The mutual coupling of structure and magnetism is crucial for Heusler alloys.In this paper,Ni_(50)Mn_(34)Sb_(16-x)Ga_(x)(0≤x≤16)alloys were prepared by arc melting.Based on the test results of structure and magnetis...The mutual coupling of structure and magnetism is crucial for Heusler alloys.In this paper,Ni_(50)Mn_(34)Sb_(16-x)Ga_(x)(0≤x≤16)alloys were prepared by arc melting.Based on the test results of structure and magnetism,the magnetic-structural phase diagram of Ni_(50)Mn_(34)Sb_(16-x)Ga_(x)(0≤x≤16)was drawn.The structure changes from cubic to monoclinic and finally to tetragonal as the x increases at room temperature.Its phase diagram shows a morphotropic phase boundary(MPB)starting from a tricritical triple point(around the Ni_(50)Mn_(34)Sb_(5)Ga_(11)alloy)of a cubic paramagnetic phase,ferromagnetic monoclinic,and antiferromagnetic tetragonal phases.And Ni_(50)Mn_(34)Sb_(5)Ga_(11)alloy has experienced five different phase states:paramagnetic austenite→ferromagnetic austenite→antiferromagnetic martensite→ferromagnetic martensite→spin glass as the temperature decreased.Further study of the alloys’magnetostrictive properties near the MPB showed that as x increases,a negative strain initially appears,followed by a W-type that crosses negative and positive strains,and then a positive strain.This is caused by the inconsistency in the speed and degree of magnetic domain walls response with monoclinic and tetragonal coexisting structures.This indicates that coupling between structure and magnetism is critical to the properties of materials.This work provides valuable insights into the magnetostrictive behavior and structural evolution of Heusler alloys,particularly in the context of MPB systems,and offers guidance for the design and optimization of material properties through controlled magnetic-structural interactions.Kindly check and confirm the edit made in the title.The edit made in the title has been confirmed to be accurate.展开更多
The flourishing development of emerging electromechanical applications has stimulated an urgent demand for ferroelectric ceramics with high piezoelectric properties and broad temperature usage range.However,it remains...The flourishing development of emerging electromechanical applications has stimulated an urgent demand for ferroelectric ceramics with high piezoelectric properties and broad temperature usage range.However,it remains a challenge to simultaneously obtain good piezoelectricity and reliable temperature stability in lead zirconate titanate(PZT)-based piezoelectric ceramics.To solve this issue,a synergetic strategy was proposed to introduce lead vacancies through niobium doping and construct morphotropic phase boundary(MPB).In this work,Pb_(0.905)Ba_(0.085)(V Pb″)_(0.01)[(Zr_(x)Ti_(1-x))_(0.98)Nb_(0.02)]O_(3)(PBZTN-x)material system was designed.Good comprehensive properties(d_(33)=864 pC/N,k_(p)=84%,T_(C)=201℃)and excellent temperature stability(less than 10%variation of electrical properties from 20℃ to 160℃)were obtained in PBZTN-0.540 ceramics.Good piezoelectricity can be attributed to high extrinsic contribution(domain wall motion)induced by Pb^(2+)vacancies and the existence of nano-domains emerged at MPB,while excellent temperature stability is mainly attributed to the minimized local stress in the lattice and the stable domain structure.展开更多
Computer modeling and simulation for the Pb（Zr1-x Tix ）O3 （PZT） system reveal the role of polar anisotropy on the giant anhysteretic response and structural properties of morphotropic phase boundary （MPB） ferroe...Computer modeling and simulation for the Pb（Zr1-x Tix ）O3 （PZT） system reveal the role of polar anisotropy on the giant anhysteretic response and structural properties of morphotropic phase boundary （MPB） ferroelectrics. It is shown that a drastic reduction of the compositiondependent polar anisotropy near the MPB flattens energy surfaces and thus facilitates reversible polarization rotation. It is further shown that the polar anisotropy favors formation of polar domains, promotes phase decomposition and results in a two-phase multidomain state, which response to applied electric field is anhysteretic when the polar domain reorientation is only caused by polarization rotation other than polar domain wall movement. This is the case for the decomposing ferroelectrics under a poling electric field with the formation of a two-phase multidomain microstructure, wherein most domain walls are pinned at the two-phase boundaries. Indication of the microstructure dependence of the anhysteretic strain response opens new avenues to improve the piezoelectric properties of these materials through the microstructure engineering.展开更多
Potassium Sodium Bismuth Titanate (KNBT) ceramics, with the general formula (1 - x)K0.5Bi0.5TiO3 -xNa0.5Bi0.5TiO3, have been synthesized following hydrothermal route, starting with solid solutions of pure perovskite n...Potassium Sodium Bismuth Titanate (KNBT) ceramics, with the general formula (1 - x)K0.5Bi0.5TiO3 -xNa0.5Bi0.5TiO3, have been synthesized following hydrothermal route, starting with solid solutions of pure perovskite nanoceramics of KBT and NBT in desired stoichiometric weight ratios, followed by sintering between 850°C and 1000°C for few hours. Pure KNBT nanoceramics with perovskite structure, having mean particle size around 30 nm, could be obtained. Morphology of the samples is found to depend strongly on composition. A change of composition results in a phase change, as evident from X-ray structure analysis. This phase change is a result of rhombohedral to tetragonal morphotropic phase boundary (MPB) in the sample with x around 0.80. Composition dependent occurrence of MPB leads to formation of needle like structures with micrometer length scales. These are typical of tetragonal lamellar structures, suggesting partial induction of tetragonal polar order from rhombohedral structure at MPB. Dielectric and piezoelectric properties, such as dielectric constant and loss, piezoelectric coefficients and figures of merit, exhibit threshold maxima in their values at the composition corresponding to MPB. These values reported for a lead-free piezoceramic, synthesized by a comparatively simple hydrothermal route, are highly promising, and comparable to well-known PZT.展开更多
Morphotropic phase boundary(MPB)-based ceramics are excellent for energy harvesting due to their enhanced physical properties at phase boundaries,broad operating temperature range,and ability to customize properties f...Morphotropic phase boundary(MPB)-based ceramics are excellent for energy harvesting due to their enhanced physical properties at phase boundaries,broad operating temperature range,and ability to customize properties for efficient conversion of mechanical energy into electrical energy.In this work,Bi_(1–x)Na_(x)Fe_(1–x)Nb_(x)O_(3)(x=0.20,0.30,0.32 and 0.40,BNFNO abbreviation)based ceramics were synthesized using a solid-state route and blended with Polydimethylsiloxane(PDMS)to achieve flexible composites.Various material characterization and energy harvesting were performed by designing a hybrid piezoelectric(PENG)-triboelectric(TENG)device.The voltage and current of PENG,TENG,and hybrid bearing same device area(2 cm×2 cm)were recorded as 11 V/0.3μA;60 V/0.7μA;110 V/2.2μA.The strategies for enhancing the output performance of the hybrid device were evaluated,such as increased surface area(creating micro-roughness and porous morphology)and increasing electrode size and multi-layer hybrid device formation.The self-powered acceleration monitoring was demonstrated using the hybrid device.Further,the low-frequency-based wave energy is converted into electrical energy,confirming the usage of hybrid PENG-TENG devices as a base for battery-free sensors and blue energy harvesting.展开更多
