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Keywords = bismuth layered ferroelectric structures

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15 pages, 19604 KiB  
Article
Simultaneously Achieved High Piezoelectricity and High Resistivity in Na0.5Bi4.5Ti4O15-Based Ceramics with High Curie Temperature
by Zhengli Huan, Ning Chang, Yunyun Feng, Xuan Fei, Xiang Xu and Huiming Ji
Materials 2024, 17(23), 5857; https://doi.org/10.3390/ma17235857 - 29 Nov 2024
Cited by 1 | Viewed by 815
Abstract
Good piezoelectricity and high resistivity are prerequisites for high-temperature acceleration sensors to function correctly in high-temperature environments. Bismuth layered structure ferroelectrics (BLSFs) are promising candidates for piezoelectric ceramics with excellent piezoelectric performance at high temperatures, high electrical resistivity, and high Curie temperatures ( [...] Read more.
Good piezoelectricity and high resistivity are prerequisites for high-temperature acceleration sensors to function correctly in high-temperature environments. Bismuth layered structure ferroelectrics (BLSFs) are promising candidates for piezoelectric ceramics with excellent piezoelectric performance at high temperatures, high electrical resistivity, and high Curie temperatures (Tc). In this study, (LiMn)5+ is substituted for Bi at the A-site, and Ce-doping is performed to replace Ti ions in Na0.5Bi4.5Ti4O15, which achieves the desired combination of high piezoelectric coefficients and high resistivity. Herein, we prepared Na0.5Bi3(LiMn)0.9Ti4−xCexO15 high-temperature piezoelectric ceramics, achieving a high piezoelectric coefficient d33 of 32.0 pC/N and a high resistivity ρ of 1.2 × 108 Ω·cm (at 500 °C), and a high Curie temperature of 648 °C. It is important that the d33 variation remains within 8% over a wide temperature range from 25 °C to 600 °C, demonstrating excellent thermal stability. Structural characterization and microstructure analysis showed that the excellent piezoelectric coefficient and high resistivity of cerium-doped Na0.5Bi4.5Ti4O15-based ceramics are attributable to the synergistic effects of structural characteristics, defect concentration, refined grain size and domain morphology. This study demonstrates that the superior properties of Na0.5Bi3(LiMn)0.9Ti4−xCexO15 ceramics are crucial for the stable operation of high-temperature accelerometer sensors and for the development of high-temperature devices. Full article
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15 pages, 7626 KiB  
Article
A DFT Study on the Structural, Electronic, Optical, and Elastic Properties of BLSFs XTi4Bi4O15 (X = Sr, Ba, Be, Mg) for Solar Energy Applications
by Ahmad Hussain, Fatima Kainat, Ameer Hamza, Adeela Naz, Nawishta Jabeen, Tuba Munawar and Muhammad Adnan Qaiser
Ceramics 2024, 7(4), 1727-1741; https://doi.org/10.3390/ceramics7040110 - 11 Nov 2024
Cited by 9 | Viewed by 1187
Abstract
For the first time, a theoretical investigation has been conducted into the structural, electrical, elastic, and optical properties of innovative bismuth-layered structure ferroelectric (BLSF) materials XTi4Bi4O15 (where X = Sr, Ba, Be, and Mg). For all of the [...] Read more.
