanosheet and in the corner of nanosheet with diameters of 2 and 3 nm for silicon and diamond clusters on boron and nitrogen doped polycrystalline graphene.

Density functional theory computational study of ferroelectricity and piezoelectricity in BaTiO3/PbTiO3 (0 1 1) superlattices

Science.gov (United States)

Lou, Yaoding; Deng, Junkai; Zhe Liu, Jefferson

2018-04-01

The structure, ferroelectricity (FE), and piezoelectricity of epitaxial BaTiO3/PbTiO3 (BTO/PTO) (0 1 1) superlattices are studied using density functional theory calculations. Our results show that compressive strain arising from the SrTiO3 (0 1 1) substrate stabilizes the (BTO) m /(PTO) n (0 1 1) superlattices in orthorhombic phase with the FE polarization along [0 1 1] direction. Tuning the BTO contents significantly changes the structural, ferroelectric and piezoelectric properties. The FE polarization of superlattices significantly drops with increasing BTO contents, which can be attributed to depolarization of the PTO layers. The averaged c/a ratio of the whole superlattices exhibits anomalous non-monotonic relation with respect to BTO contents. Interestingly, our results predict the (0 1 1) superlattices can enhance the piezoelectric coefficient e 33 with a maximum value at ~67% BTO concentration. This result suggests a potential avenue to design high performance piezoelectric materials with less Pb contents. In-depth analysis reveals the B-site Ti cation as the origin for the enhanced e 33 value, which implies the potential of B-site cation engineering in perovskite heterostructure designs.

Crystal Growth and Characterization of (Bi0.5Na0.5)TiO3-BaTiO3 Single Crystals Obtained by a Top-Seeded Solution Growth Method under High-Pressure Oxygen Atmosphere

Science.gov (United States)

Onozuka, Hiroaki; Kitanaka, Yuuki; Noguchi, Yuji; Miyayama, Masaru

2011-09-01

A single crystal of ferroelectric 0.88(Bi,Na)TiO3-0.12BaTiO3 (BNT-BT) solid solution with tetragonal P4mm structure was grown by a top-seeded solution growth (TSSG) method at a high oxygen pressure (PO2 ) of 0.9 MPa. The crystals exhibited a large remanent polarization (Pr) of 54 µC/cm2, which leads to a spontaneous polarization estimated to be 54 µC/cm2. The large Pr compared with that of crystals grown at PO2 = 0.1 MPa is suggested to originate from a low oxygen vacancy concentration. The high-PO2 TSSG method is demonstrated to be effective for obtaining large-sized, high-quality BNT-BT crystals.

A revisit to the temperature dependence of electrical resistivity of α - Titanium at low temperatures

Science.gov (United States)

Sharath Chandra, L. S.; Mondal, R.; Thamizhavel, A.; Dhar, S. K.; Roy, S. B.

2017-09-01

The temperature dependence of resistivity ρ(T) of a polycrystalline sample and a single crystal sample (current along the [0001] direction) of α - Titanium (Ti) at low temperatures is revisited to understand the electrical charge transport phenomena in this hexagonal closed pack metal. We show that the ρ(T) in single crystal Ti can be explained by considering the scattering of electrons due to electron-phonon, electron-electron, inter-band s-d and electron-impurity interactions, whereas the ρ(T) of polycrystalline Ti could not be explained by these interactions alone. We observed that the effects of the anisotropy of the hexagonal structure on the electronic band structure and the phonon dispersion need to be taken into account to explain ρ(T) of polycrystalline Ti. Two Debye temperatures corresponding to two different directions for the electron-phonon interactions and inter-band s-d scattering are needed to account the observed ρ(T) in polycrystalline Ti.