In this work,the rare-earth doped ternary lead zirconate titanate ceramics with chemical formula of[0.3 Pb(Zn_(1/3)Nb_(2/3))O_(3)-0.7Pb(Zr_(0.52)Ti_(0.48))O_(3)]+x wt%CeO_(2)(x=0-0.5,abbreviated as 0.3PZN-0.7PZT-xCe)w...In this work,the rare-earth doped ternary lead zirconate titanate ceramics with chemical formula of[0.3 Pb(Zn_(1/3)Nb_(2/3))O_(3)-0.7Pb(Zr_(0.52)Ti_(0.48))O_(3)]+x wt%CeO_(2)(x=0-0.5,abbreviated as 0.3PZN-0.7PZT-xCe)were synthesized by a conventional solid-state reaction route,specific attentions was focused on the effects of CeO_(2)dopants on the structures and electrical properties of the 0.3PZN-0.7PZT ceramics,revealing the role conve rsion of CeO_(2)dopants with its doping amount(x).When less CeO_(2)(x≤0.2)is introduced into 0.3PZN-0.7PZT,the prepared ceramics are identified as the coexistence of rhombohedral and tetragonal phases,also involved with an increased grain size and a reduced atomic ratio of Pb/(Zr+Ti+Zn+Nb).The increased remanent polarization(Pr)and deceased coercive filed(Ec),as well as improved dielectric permittivity(er)and piezoelectric coefficient(d_(33))de monstrate the donor substitution of Ce^(3+)for Pb^(2+)at the A-site of perovskite lattice.Conversely,the introduction of excessive CeO_(2)(x>0.2)causes a reversal evolution in the electrical properties of ceramics,suggesting that some of the introduced cerium element tends to become Ce4+,which equivalently substitutes for Zr^(4+)at the B-site.Additionally,the diffused phase transition(DPT)behaviors of the 0.3PZN-0.7PZT-xCe ceramics were investigated by the modified Curie-Weiss Law.The sample with x=0.2 shows reduced DPT character and optimized electrical properties,including TC=297℃,εr=1400,d_(33)=480 pC/N,tanδ=1.6%,kp=65%,d_(33)·g_(33)=16.32×10^(-12)m^(2)/N,Pr=38.3μC/cm^(2)and Ec=1.02 kV/mm.These enhanced electrical properties not only are contributed by the donor substitution effect of Ce^(3+),but also benefit from the optimized morphotropic phase boundary that is close to the tetragonal-rich side.展开更多
Controlling the properties of piezoelectric thin films is a key aspect for designing highly efficient flexible electromechanical devices. In this stud）~ the crystallographic phenomena of PbZr1-xTixO3 （PZT） thin fil...Controlling the properties of piezoelectric thin films is a key aspect for designing highly efficient flexible electromechanical devices. In this stud）~ the crystallographic phenomena of PbZr1-xTixO3 （PZT） thin films caused by distinguished interfacial effects are deeply investigated by overlooking views, including not only an experimental demonstration but also ab initio modeling. The polymorphic phase balance and crystallinity, as well as the crystal orientation of PZT thin films at the morphotropic phase boundary （MPB）, can be stably modulated using interfacial crystal structures. Here, interactions with MgO stabilize the PZT crystallographic system well and induce the texturing influences, while the PZT film remains quasi-stable on a conventional A1203 wafer. On the basis of this fundamental understanding, a high-output flexible energy harvester is developed using the controlled-PZT system, which shows significantly higher performance than the unmodified PZT generator. The voltage, current, and power densities are improved by 556%, 503%, and 822%, respectively, in comparison with the previous flexional single-crystalline piezoelectric device. Finally, the improved flexible generator is applied to harvest tiny vibrational energy from a real traffic system, and it is used to operate a commercial electronic unit. These results clearly indicate that atomic-scale designs can produce significant impacts on macroscopic applications.展开更多
The dielectric properties of Pb(Zn1/3Nb2/3)O3-PbZrO3-PbTiO3 (PZN-PZ-PT) system near the rhombohedral/tetragonal morphotropic phase boundary (MPB) are carefully studied in this paper.It is found that,for all samples,th...The dielectric properties of Pb(Zn1/3Nb2/3)O3-PbZrO3-PbTiO3 (PZN-PZ-PT) system near the rhombohedral/tetragonal morphotropic phase boundary (MPB) are carefully studied in this paper.It is found that,for all samples,the curves around the temperatures of dielectric permittivity peak show the characteristics of diffuse phase transition.The change in PbZrO3/PbTiO3 ratio has much influence on the dielectric properties of the samples.The extent of diffuse phase transition increases with the increasing Zr/Ti ratio.The samples in rhombohedral region have typical diffuse phase transition in the temperature range measured.However,for the samples with tetragonal symmetry,a spontaneous normal ferroelectric-relaxor phase transition exists at temperature lower than that of permittivity peak.This normal ferroelectric-relaxor phase transition is confirmed by the experiment of thermally driven current.The analysis of TEM reveals that the samples in tetragonal region show a 90° macrodomain structure,while the samples in rhombohedral region have the configuration of microdomain structure.展开更多
A morphotropic phase boundary(MPB)with temperature-independent behavior,the so-called vertical MPB was investigated in lead-free(K,Na,Li)NbO_(3)–BaZrO_(3)–(La,Na)TiO_(3)ternary ceramic system.The specimens were synt...A morphotropic phase boundary(MPB)with temperature-independent behavior,the so-called vertical MPB was investigated in lead-free(K,Na,Li)NbO_(3)–BaZrO_(3)–(La,Na)TiO_(3)ternary ceramic system.The specimens were synthesized by a conventional solid-state reaction method,and their crystal structures as well as their MPB were determined from X-ray diffraction patterns measured from room temperature to 300℃.The vertical MPB composition was determined to be 0.9025(K_(0:45)Na0:5Li_(0:05))NbO_(3)–0.09BaZrO_(3)–0.0075(La,Na)TiO_(3)and the Curie temperature was found to be about 195℃.It was successfully confirmed that ceramic samples of this system could be sintered in a reducing atmosphere.For lead-free piezoceramic applications of multilayer actuators using Ni inner electrodes,the results obtained in this work have important practical implications.展开更多