For the first time, a theoretical investigation has been conducted into the structural, electrical, elastic, and optical properties of innovative bismuth-layered structure ferroelectric (BLSF) materials XTi4Bi4O15 (where X = Sr, Ba, Be, and Mg). For all of the calculations, PBE-GGA and the ultra-soft pseudopotential plane wave techniques have been implemented with the DFT-based CASTEP simulation tool. Based on the exchange correlation approximation, the calculations reveal that XTi4Bi4O15 (X = Sr, Ba, Be, and Mg) materials demonstrate direct band-gap semiconductor behavior with an estimated density functional fundamental gap in the range from 1.966 eV to 2.532 eV. The optical properties of these materials exhibit strong absorption and low reflection in the visible range. Moreover, the estimations of the elastic properties of the materials have shown mechanical stability and ductile behavior (due to B/G > 1.75), where G and B denote the shear modulus and the bulk modulus. Based on the above-mentioned highlights, it can be confidently stated that these materials are promising potential candidates for photovoltaic applications and solar cells due to their suitable direct band gap and high absorption coefficient. Full article
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14 pages, 4182 KiB  
Article
First-Principles Calculations of the Structural, Mechanical, Optical, and Electronic Properties of X2Bi4Ti5O18 (X = Pb, Ba, Ca, and Sr) Bismuth-Layered Materials for Photovoltaic Applications
by Ahmad Hussain, Fatima Kainat, Nawishta Jabeen, Ali Yaqoob, Tassawar Abbas, Muhammad Usman Khan, Muhammad Adnan Qaiser and M. H. H. Mahmoud
Crystals 2024, 14(10), 870; https://doi.org/10.3390/cryst14100870 - 2 Oct 2024
Cited by 7 | Viewed by 1357
Abstract
For the first time, density functional theory (DFT) calculations have been employed for the measurement of the structural, mechanical, optical, and electrical properties of a bismuth-layered structure ferroelectrics (BLSFs) family member possessing an orthorhombic structure with Cmc21 space group. Based on the [...] Read more.
For the first time, density functional theory (DFT) calculations have been employed for the measurement of the structural, mechanical, optical, and electrical properties of a bismuth-layered structure ferroelectrics (BLSFs) family member possessing an orthorhombic structure with Cmc21 space group. Based on the exchange–correlation approximation, our calculations show that Pb2Bi4Ti5O18 possesses an indirect band gap, while the materials X2Bi4Ti5O18 (X = Ba, Ca, and Sr) demonstrate direct band gap, where the estimated density functional fundamental band gap values lie between 1.84 to 2.33 eV, which are ideal for photovoltaic applications. The optical performance of these materials has been investigated by tuning the band gaps. The materials demonstrated outstanding optical characteristics, such as high absorption coefficients and low reflection. They exhibited impressive absorption coefficient (α = 105 cm−1) throughout a broad energy range, especially in the visible spectrum (105 cm−1 region). The findings show that the compounds demonstrate lower reflectivity in the visible and UV regions, making them suitable for single-junction photovoltaic cells and optoelectronic applications. The Voigt–Reuss–Hill averaging technique has been employed to derive elastic parameters like bulk modulus (B), Young’s modulus, shear modulus (G), the Pugh ratio (B/G) and the Frantesvich ratio (G/B) at 0.1 GPa. The mechanical stability of the compounds was analyzed using the Born stability criteria. Pugh’s ratio and Frantesvich’s ratio show that all the compounds are ductile, making them ideal for flexible optical applications. Full article
(This article belongs to the Section Inorganic Crystalline Materials)
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12 pages, 12974 KiB  
Article
Effect of Ca, Ba, Be, Mg, and Sr Substitution on Electronic and Optical Properties of XNb2Bi2O9 for Energy Conversion Application Using Generalized Gradient Approximation–Perdew–Burke–Ernzerhof
by Fatima Kainat, Nawishta Jabeen, Ali Yaqoob, Najam Ul Hassan, Ahmad Hussain and Mohamed E. Khalifa
Crystals 2024, 14(8), 710; https://doi.org/10.3390/cryst14080710 - 7 Aug 2024
Cited by 9 | Viewed by 1159
Abstract
Bismuth layered structure ferroelectrics (BLSFs), also known as Aurivillius phase materials, are ideal for energy-efficient applications, particularly for solar cells. This work reports the first comprehensive detailed theoretical study on the fascinating structural, electronic, and optical properties of XNb2Bi2O [...] Read more.