The effect of grain size and phosphorous-doping of polycrystalline 3C–SiC on infrared reflectance spectra

International Nuclear Information System (INIS)

Rooyen, I.J. van; Engelbrecht, J.A.A.; Henry, A.; Janzén, E.; Neethling, J.H.; Rooyen, P.M. van

2012-01-01

Highlights: ► IR is investigated as a technique to measure grain size and P-doping of polycrystalline SiC. ► Infrared plasma minima can be used to determine doping levels in 3C–SiC for doping levels greater than 5 × 10 17 cm −3 . ► A linear relationship is found between FWHM and the inverse of grain size of 3C–SiC irrespective of P-doping level. ► It is further found that ω p is not influenced by the grain size. ► P-doping level has no significant effect on the linear relationship between grain size and surface roughness. - Abstract: The effect of P-doping and grain size of polycrystalline 3C–SiC on the infrared reflectance spectra is reported. The relationship between grain size and full width at half maximum (FWHM) suggest that the behavior of the 3C–SiC with the highest phosphorous doping level (of 1.2 × 10 19 at. cm −3 ) is different from those with lower doping levels ( 18 at. cm −3 ). It is also further demonstrated that the plasma resonance frequency (ω p ) is not influenced by the grain size.

Absorption intensities and emission cross sections of principal intermanifold and inter-Stark transitions of Er3+(4f 11) in polycrystalline ceramic garnet Y3Al5O12

International Nuclear Information System (INIS)

Sardar, Dhiraj K.; Russell, Charles C. III; Gruber, John B.; Allik, Toomas H.

2005-01-01

A comparative spectroscopic study is performed on Er 3+ (4f 11 ) ions doped in polycrystalline ceramic garnet Y 3 Al 5 O 12 (YAG) and single-crystal laser rod, both containing nominal 50 at. % of Er 3+ . The standard Judd-Ofelt (JO) model is applied to the room-temperature absorption intensities of Er 3+ (4f 11 ) transitions in both hosts to obtain the phenomenological intensity parameters. These parameters are subsequently used to determine the radiative decay rates, radiative lifetimes, and branching ratios of the Er 3+ transitions from the upper multiplet manifolds to the corresponding lower-lying multiplet manifolds 2S+1 L J of Er 3+ (4f 11 ) in these garnet hosts. The emission cross sections of the intermanifold Er 3+ 4 I 13/2 → 4 I 15/2 (1.5 μm) transition as well as the principal inter-Stark transition Y 1 →Z 4 (1550 nm) within the corresponding multiplet manifolds have been determined. The room-temperature fluorescence lifetimes of the 4 I 13/2 → 4 I 15/2 (1.5 μm) transition in both polycrystalline ceramic and single-crystal YAG samples were measured. From the radiative lifetimes determined from the JO model and the measured fluorescence lifetimes, the quantum efficiencies for both samples were determined. The comparative study of Er 3+ (4f 11 ) ions performed suggests that polycrystalline ceramic YAG is an excellent alternative to single-crystal YAG rod for certain applications

Probing nanoscale ferroelectricity by ultraviolet Raman spectroscopy.

Science.gov (United States)

Tenne, D A; Bruchhausen, A; Lanzillotti-Kimura, N D; Fainstein, A; Katiyar, R S; Cantarero, A; Soukiassian, A; Vaithyanathan, V; Haeni, J H; Tian, W; Schlom, D G; Choi, K J; Kim, D M; Eom, C B; Sun, H P; Pan, X Q; Li, Y L; Chen, L Q; Jia, Q X; Nakhmanson, S M; Rabe, K M; Xi, X X

2006-09-15

We demonstrated that ultraviolet Raman spectroscopy is an effective technique to measure the transition temperature (Tc) in ferroelectric ultrathin films and superlattices. We showed that one-unit-cell-thick BaTiO3 layers in BaTiO3/SrTiO3 superlattices are not only ferroelectric (with Tc as high as 250 kelvin) but also polarize the quantum paraelectric SrTiO3 layers adjacent to them. Tc was tuned by approximately 500 kelvin by varying the thicknesses of the BaTiO3 and SrTiO3 layers, revealing the essential roles of electrical and mechanical boundary conditions for nanoscale ferroelectricity.