New lead-free piezoceramic nanocomposites of Boron Sodium Gadolinium Niobate(BNGN),with general formula(1-x)B_(0.5)Na_(0.5)GdO3xB_(0.5)Na_(0.5)NbO_(3),exhibiting a Morphotropic Phase Boundary(MPB),have been synthesize...New lead-free piezoceramic nanocomposites of Boron Sodium Gadolinium Niobate(BNGN),with general formula(1-x)B_(0.5)Na_(0.5)GdO3xB_(0.5)Na_(0.5)NbO_(3),exhibiting a Morphotropic Phase Boundary(MPB),have been synthesized following hydrothermal method followed by solid state sintering.The occurrence of MPB at the composition with x=0.55,at which rhombohedral and monoclinic phases are found to coexist,has been confirmed using powder XRD.This accounts for the occurrence of large remnant polarization when the sintered ceramic pellets are subjected to electric poling at 2KV/mm.Uniform microstructure of various compositions is confirmed by SEM imaging.Dielectric and piezoelectric properties of the samples are found to be comparable to those of commercial grade PZT.At the MPB,the d_(33)coefficient is found to be 556 pC/N,which is close to that of commercial grade PZT,which makes BNGN a promising material to substitute lead containing PZT in the near future.展开更多
Presented results demonstrate importance of taking into account such a phenomenon as the solid solution decomposition at the boundaries separating coexisting phases in lead zirconate-titanate-based solid solutions wit...Presented results demonstrate importance of taking into account such a phenomenon as the solid solution decomposition at the boundaries separating coexisting phases in lead zirconate-titanate-based solid solutions with compositions belonging to the morphotropic boundary region of the"temperature–composition"phase diagram.It is shown that in the local decomposition of solid solutions in the vicinity of the boundaries separating the tetragonal and rhombohedral phases in lead zirconate-titanate-based solid solutions lead to the changes of the solid solution's chemical composition and to the formation of segregates.It is also shown that the proper thermoelectric treatment of samples containing these segregates can give substantially higher values of piezoelectric parameters in the lead zirconate-titanate-based compounds.展开更多
Due to the thermal depolarization effect,adequate piezoelectric performance with high operating temperature is regarded to be challenging to accomplish concurrently in piezoceramics for applications in specific piezoe...Due to the thermal depolarization effect,adequate piezoelectric performance with high operating temperature is regarded to be challenging to accomplish concurrently in piezoceramics for applications in specific piezoelectric devices.In this work,we synthesized(0.8−x)BiFeO_(3)-x PbTi_(3)-0.2Ba(Zr_(0.25)Ti_(0.75))O_(3)(abbreviated as BFO-x PT-BZT)ternary solid solutions with 0.15≤x≤0.30 by conventional solid-state reaction method.The MPB composition with a coexisting state of rhombohedral-tetragonal phases exhibits enhanced electromechanical properties,including Curie temperature of 380℃,large-signal equivalent piezoelectric coefficient d^(∗)_(33)of 395 pm V^(-1),small-signal piezoelectric coefficient d_(33)of 302 pC N^(-1),and electromechanical coupling factor k_(p)of 50.2%,which is comparable to commercial PZT-5A ceramics,indicating potential in high-temperature applications.Furthermore,in-situ X-ray diffraction(XRD)and piezoelectric force microscopic(PFM)techniques demonstrate that multiphase coexistence and complex nanodomains promote piezoelectric response via synergism.The x=0.24 composition exhibits the highest in-situ d_(33)of 577 pC N^(-1)and good temperature stability in 30−280℃,indicating that BZT-modified BFO-PT ceramics are promising candidates for high-temperature piezoelectric devices.展开更多
Quinary system piezoelectric ceramics PSN-PZN-PMS-PZT were prepared by using a two-step method. The effects of CeO2 doping on piezoelectric and dielectric properties of the system were investigated at morphotropic pha...Quinary system piezoelectric ceramics PSN-PZN-PMS-PZT were prepared by using a two-step method. The effects of CeO2 doping on piezoelectric and dielectric properties of the system were investigated at morphotropic phase boundary （MPB）. The results reveal that the relative dielectric constant ε33^T｜ε0, the Curie temperature To, the piezoelectric constant d33, the mechanical quality factor Qm, and the electromechanical coupling coefficient Kp are changed with the increase of CeO2 content. On the other hand, the effects of CeO2 doping on the dielectric properties of PSN-PZN-PMS-PZT piezoelectric ceramics at high electric field are consistent with the change at weak electric field. The values of dielectric constant and dielectric loss are enhanced with the increasing of electric field.展开更多
Piezoelectric ceramic based high-temperature acoustic emission(AE)sensor is required urgently in the structural health monitoring of high-temperature fields.In this research,a series of 0.45(BiSc_(x)O_(3)-BiFe_(1-x)O_...Piezoelectric ceramic based high-temperature acoustic emission(AE)sensor is required urgently in the structural health monitoring of high-temperature fields.In this research,a series of 0.45(BiSc_(x)O_(3)-BiFe_(1-x)O_(3))-0.48PbTiO_(3)-0.07BaTiO_(3)(BSc_(x)Fe_(1-x)-PT-BT,n(Sc)/n(Fe)=0.4/0.6-0.6/0.4)ceramics with both high Curie temperature and large piezoelectric constant were presented.The structure and electrical properties of BSc_(x)Fe_(1-x)-PT-BT ceramics as a function of n(Sc)/n(Fe)have been systematically investigated.All the ceramics possess a perovskite structure,and the phase approaches from the rhombohedral toward the tetragonal phase with the decrease of n(Sc)/n(Fe).The BSc_(0.5)Fe_(0.5)-PT-BT and BSc_(0.5)Fe_(0.5)-PT-BT piezoelectric ceramics exhibit good piezoelectricity(d_(33)=250-281 pC/N),high Curie temperature(T_(C)=430-450℃)and excellent temperature stability.These improvements are greatly attributed to the balance between rhombohedral and tetragonal phase near morphotropic phase boundary with dense microstructure of ceramics.AE sensor based BSc_(0.5)Fe_(0.5)-PT-BT piezoelectric ceramic was designed,prepared and tested.The high-temperature stability of AE sensor was characterized through pencil-lead breaking with in situ high-temperature test.The noise of AE sensor is less than 40 dB,and the acoustic signal is up to 90 dB at 200℃.As a result,AE sensors based on BSc_(x)Fe_(1-x)-PT-BT piezoelectric ceramics are expected to be applied into the structural health monitoring of high temperature fields.展开更多
MgO-modified Li0.06（Na0.5K0.5）0.94NbO3O3 （L6NKN） lead-free piezoelectric ceramics were synthesized by normal sintering at a rela- tively low temperature of 1000℃. The crystalline phase, microstructure, and electr...MgO-modified Li0.06（Na0.5K0.5）0.94NbO3O3 （L6NKN） lead-free piezoelectric ceramics were synthesized by normal sintering at a rela- tively low temperature of 1000℃. The crystalline phase, microstructure, and electrical properties of the ceramics were investigated with a special emphasis on the influence of MgO content. The addition of MgO effectively improves the sintembility of the L6NKN ceramics. X-my diffr cfion analysis indicates that the morphotropic phase boundary （MPB） separating orthorhombic and tetragonal phases for the ceramics lies in the range of Mg doping content （x） from 0.3at% to 0.7at%. High electrical properties of the piezoelectric constant （d33=238 pC/N）, planar electromechanical coupling coefficient （kp=41.5%）, relative dielectric constant （εr=905）, and remanent polarization （Pr=38.3 μC/cm2） are obtained from the specimen with x=0.5at%, which suggests that the Li0.06（Na0.5K0.5）0.94Nb（1-2x/5）MgxO3 （x=0.5at%） ceramic is a promising lead-free piezoelectric material.展开更多