Bismuth layered structure ferroelectrics (BLSFs), also known as Aurivillius phase materials, are ideal for energy-efficient applications, particularly for solar cells. This work reports the first comprehensive detailed theoretical study on the fascinating structural, electronic, and optical properties of XNb2Bi2O9 (X = Ca, Ba, Be, Mg, Sr). The Perdew–Burke–Ernzerhof approach and generalized gradient approximation (GGA) are implemented to thoroughly investigate the structural, bandgap, optical, and electronic properties of the compounds. The optical conductivity, band topologies, dielectric function, bandgap values, absorption coefficient, reflectivity, extinction coefficient, refractive index, and partial and total densities of states are thoroughly investigated from a photovoltaics standpoint. The material exhibits distinct behaviors, including significant optical anisotropy and an elevated absorption coefficient > 105 cm−1 in the region of visible; ultraviolet energy is observed, the elevated transparency lies in the visible and infrared regions for the imaginary portion of the dielectric function, and peaks in the optical spectra caused by inter-band transitions are detected. According to the data reported, it becomes obvious that XNb2Bi2O9 (X = Ca, Ba, Be, Mg, and Sr) is a suitable candidate for implementation in solar energy conversion applications. Full article
(This article belongs to the Section Materials for Energy Applications)
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12 pages, 6863 KiB  
Article
Boosting of Magnetic, Ferroelectric, Energy Storage Efficiency, and Piezoelectric Properties of Zn Intercalated SrBi4Ti4O15-Based Ceramics
by Nawishta Jabeen, Altaf Ur Rehman, Najam Ul Hassan, Muhammad Adnan Qaiser, Anum Zaidi, Muhammad Usman Khan, Imtiaz Ahmad Khan and Muhammad Nouman
Materials 2022, 15(14), 5057; https://doi.org/10.3390/ma15145057 - 20 Jul 2022
Cited by 7 | Viewed by 2036
Abstract
An appropriate amount of Zn-ions are incorporated into the high Curie temperature bismuth layer-structure ferroelectric material to fabricate Sr0.2Na0.4Pr0.4Bi4Ti4O15:xwt%ZnO; (SNPBT:xZn), with x = 0, 0.10, 0.15, and [...] Read more.
An appropriate amount of Zn-ions are incorporated into the high Curie temperature bismuth layer-structure ferroelectric material to fabricate Sr0.2Na0.4Pr0.4Bi4Ti4O15:xwt%ZnO; (SNPBT:xZn), with x = 0, 0.10, 0.15, and 0.20 ceramic series to investigate the magnetic, ferroelectric, and energy storage efficiency and piezoelectric properties. Pure SNPBT and SNPBT:xZn ceramics have maintained their structure even after the intercalation of Zn-ions at the lattice sites of SNPBT. The addition of ZnO in SNPBT has improved the multifunctional properties of the material at x = 0.15. At room temperature, SNPBT:0.15Zn has shown a high relative density of 96%, exhibited weak ferromagnetic behavior along with a low saturation magnetization (Ms) of 0.028 emu/g with a low coercive field of 306 Oe, a high remnant polarization (Pr) of 9.04 µC/cm2, a recoverable energy density (Wrec) of ~0.5 J/cm3, an energy conversion efficiency (η) of ~41%, a high piezoelectric co-efficient (d33) of 21 pC/N, and an impedance of 1.98 × 107 Ω, which are much improved as compared to pure SBT or pure SNPBT ceramics. Dielectric Constant (ɛr) versus temperature plots present the sharp peak for SNPBT:0.15Zn ceramic at a Curie temperature (TC) ~ 605 °C, confirming the strong ferroelectric nature of the ceramic. Moreover, SNPBT:0.15Zn ceramic has shown strong, piezoelectric, thermally stable behavior, which remains at 76% (16 pC/N) of its initial value even after annealing at 500 °C. The achieved results clearly indicate that SNPBT:0.15Zn ceramic is a promising candidate for future wide-temperature pulse power applications and high-temperature piezoelectric devices. Full article
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18 pages, 3129 KiB  
Article
Aurivillius Oxides Nanosheets-Based Photocatalysts for Efficient Oxidation of Malachite Green Dye
by David A. Collu, Cristina Carucci, Marco Piludu, Drew F. Parsons and Andrea Salis
Int. J. Mol. Sci. 2022, 23(10), 5422; https://doi.org/10.3390/ijms23105422 - 12 May 2022
Cited by 15 | Viewed by 2873
Abstract
Aurivillius oxides ferroelectric layered materials are formed by bismuth oxide and pseu-do-perovskite layers. They have a good ionic conductivity, which is beneficial for various photo-catalyzed reactions. Here, we synthesized ultra-thin nanosheets of two different Aurivillius oxides, Bi2WO6 (BWO) and Bi [...] Read more.