Lead-free piezoelectric NaxK1-xNbO3（x = 0.3-0.8）（NKN） ceramics were fabricated by normal sintering at 1060°C for 2 h.Microstructures and electrical properties of the ceramics were investigated with a special ...Lead-free piezoelectric NaxK1-xNbO3（x = 0.3-0.8）（NKN） ceramics were fabricated by normal sintering at 1060°C for 2 h.Microstructures and electrical properties of the ceramics were investigated with a special emphasis on the influence of Na content.The grain size of the produced dense ceramic was decreased by increasing Na content.A discontinuous change in the space distance was found at the composition close to Na0.7K0.3NbO3 ceramic, which indicates the presence of a transitional composition between two different orthorhombic phases, which is similar to the behavior of morphotropic phase boundary（MPB） in NaxK1-xNbO3 ceramics.Such MPB-like behavior contributes to the enhanced piezoelectric coefficient d33 of 122 pC/N, planar-mode electromechanical coupling coefficient kP of 28.6%, and dielectric constant εr of 703, respectively for the Na0.7K0.3NbO3 ceramic.Cubic temperature TC and the transitional temperature TO-T from orthorhombic to tetragonal phase are observed at around 420°C and 200°C, respectively.展开更多
Lead-free piezoelectric ceramics （Na0.5K0.5-xLix）NbO3 （x=0.057-0.066） were synthesized by an ordinary sin-tering technique. Substituting Li for K can lead to structural distortion, which improves the Curie tempera...Lead-free piezoelectric ceramics （Na0.5K0.5-xLix）NbO3 （x=0.057-0.066） were synthesized by an ordinary sin-tering technique. Substituting Li for K can lead to structural distortion, which improves the Curie temperature （To） greatly. By adding appropriate LiNbO3 content, piezoelectric constant d33 values reach 202-212 pC/N. Electromechanical coefficients of the planar mode reach 44.4%-46.8%. The dielectric loss is below 2.6%, which is much lower than reported （about 50%）. The To of （Na0.5K0.5-xLix）NbO3 （x=0.057-0.066） is in the range of 490-510℃, at least 70℃ higher than that of pure （Na0.5K0.5）NbO3 ceramics. The results show that （Na0.5K0.5-xLix）NbO3 ceramic is a kind of good lead-free high-temperature piezoelectric material.展开更多
Ferromagnetic transition has generally been considered to involve only an ordering of magnetic moment with no change in the host crystal structure or symmetry, as evidenced by a wealth of crystal structure data from c...Ferromagnetic transition has generally been considered to involve only an ordering of magnetic moment with no change in the host crystal structure or symmetry, as evidenced by a wealth of crystal structure data from conventional X-ray diffractometry （XRD）. However, the existence of magnetostriction in all known ferromagnetic systems indicates that the magnetic moment is coupled to the crystal lattice; hence there is a possibility that magnetic ordering may cause a change in crystal structure. With the development of high-resolution synchrotron XRD, more and more magnetic transitions have been found to be accompanied by simultaneous structural changes. In this article, we review our recent progress in understand- ing the structural change at a ferromagnetic transition, including synchrotron XRD evidence of structural changes at the ferromagnetic transition, a phenomenological theory of crystal structure changes accompanying ferromagnetic transitions, new insight into magnetic morphotropic phase boundaries （MPB） and so on. Two intriguing implications of non-centric symmetry in the ferromagnetic phase and the first-order nature of ferromagnetic transition are also discussed here. In short, this review is intended to give a self-consistent and logical account of structural change occurring simultaneously with a ferromagnetic transition, which may provide new insight for developing highly magneto-responsive materials.展开更多
The piezoelectric properties of K1-xNaxNbO3 are studied by using first-principles calculations within virtual crystal approximation. To understand the critical factors for the high piezoelectric response in K1-xNaxNbO...The piezoelectric properties of K1-xNaxNbO3 are studied by using first-principles calculations within virtual crystal approximation. To understand the critical factors for the high piezoelectric response in K1-xNaxNbO3, the total energy, piezoelectric coefficient, elastic property, density of state, Born effective charge, and energy barrier on polarization rotation paths are systematically investigated. The morphotropic phase boundary in K1-xNaxNbO3 is predicted to occur at x = 0.521, which is in good agreement with the available experimental data. At the morphotropic phase boundary, the longitudinal piezoelectric coefficient d33 of orthorhombic K0.5Na0.5NbO3 reaches a maximum value. The rotated maximum of d＊33 is found to be along the 50° direction away from the spontaneous polarization （close to the [001] direction）. The moderate bulk and shear modulus are conducive to improving the piezoelectric response. By analyzing the energy barrier on polarization rotation paths, it is found that the polarization rotation of orthorhombic K0.5Na0.5NbO3 becomes easier compared with orthorhombic KNbO3, which proves that the high piezoelectric response is attributed to the flattening of the free energy at compositions close to the morphotropic phase boundary.展开更多
The structural, dielectric and piezoelectric properties of （1-x）（Bi1/2Na1/2） TiO3-xBaTiO3 ceramics were investigated for the compositional range, x=0.02, 0.04, 0.06, 0.08, 0.10. The samples were synthesized by a c...The structural, dielectric and piezoelectric properties of （1-x）（Bi1/2Na1/2） TiO3-xBaTiO3 ceramics were investigated for the compositional range, x=0.02, 0.04, 0.06, 0.08, 0.10. The samples were synthesized by a conventional solid-state reaction technique. All compositions show a single perovskite structure, and X-ray powder diffraction patterns can be indexed using a rhombohedral structure. Lattice constants and lattice distortion increase while the amount of BaTiO3 increases. The X-ray diffraction results show the morphotropic phase boundary （MPB） of （1-x）（Bi1/2Na12） TiO3-xBaTiO3 exists in near x=0.06-0.08. Temperature dependence of dielectric constant eT33/ε0 measurement reveals that all compositions experience one structural phase and two ferroelectric phases transition below 400℃： rhombohedral （or rhombohedral plus tetragonal） ferroelectric phase ←→ tetragonal antiferroelectric phase ←→ tetragonal paraelectric phase. Relaxor behaviors exist in the course of ferroelectric to antiferroelectric phase transition. Dielectric and piezoelectric properties are enhanced in the MPB range for （ 1-x）（Bi1/2Na1/2）TiO3-xBaTiO3.展开更多
基金supported by the National Key Research and Development Program of China(Nos.2022YFE0109500 and 2021YFB3501401)the National Natural Science Foundation of China(Nos.52171190 and 52301250).
文摘The mutual coupling of structure and magnetism is crucial for Heusler alloys.In this paper,Ni_(50)Mn_(34)Sb_(16-x)Ga_(x)(0≤x≤16)alloys were prepared by arc melting.Based on the test results of structure and magnetism,the magnetic-structural phase diagram of Ni_(50)Mn_(34)Sb_(16-x)Ga_(x)(0≤x≤16)was drawn.The structure changes from cubic to monoclinic and finally to tetragonal as the x increases at room temperature.Its phase diagram shows a morphotropic phase boundary(MPB)starting from a tricritical triple point(around the Ni_(50)Mn_(34)Sb_(5)Ga_(11)alloy)of a cubic paramagnetic phase,ferromagnetic monoclinic,and antiferromagnetic tetragonal phases.And Ni_(50)Mn_(34)Sb_(5)Ga_(11)alloy has experienced five different phase states:paramagnetic austenite→ferromagnetic austenite→antiferromagnetic martensite→ferromagnetic martensite→spin glass as the temperature decreased.Further study of the alloys’magnetostrictive properties near the MPB showed that as x increases,a negative strain initially appears,followed by a W-type that crosses negative and positive strains,and then a positive strain.This is caused by the inconsistency in the speed and degree of magnetic domain walls response with monoclinic and tetragonal coexisting structures.This indicates that coupling between structure and magnetism is critical to the properties of materials.This work provides valuable insights into the magnetostrictive behavior and structural evolution of Heusler alloys,particularly in the context of MPB systems,and offers guidance for the design and optimization of material properties through controlled magnetic-structural interactions.Kindly check and confirm the edit made in the title.The edit made in the title has been confirmed to be accurate.
基金This work was financially supported by the National Natural Science Foundation of China(Nos.52002252 and 52032007).
文摘The flourishing development of emerging electromechanical applications has stimulated an urgent demand for ferroelectric ceramics with high piezoelectric properties and broad temperature usage range.However,it remains a challenge to simultaneously obtain good piezoelectricity and reliable temperature stability in lead zirconate titanate(PZT)-based piezoelectric ceramics.To solve this issue,a synergetic strategy was proposed to introduce lead vacancies through niobium doping and construct morphotropic phase boundary(MPB).In this work,Pb_(0.905)Ba_(0.085)(V Pb″)_(0.01)[(Zr_(x)Ti_(1-x))_(0.98)Nb_(0.02)]O_(3)(PBZTN-x)material system was designed.Good comprehensive properties(d_(33)=864 pC/N,k_(p)=84%,T_(C)=201℃)and excellent temperature stability(less than 10%variation of electrical properties from 20℃ to 160℃)were obtained in PBZTN-0.540 ceramics.Good piezoelectricity can be attributed to high extrinsic contribution(domain wall motion)induced by Pb^(2+)vacancies and the existence of nano-domains emerged at MPB,while excellent temperature stability is mainly attributed to the minimized local stress in the lattice and the stable domain structure.
基金supports from the'Hundred of Talents Project'of the Chinese Academy of Sciencesthe support from NSF DMR under the grant NSFDMR-0704045
文摘Computer modeling and simulation for the Pb（Zr1-x Tix ）O3 （PZT） system reveal the role of polar anisotropy on the giant anhysteretic response and structural properties of morphotropic phase boundary （MPB） ferroelectrics. It is shown that a drastic reduction of the compositiondependent polar anisotropy near the MPB flattens energy surfaces and thus facilitates reversible polarization rotation. It is further shown that the polar anisotropy favors formation of polar domains, promotes phase decomposition and results in a two-phase multidomain state, which response to applied electric field is anhysteretic when the polar domain reorientation is only caused by polarization rotation other than polar domain wall movement. This is the case for the decomposing ferroelectrics under a poling electric field with the formation of a two-phase multidomain microstructure, wherein most domain walls are pinned at the two-phase boundaries. Indication of the microstructure dependence of the anhysteretic strain response opens new avenues to improve the piezoelectric properties of these materials through the microstructure engineering.
文摘Potassium Sodium Bismuth Titanate (KNBT) ceramics, with the general formula (1 - x)K0.5Bi0.5TiO3 -xNa0.5Bi0.5TiO3, have been synthesized following hydrothermal route, starting with solid solutions of pure perovskite nanoceramics of KBT and NBT in desired stoichiometric weight ratios, followed by sintering between 850°C and 1000°C for few hours. Pure KNBT nanoceramics with perovskite structure, having mean particle size around 30 nm, could be obtained. Morphology of the samples is found to depend strongly on composition. A change of composition results in a phase change, as evident from X-ray structure analysis. This phase change is a result of rhombohedral to tetragonal morphotropic phase boundary (MPB) in the sample with x around 0.80. Composition dependent occurrence of MPB leads to formation of needle like structures with micrometer length scales. These are typical of tetragonal lamellar structures, suggesting partial induction of tetragonal polar order from rhombohedral structure at MPB. Dielectric and piezoelectric properties, such as dielectric constant and loss, piezoelectric coefficients and figures of merit, exhibit threshold maxima in their values at the composition corresponding to MPB. These values reported for a lead-free piezoceramic, synthesized by a comparatively simple hydrothermal route, are highly promising, and comparable to well-known PZT.
基金This work is supported by Basic Science Research Program through the National Research Foundation of Korea(NRF)(2021R1C1C1011588)funded by the Ministry of Science and ICT of Korea.HJ Kim was supported by the Ministry of Trade,Industry and Energy of Korea(RS-2023-00231350)+2 种基金YKM acknowledges the funding by Interreg Deutschland-Denmark with money from the European Regional Development Fund,project number 096-1.1-18(Access and Acceleration)N.Vittayakorn was funded by KMITL under grant No.KREF11650Z Jagličićwas supported by the Slovenian Research Agency(Grant No.P2-0348).