Aurivillius oxides ferroelectric layered materials are formed by bismuth oxide and pseu-do-perovskite layers. They have a good ionic conductivity, which is beneficial for various photo-catalyzed reactions. Here, we synthesized ultra-thin nanosheets of two different Aurivillius oxides, Bi2WO6 (BWO) and Bi2MoO6 (BMO), by using a hard-template process. All materials were characterized through XRD, TEM, FTIR, TGA/DSC, DLS/ELS, DRS, UV-Vis. Band gap material (Eg) and potential of the valence band (EVB) were calculated for BWO and BMO. In contrast to previous reports on the use of multi composite materials, a new procedure for photocatalytic efficient BMO nanosheets was developed. The procedure, with an additional step only, avoids the use of composite materials, improves crystal structure, and strongly reduces impurities. BWO and BMO were used as photocatalysts for the degradation of the water pollutant dye malachite green (MG). MG removal kinetics was fitted with Langmuir—Hinshelwood model obtaining a kinetic constant k = 7.81 × 10−2 min−1 for BWO and k = 9.27 × 10−2 min−1 for BMO. Photocatalytic dye degradation was highly effective, reaching 89% and 91% MG removal for BWO and BMO, respectively. A control experiment, carried out in the absence of light, allowed to quantify the contribution of adsorption to MG removal process. Adsorption contributed to MG removal by a 51% for BWO and only by a 19% for BMO, suggesting a different degradation mechanism for the two photocatalysts. The advanced MG degradation process due to BMO is likely caused by the high crystallinity of the material synthetized with the new procedure. Reuse tests demonstrated that both photocatalysts are highly active and stable reaching a MG removal up to 95% at the 10th reaction cycle. These results demonstrate that BMO nanosheets, synthesized with an easy additional step, achieved the best degradation performance, and can be successfully used for environmental remediation applications. Full article
(This article belongs to the Collection Feature Papers in 'Physical Chemistry and Chemical Physics')
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12 pages, 1746 KiB  
Article
Lead-Free BiFeO3 Thin Film: Ferroelectric and Pyroelectric Properties
by Mihaela Botea, Cristina Chirila, Georgia Andra Boni, Iuliana Pasuk, Lucian Trupina, Ioana Pintilie, Luminiţa Mirela Hrib, Becherescu Nicu and Lucian Pintilie
Electron. Mater. 2022, 3(2), 173-184; https://doi.org/10.3390/electronicmat3020015 - 1 Apr 2022
Cited by 8 | Viewed by 5528
Abstract
The ferroelectric and pyroelectric properties of bismuth ferrite (BFO) epitaxial thin film have been investigated. The ferroelectric epitaxial thin layer has been deposited on strontium titanate (STO) (001) substrate by pulsed laser deposition, in a capacitor geometry using as top and bottom electrode [...] Read more.
The ferroelectric and pyroelectric properties of bismuth ferrite (BFO) epitaxial thin film have been investigated. The ferroelectric epitaxial thin layer has been deposited on strontium titanate (STO) (001) substrate by pulsed laser deposition, in a capacitor geometry using as top and bottom electrode a conductive oxide of strontium ruthenate (SRO). The structural characterizations performed by X-ray diffraction and atomic force microscopy demonstrate the epitaxial character of the ferroelectric thin film. The macroscopic ferroelectric characterization of BFO revealed a rectangular shape of a polarization-voltage loop with a remnant polarization of 30 μC/c m2 and a coercive electric field of 633 KV/cm at room temperature. Due to low leakage current, the BFO capacitor structure could be totally pooled despite large coercive fields. A strong variation of polarization is obtained in 80–400 K range which determines a large pyroelectric coefficient of about 10−4 C/m2 K deduced both by an indirect and also by a direct method. Full article
(This article belongs to the Special Issue Electronic Processes in Ferroelectrics)
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13 pages, 4151 KiB  
Article
Excellent Energy Storage Performance in Bi(Fe0.93Mn0.05Ti0.02)O3 Modified CaBi4Ti4O15 Thin Film by Adjusting Annealing Temperature
by Tong Liu, Wenwen Wang, Jin Qian, Qiqi Li, Mengjia Fan, Changhong Yang, Shifeng Huang and Lingchao Lu
Nanomaterials 2022, 12(5), 730; https://doi.org/10.3390/nano12050730 - 22 Feb 2022
Cited by 13 | Viewed by 2524
Abstract
Dielectric capacitors with ultrahigh power density are highly desired in modern electrical and electronic systems. However, their comprehensive performances still need to be further improved for application, such as recoverable energy storage density, efficiency and temperature stability. In this work, new lead-free bismuth [...] Read more.