文摘Morphotropic phase boundary(MPB)-based ceramics are excellent for energy harvesting due to their enhanced physical properties at phase boundaries,broad operating temperature range,and ability to customize properties for efficient conversion of mechanical energy into electrical energy.In this work,Bi_(1–x)Na_(x)Fe_(1–x)Nb_(x)O_(3)(x=0.20,0.30,0.32 and 0.40,BNFNO abbreviation)based ceramics were synthesized using a solid-state route and blended with Polydimethylsiloxane(PDMS)to achieve flexible composites.Various material characterization and energy harvesting were performed by designing a hybrid piezoelectric(PENG)-triboelectric(TENG)device.The voltage and current of PENG,TENG,and hybrid bearing same device area(2 cm×2 cm)were recorded as 11 V/0.3μA;60 V/0.7μA;110 V/2.2μA.The strategies for enhancing the output performance of the hybrid device were evaluated,such as increased surface area(creating micro-roughness and porous morphology)and increasing electrode size and multi-layer hybrid device formation.The self-powered acceleration monitoring was demonstrated using the hybrid device.Further,the low-frequency-based wave energy is converted into electrical energy,confirming the usage of hybrid PENG-TENG devices as a base for battery-free sensors and blue energy harvesting.
基金Project supported by the Natural Science Foundation of Sichuan Province(2024NSFSC0219)。
文摘In this work,the rare-earth doped ternary lead zirconate titanate ceramics with chemical formula of[0.3 Pb(Zn_(1/3)Nb_(2/3))O_(3)-0.7Pb(Zr_(0.52)Ti_(0.48))O_(3)]+x wt%CeO_(2)(x=0-0.5,abbreviated as 0.3PZN-0.7PZT-xCe)were synthesized by a conventional solid-state reaction route,specific attentions was focused on the effects of CeO_(2)dopants on the structures and electrical properties of the 0.3PZN-0.7PZT ceramics,revealing the role conve rsion of CeO_(2)dopants with its doping amount(x).When less CeO_(2)(x≤0.2)is introduced into 0.3PZN-0.7PZT,the prepared ceramics are identified as the coexistence of rhombohedral and tetragonal phases,also involved with an increased grain size and a reduced atomic ratio of Pb/(Zr+Ti+Zn+Nb).The increased remanent polarization(Pr)and deceased coercive filed(Ec),as well as improved dielectric permittivity(er)and piezoelectric coefficient(d_(33))de monstrate the donor substitution of Ce^(3+)for Pb^(2+)at the A-site of perovskite lattice.Conversely,the introduction of excessive CeO_(2)(x>0.2)causes a reversal evolution in the electrical properties of ceramics,suggesting that some of the introduced cerium element tends to become Ce4+,which equivalently substitutes for Zr^(4+)at the B-site.Additionally,the diffused phase transition(DPT)behaviors of the 0.3PZN-0.7PZT-xCe ceramics were investigated by the modified Curie-Weiss Law.The sample with x=0.2 shows reduced DPT character and optimized electrical properties,including TC=297℃,εr=1400,d_(33)=480 pC/N,tanδ=1.6%,kp=65%,d_(33)·g_(33)=16.32×10^(-12)m^(2)/N,Pr=38.3μC/cm^(2)and Ec=1.02 kV/mm.These enhanced electrical properties not only are contributed by the donor substitution effect of Ce^(3+),but also benefit from the optimized morphotropic phase boundary that is close to the tetragonal-rich side.
文摘Controlling the properties of piezoelectric thin films is a key aspect for designing highly efficient flexible electromechanical devices. In this stud）~ the crystallographic phenomena of PbZr1-xTixO3 （PZT） thin films caused by distinguished interfacial effects are deeply investigated by overlooking views, including not only an experimental demonstration but also ab initio modeling. The polymorphic phase balance and crystallinity, as well as the crystal orientation of PZT thin films at the morphotropic phase boundary （MPB）, can be stably modulated using interfacial crystal structures. Here, interactions with MgO stabilize the PZT crystallographic system well and induce the texturing influences, while the PZT film remains quasi-stable on a conventional A1203 wafer. On the basis of this fundamental understanding, a high-output flexible energy harvester is developed using the controlled-PZT system, which shows significantly higher performance than the unmodified PZT generator. The voltage, current, and power densities are improved by 556%, 503%, and 822%, respectively, in comparison with the previous flexional single-crystalline piezoelectric device. Finally, the improved flexible generator is applied to harvest tiny vibrational energy from a real traffic system, and it is used to operate a commercial electronic unit. These results clearly indicate that atomic-scale designs can produce significant impacts on macroscopic applications.
文摘The dielectric properties of Pb(Zn1/3Nb2/3)O3-PbZrO3-PbTiO3 (PZN-PZ-PT) system near the rhombohedral/tetragonal morphotropic phase boundary (MPB) are carefully studied in this paper.It is found that,for all samples,the curves around the temperatures of dielectric permittivity peak show the characteristics of diffuse phase transition.The change in PbZrO3/PbTiO3 ratio has much influence on the dielectric properties of the samples.The extent of diffuse phase transition increases with the increasing Zr/Ti ratio.The samples in rhombohedral region have typical diffuse phase transition in the temperature range measured.However,for the samples with tetragonal symmetry,a spontaneous normal ferroelectric-relaxor phase transition exists at temperature lower than that of permittivity peak.This normal ferroelectric-relaxor phase transition is confirmed by the experiment of thermally driven current.The analysis of TEM reveals that the samples in tetragonal region show a 90° macrodomain structure,while the samples in rhombohedral region have the configuration of microdomain structure.
文摘A morphotropic phase boundary(MPB)with temperature-independent behavior,the so-called vertical MPB was investigated in lead-free(K,Na,Li)NbO_(3)–BaZrO_(3)–(La,Na)TiO_(3)ternary ceramic system.The specimens were synthesized by a conventional solid-state reaction method,and their crystal structures as well as their MPB were determined from X-ray diffraction patterns measured from room temperature to 300℃.The vertical MPB composition was determined to be 0.9025(K_(0:45)Na0:5Li_(0:05))NbO_(3)–0.09BaZrO_(3)–0.0075(La,Na)TiO_(3)and the Curie temperature was found to be about 195℃.It was successfully confirmed that ceramic samples of this system could be sintered in a reducing atmosphere.For lead-free piezoceramic applications of multilayer actuators using Ni inner electrodes,the results obtained in this work have important practical implications.
文摘New lead-free piezoceramic nanocomposites of Boron Sodium Gadolinium Niobate(BNGN),with general formula(1-x)B_(0.5)Na_(0.5)GdO3xB_(0.5)Na_(0.5)NbO_(3),exhibiting a Morphotropic Phase Boundary(MPB),have been synthesized following hydrothermal method followed by solid state sintering.The occurrence of MPB at the composition with x=0.55,at which rhombohedral and monoclinic phases are found to coexist,has been confirmed using powder XRD.This accounts for the occurrence of large remnant polarization when the sintered ceramic pellets are subjected to electric poling at 2KV/mm.Uniform microstructure of various compositions is confirmed by SEM imaging.Dielectric and piezoelectric properties of the samples are found to be comparable to those of commercial grade PZT.At the MPB,the d_(33)coefficient is found to be 556 pC/N,which is close to that of commercial grade PZT,which makes BNGN a promising material to substitute lead containing PZT in the near future.
文摘Presented results demonstrate importance of taking into account such a phenomenon as the solid solution decomposition at the boundaries separating coexisting phases in lead zirconate-titanate-based solid solutions with compositions belonging to the morphotropic boundary region of the"temperature–composition"phase diagram.It is shown that in the local decomposition of solid solutions in the vicinity of the boundaries separating the tetragonal and rhombohedral phases in lead zirconate-titanate-based solid solutions lead to the changes of the solid solution's chemical composition and to the formation of segregates.It is also shown that the proper thermoelectric treatment of samples containing these segregates can give substantially higher values of piezoelectric parameters in the lead zirconate-titanate-based compounds.
基金supported by the National Natu-ral Science Foundation of China(Grant No.52261135548)the Key Research and Development Program of Shaanxi(Program No.2022KWZ-22)+3 种基金the National Key Research and Development Program of China(Grant Nos.2021YFE0115000 and 2021YFB3800602)Russian Science Foundation(Project No.23-42-00116)The equipment of the Ural Center for Shared Use“Modern nanotechnology”Ural Federal University(Reg.No.2968)the Ministry of Science and Higher Education RF(Project No.075-15-2021-677)was used.
文摘Due to the thermal depolarization effect,adequate piezoelectric performance with high operating temperature is regarded to be challenging to accomplish concurrently in piezoceramics for applications in specific piezoelectric devices.In this work,we synthesized(0.8−x)BiFeO_(3)-x PbTi_(3)-0.2Ba(Zr_(0.25)Ti_(0.75))O_(3)(abbreviated as BFO-x PT-BZT)ternary solid solutions with 0.15≤x≤0.30 by conventional solid-state reaction method.The MPB composition with a coexisting state of rhombohedral-tetragonal phases exhibits enhanced electromechanical properties,including Curie temperature of 380℃,large-signal equivalent piezoelectric coefficient d^(∗)_(33)of 395 pm V^(-1),small-signal piezoelectric coefficient d_(33)of 302 pC N^(-1),and electromechanical coupling factor k_(p)of 50.2%,which is comparable to commercial PZT-5A ceramics,indicating potential in high-temperature applications.Furthermore,in-situ X-ray diffraction(XRD)and piezoelectric force microscopic(PFM)techniques demonstrate that multiphase coexistence and complex nanodomains promote piezoelectric response via synergism.The x=0.24 composition exhibits the highest in-situ d_(33)of 577 pC N^(-1)and good temperature stability in 30−280℃,indicating that BZT-modified BFO-PT ceramics are promising candidates for high-temperature piezoelectric devices.
文摘Quinary system piezoelectric ceramics PSN-PZN-PMS-PZT were prepared by using a two-step method. The effects of CeO2 doping on piezoelectric and dielectric properties of the system were investigated at morphotropic phase boundary （MPB）. The results reveal that the relative dielectric constant ε33^T｜ε0, the Curie temperature To, the piezoelectric constant d33, the mechanical quality factor Qm, and the electromechanical coupling coefficient Kp are changed with the increase of CeO2 content. On the other hand, the effects of CeO2 doping on the dielectric properties of PSN-PZN-PMS-PZT piezoelectric ceramics at high electric field are consistent with the change at weak electric field. The values of dielectric constant and dielectric loss are enhanced with the increasing of electric field.
基金Project(SDBX2020010) supported by Shandong Postdoctoral Innovative Talents Support Plan,ChinaProjects(U1806221,U2006218) supported by the National Natural Science Foundation of China+1 种基金Project(ZR2020KA003)supported by Shandong Provincial Natural Science Foundation,ChinaProjects(2019GXRC017,2020GXRC051)supported by the Project of “20 Items of University” of Jinan,China。
文摘Piezoelectric ceramic based high-temperature acoustic emission(AE)sensor is required urgently in the structural health monitoring of high-temperature fields.In this research,a series of 0.45(BiSc_(x)O_(3)-BiFe_(1-x)O_(3))-0.48PbTiO_(3)-0.07BaTiO_(3)(BSc_(x)Fe_(1-x)-PT-BT,n(Sc)/n(Fe)=0.4/0.6-0.6/0.4)ceramics with both high Curie temperature and large piezoelectric constant were presented.The structure and electrical properties of BSc_(x)Fe_(1-x)-PT-BT ceramics as a function of n(Sc)/n(Fe)have been systematically investigated.All the ceramics possess a perovskite structure,and the phase approaches from the rhombohedral toward the tetragonal phase with the decrease of n(Sc)/n(Fe).The BSc_(0.5)Fe_(0.5)-PT-BT and BSc_(0.5)Fe_(0.5)-PT-BT piezoelectric ceramics exhibit good piezoelectricity(d_(33)=250-281 pC/N),high Curie temperature(T_(C)=430-450℃)and excellent temperature stability.These improvements are greatly attributed to the balance between rhombohedral and tetragonal phase near morphotropic phase boundary with dense microstructure of ceramics.AE sensor based BSc_(0.5)Fe_(0.5)-PT-BT piezoelectric ceramic was designed,prepared and tested.The high-temperature stability of AE sensor was characterized through pencil-lead breaking with in situ high-temperature test.The noise of AE sensor is less than 40 dB,and the acoustic signal is up to 90 dB at 200℃.As a result,AE sensors based on BSc_(x)Fe_(1-x)-PT-BT piezoelectric ceramics are expected to be applied into the structural health monitoring of high temperature fields.