Dielectric capacitors with ultrahigh power density are highly desired in modern electrical and electronic systems. However, their comprehensive performances still need to be further improved for application, such as recoverable energy storage density, efficiency and temperature stability. In this work, new lead-free bismuth layer-structured ferroelectric thin films of CaBi4Ti4O15-Bi(Fe0.93Mn0.05Ti0.02)O3 (CBTi-BFO) were prepared via chemical solution deposition. The CBTi-BFO film has a small crystallization temperature window and exhibits a polycrystalline bismuth layered structure with no secondary phases at annealing temperatures of 500–550 °C. The effects of annealing temperature on the energy storage performances of a series of thin films were investigated. The lower the annealing temperature of CBTi-BFO, the smaller the carrier concentration and the fewer defects, resulting in a higher intrinsic breakdown field strength of the corresponding film. Especially, the CBTi-BFO film annealed at 500 °C shows a high recoverable energy density of 82.8 J·cm−3 and efficiency of 78.3%, which can be attributed to the very slim hysteresis loop and a relatively high electric breakdown strength. Meanwhile, the optimized CBTi-BFO film capacitor exhibits superior fatigue endurance after 107 charge–discharge cycles, a preeminent thermal stability up to 200 °C, and an outstanding frequency stability in the range of 500 Hz–20 kHz. All these excellent performances indicate that the CBTi-BFO film can be used in high energy density storage applications. Full article
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10 pages, 3399 KiB  
Article
Spontaneous Growth of CaBi4Ti4O15 Piezoelectric Crystal Using Mixed Flux Agents
by Mengdi Fan, Guangda Wu, Fapeng Yu, Lili Li, Yanlu Li, Xiufeng Cheng and Xian Zhao
Crystals 2020, 10(8), 698; https://doi.org/10.3390/cryst10080698 - 12 Aug 2020
Cited by 6 | Viewed by 3483
Abstract
The bismuth layer-structured ferroelectrics (BLSFs) materials have potential for high-temperature piezoelectric applications. Among these piezoelectric materials, the CaBi4Ti4O15 (CBT) piezoelectric ceramic with a high decomposition temperature of about 1250 °C attracts a lot of attention. Achieving a CBT [...] Read more.
The bismuth layer-structured ferroelectrics (BLSFs) materials have potential for high-temperature piezoelectric applications. Among these piezoelectric materials, the CaBi4Ti4O15 (CBT) piezoelectric ceramic with a high decomposition temperature of about 1250 °C attracts a lot of attention. Achieving a CBT single crystal is a significant way to improve its piezoelectric properties. For this purpose, the flux system for growing CBT crystal was explored in this study. The optimum flux composition ratio was found to be PbO:B2O3:CBT = 3:3:1 in mol%, where the PbO–B2O3 mixtures were used as a flux system. Millimeter size flake-shaped CBT crystals were obtained using the spontaneous growth process for the first time. The relationship between the crystal structure and flake growth habit was analyzed. In addition, the bandgap was evaluated by the combination of transmittance spectrum and first-principle calculations. Besides, the piezoelectric property was predicted from the perspective of polyhedral distortion, which indicated the potential of CBT crystal for piezoelectric applications. Full article
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16 pages, 4460 KiB  
Article
PZT/PZT and PZT/BiT Composite Piezo-Sensors in Aerospace SHM Applications: Photochemical Metal Organic + Infiltration Deposition and Characterization
by Hamidreza Hoshyarmanesh, Nafiseh Ebrahimi, Amir Jafari, Parisa Hoshyarmanesh, Minjae Kim and Hyung-Ho Park
Sensors 2019, 19(1), 13; https://doi.org/10.3390/s19010013 - 20 Dec 2018
Cited by 26 | Viewed by 7188
Abstract
The composition of fine-ground lead zirconate-titanate powder Pb(Zr0.52Ti0.48)O3, suspended in PZT and bismuth titanate (BiT) solutions, is deposited on the curved surface of IN718 and IN738 nickel-based supper alloy substrates up to 100 µm thickness. Photochemical metal [...] Read more.