基金supported by the Research Fund for the Doctoral Program of Higher Education of China (No20090006110010)the National Basic Research Priorities Program of China (No2007CB613301)the Program of University-Industry Cooperation Supported by the Ministry of Education and Guangdong Province of China (No2008B090500262)
文摘MgO-modified Li0.06（Na0.5K0.5）0.94NbO3O3 （L6NKN） lead-free piezoelectric ceramics were synthesized by normal sintering at a rela- tively low temperature of 1000℃. The crystalline phase, microstructure, and electrical properties of the ceramics were investigated with a special emphasis on the influence of MgO content. The addition of MgO effectively improves the sintembility of the L6NKN ceramics. X-my diffr cfion analysis indicates that the morphotropic phase boundary （MPB） separating orthorhombic and tetragonal phases for the ceramics lies in the range of Mg doping content （x） from 0.3at% to 0.7at%. High electrical properties of the piezoelectric constant （d33=238 pC/N）, planar electromechanical coupling coefficient （kp=41.5%）, relative dielectric constant （εr=905）, and remanent polarization （Pr=38.3 μC/cm2） are obtained from the specimen with x=0.5at%, which suggests that the Li0.06（Na0.5K0.5）0.94Nb（1-2x/5）MgxO3 （x=0.5at%） ceramic is a promising lead-free piezoelectric material.
基金supported by the National Natural Science Foundation of China (No. 50842028)the National Basic Research Priorities Program of China (No. 2007CB613301)
文摘Lead-free piezoelectric NaxK1-xNbO3（x = 0.3-0.8）（NKN） ceramics were fabricated by normal sintering at 1060°C for 2 h.Microstructures and electrical properties of the ceramics were investigated with a special emphasis on the influence of Na content.The grain size of the produced dense ceramic was decreased by increasing Na content.A discontinuous change in the space distance was found at the composition close to Na0.7K0.3NbO3 ceramic, which indicates the presence of a transitional composition between two different orthorhombic phases, which is similar to the behavior of morphotropic phase boundary（MPB） in NaxK1-xNbO3 ceramics.Such MPB-like behavior contributes to the enhanced piezoelectric coefficient d33 of 122 pC/N, planar-mode electromechanical coupling coefficient kP of 28.6%, and dielectric constant εr of 703, respectively for the Na0.7K0.3NbO3 ceramic.Cubic temperature TC and the transitional temperature TO-T from orthorhombic to tetragonal phase are observed at around 420°C and 200°C, respectively.
基金This work was financially supported by the National Natural Science Foundation of China(Grant No.50572056).
文摘Lead-free piezoelectric ceramics （Na0.5K0.5-xLix）NbO3 （x=0.057-0.066） were synthesized by an ordinary sin-tering technique. Substituting Li for K can lead to structural distortion, which improves the Curie temperature （To） greatly. By adding appropriate LiNbO3 content, piezoelectric constant d33 values reach 202-212 pC/N. Electromechanical coefficients of the planar mode reach 44.4%-46.8%. The dielectric loss is below 2.6%, which is much lower than reported （about 50%）. The To of （Na0.5K0.5-xLix）NbO3 （x=0.057-0.066） is in the range of 490-510℃, at least 70℃ higher than that of pure （Na0.5K0.5）NbO3 ceramics. The results show that （Na0.5K0.5-xLix）NbO3 ceramic is a kind of good lead-free high-temperature piezoelectric material.
基金Project supported by the National Basic Research Program of China (Grant No. 2012CB619401)the National Natural Science Foundation of China (Grant Nos. 51222104 and 51071117)the Fundamental Research Funds for Central Universities
文摘Ferromagnetic transition has generally been considered to involve only an ordering of magnetic moment with no change in the host crystal structure or symmetry, as evidenced by a wealth of crystal structure data from conventional X-ray diffractometry （XRD）. However, the existence of magnetostriction in all known ferromagnetic systems indicates that the magnetic moment is coupled to the crystal lattice; hence there is a possibility that magnetic ordering may cause a change in crystal structure. With the development of high-resolution synchrotron XRD, more and more magnetic transitions have been found to be accompanied by simultaneous structural changes. In this article, we review our recent progress in understand- ing the structural change at a ferromagnetic transition, including synchrotron XRD evidence of structural changes at the ferromagnetic transition, a phenomenological theory of crystal structure changes accompanying ferromagnetic transitions, new insight into magnetic morphotropic phase boundaries （MPB） and so on. Two intriguing implications of non-centric symmetry in the ferromagnetic phase and the first-order nature of ferromagnetic transition are also discussed here. In short, this review is intended to give a self-consistent and logical account of structural change occurring simultaneously with a ferromagnetic transition, which may provide new insight for developing highly magneto-responsive materials.
基金supported by the National Basic Research Program of China(Grant No.2013CB632900)
文摘The piezoelectric properties of K1-xNaxNbO3 are studied by using first-principles calculations within virtual crystal approximation. To understand the critical factors for the high piezoelectric response in K1-xNaxNbO3, the total energy, piezoelectric coefficient, elastic property, density of state, Born effective charge, and energy barrier on polarization rotation paths are systematically investigated. The morphotropic phase boundary in K1-xNaxNbO3 is predicted to occur at x = 0.521, which is in good agreement with the available experimental data. At the morphotropic phase boundary, the longitudinal piezoelectric coefficient d33 of orthorhombic K0.5Na0.5NbO3 reaches a maximum value. The rotated maximum of d＊33 is found to be along the 50° direction away from the spontaneous polarization （close to the [001] direction）. The moderate bulk and shear modulus are conducive to improving the piezoelectric response. By analyzing the energy barrier on polarization rotation paths, it is found that the polarization rotation of orthorhombic K0.5Na0.5NbO3 becomes easier compared with orthorhombic KNbO3, which proves that the high piezoelectric response is attributed to the flattening of the free energy at compositions close to the morphotropic phase boundary.
文摘The structural, dielectric and piezoelectric properties of （1-x）（Bi1/2Na1/2） TiO3-xBaTiO3 ceramics were investigated for the compositional range, x=0.02, 0.04, 0.06, 0.08, 0.10. The samples were synthesized by a conventional solid-state reaction technique. All compositions show a single perovskite structure, and X-ray powder diffraction patterns can be indexed using a rhombohedral structure. Lattice constants and lattice distortion increase while the amount of BaTiO3 increases. The X-ray diffraction results show the morphotropic phase boundary （MPB） of （1-x）（Bi1/2Na12） TiO3-xBaTiO3 exists in near x=0.06-0.08. Temperature dependence of dielectric constant eT33/ε0 measurement reveals that all compositions experience one structural phase and two ferroelectric phases transition below 400℃： rhombohedral （or rhombohedral plus tetragonal） ferroelectric phase ←→ tetragonal antiferroelectric phase ←→ tetragonal paraelectric phase. Relaxor behaviors exist in the course of ferroelectric to antiferroelectric phase transition. Dielectric and piezoelectric properties are enhanced in the MPB range for （ 1-x）（Bi1/2Na1/2）TiO3-xBaTiO3.