The composition of fine-ground lead zirconate-titanate powder Pb(Zr0.52Ti0.48)O3, suspended in PZT and bismuth titanate (BiT) solutions, is deposited on the curved surface of IN718 and IN738 nickel-based supper alloy substrates up to 100 µm thickness. Photochemical metal organic and infiltration techniques are implemented to produce smooth, semi-dense, and crack-free random orientated thick piezoelectric films as piezo-sensors, free of any dopants or thickening polymers. Every single layer of the deposited films is heated at 200 °C with 10 wt.% excess PbO, irradiated by ultraviolet lamp (365 nm, 6 watt) for 10 min, pyrolyzed at 400 °C, and subsequently annealed at 700 °C for one hour. This process is repeated successively until reaching the desired thickness. Au and Pt thin films are deposited as the bottom and top electrodes using evaporation and sputtering methods, respectively. PZT/PZT and PZT/BiT composite films are then characterized and compared to similar PZT and BiT thick films deposited on the similar substrates. The effect of the composition and deposition process is also investigated on the crystalline phase development and microstructure morphology as well as the dielectric, ferroelectric, and piezoelectric properties of piezo-films. The maximum remnant polarization of Pr = 22.37 ± 0.01, 30.01 ± 0.01 µC/cm2, the permittivity of εr = 298 ± 3, 566 ± 5, and piezoelectric charge coefficient of d33 = 126, 148 m/V were measured versus the minimum coercive field of Ec = 50, 20 kV/cm for the PZT/PZT and PZT/BiT thick films, respectively. The thick film piezo-sensors are developed to be potentially used at frequency bandwidth of 1–5 MHz for rotary structural health monitoring and also in other industrial or medical applications as a transceiver. Full article
(This article belongs to the Special Issue Intelligent Sensors Applications in Aerospace)
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16 pages, 7719 KiB  
Review
Review and Perspectives of Aurivillius Structures as a Lead-Free Piezoelectric System
by Alberto Moure
Appl. Sci. 2018, 8(1), 62; https://doi.org/10.3390/app8010062 - 3 Jan 2018
Cited by 118 | Viewed by 9050
Abstract
According to the EU-Directives 2002/95/EC, 2002/96/EC, lead-based piezoceramics must be substituted in the future with more environmentally friendly alternatives, only when a reliable alternative is found. This is why an increasing interest has grown in the research community to find lead free piezoelectric [...] Read more.
According to the EU-Directives 2002/95/EC, 2002/96/EC, lead-based piezoceramics must be substituted in the future with more environmentally friendly alternatives, only when a reliable alternative is found. This is why an increasing interest has grown in the research community to find lead free piezoelectric materials that fulfil the requirements for this substitution. Different families of compounds have been shown to be possible candidates for this use, such as bismuth and niobates based perovskites, pyrochlores, etc. However, a material with piezoelectric coefficients similar to those of PZT (lead zirconate titanate, Pb[ZrxTi1-x]O3) has not been yet found. Besides, each of these families has its specific characteristics in terms of remnant polarization, coercive field or application temperature. Thus, the choice of each material should be made according to the specific needs of the application. In this sense, Aurivillius-type structure materials (also known as Bismuth Layered Structure Ferroelectrics, BLSF) can take advantage of their specific properties for uses as Lead Free Piezoelectric systems. Some of them have a high Curie temperature, which make them good candidates to be used as high temperature piezoelectrics; high coercive fields, which facilitates their use as actuators; or a high switching fatigue resistance, which can be useful for future applications as Ferroelectric Random Access Memories (FERAM). Full article
(This article belongs to the Special Issue A Perspective on the Design of Lead-Free Piezoceramics)
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