钙钛矿结构中的简谐子软模

利用复合空间型方法,在自由边界条件下解出了钙钛矿结构有限尺寸晶体的简谐振动方程.计算结果给出了收敛的简谐子谱分布,并发现了许多简谐子软模.用这些软模花样说明了钛酸钡晶体冷却时发生具有a畴和c畴结构的铁电相变.理论表明铁电相变过程涉及屏蔽电荷的激发及其在界面的缓慢扩散,以最后得出各个电畴内部的均匀自发极化 关键词： 晶格动力学 简谐子 软模 钛酸钡     

Anisotropic electrical properties of Bi0.5(Na0.75K0.25)0.5TiO3 ceramics fabricated by reactive templated grain growth (RTGG)

We have fabricated lead-free Bi_0.5(Na_0.75K_0.25)_0.5TiO₃ (BNKT) ceramics by a conventional process (CP) and reactive templated grain growth (RTGG) methods. The effect of grain orientation on structure, dielectric, complex impedance and electrical properties was investigated. The phase formation and grain morphology of BNKT ceramics were examined by X-ray diffraction (XRD) and scanning electron microscope (SEM), respectively. High dielectric constant and low dielectric loss was observed for grain oriented (textured) BNKT ceramics. Complex impedance, temperature dependent ac and dc conductivity were performed to explore the conduction behavior of the prepared BNKT ceramics.     

Spinel lithium titanate (Li4Ti5O12) as novel anode material for room-temperature sodium-ion battery

This is the first time that a novel anode material, spinel Li₄Ti₅O₁₂ which is well known as a “zero-strain” anode material for lithium storage, has been introduced for sodium-ion battery. The Li₄Ti₅O₁₂ shows an average Na storage voltage of about 1.0 V and a reversible capacity of about 145 mAh/g, thereby making it a promising anode for sodium-ion battery. E_x-situ X-ray diffraction (XRD) is used to investigate the structure change in the Na insertion/deinsertion process. Based on this, a possible Na storage mechanism is proposed.     

Luminescence of Eu~(2 ) in Strontium Aluminum Oxide System with Long Decay Property

Luminescentmaterialshavinglongdecayperi0dhaveat-IIactedmuchinterestduetotheirpotentialwidespreadaPplicati0ns.Recently,alongdecayluminescentp0wderhavingthecomPositionofSrAl2O4activatedwithEu' wasreportedandregardedasthebestcandidateforpracticalaPPlicationbecauseofitsuniqueadVantages0veritsprecursors.l'2Inthispaper,wereportthesynthesisofthelongdecayluminescentpowderandtheinnuence0fthemolarratioofAlt0sr0ntheethessioncolor.Toproducethelundnescentp0wder,amixtureofSrCO3,Al2O3,Eu2O3andsomesol…     

聚苯乙烯—钛酸钡复合材料介电性能的研究

以聚苯乙烯与化学沉淀法钛酸钡陶瓷为基本组成，采用溶液共混，溶液聚合，表面处理后溶液聚合三种方法进行复合，发现后两种复合的钛酸钡颗粒表面发生界面变化，形成活性界面，使得溶液聚合法和表面处理后溶液聚合所得到的材料具有较低的介电损耗，在高频下能保持较高的介电系数。     

微乳液法制备超细K2Ln2Ti3O10及其光催化活性研究

以钛酸四丁酯、氢氧化钾和镧系金属氧化物为原料。采用微乳液法制备了系列超细K2Ln2Ti3O10（Ln=La．Ce,Pr．Nd，Sm，Eu，Gd）光催化剂。并考察了其光催化活性。通过X射线衍射（XRD）、透射电镜（TEM）和紫外可见吸收光谱（UV—Vis）对其进行了表征。结果表明：用微乳液法制备催化剂可以在较低的温度下（900℃），用较短的烧结时间（3h）合成结晶度高、粒径较小（200Mm）的K2Ln2Ti3O10钙钛矿型层状结构化合物。催化剂在紫外光和可见光条件下均具有光催化降解甲基橙的活性。紫外光条件下可以明显提高光催化降解活性，降解率达到60％。     

Barium Titanate-reinforced Acrylonitrile-Butadiene Rubber: Synergy Effect of Carbon-based Secondary Filler

Acrylonitrile rubber(NBR) composites filled with barium titanate(BT) were prepared using an internal mixer and a two-roll mill. Also, a secondary filler, namely carbon nanotubes(CNT), was added in order to find a potential synergistic blend ratio of BT and CNT. The cure characteristics, tensile and dielectric properties(dielectric constant and dielectric loss) of the composites were determined. It was found that NBR/BT composites with CNT secondary filler, at a proper BT:CNT ratio, exhibited shorter scorch time(t_(s1)) and cure time(t_(c90)) together with superior tensile properties and reinforcement efficiency, relative to the one with only the primary filler. In addition, the NBR/BT-CNT composite with 80 phr BT and 1-2 phr CNT had dielectric constant of 100-500, dielectric loss of 12-100 and electrical conductivity below 10~(-4) S/m together with high thermal stability. Thus, with a proper BT:CNT mix and filler loading, we can produce mechanically superior rubber composites that are easy to process and low-cost, for flexible dielectric materials application.     

Kinetic investigation of electronic energy transfer processes following the pulsed dye-laser generation of excited atomic barium, Ba[6s6p(P1)], in the presence of atomic strontium

The collisional behaviour of Ba[6s5d(³D_J)], 1.151 eV above the 6s²(¹S₀) electronic ground state, in the presence of atomic strontium, has been investigated in the ‘long-time domain' (ca. 100 μs–1 ms) following the pulsed dye-laser excitation of barium vapour at elevated temperature at λ = 553.5 nm (Ba[6s6p(¹P₁)] ← Ba[6s²(¹S₀)]. Ba(³D_J) is subsequently produced from the short-lived ¹P₁ state (τ_e = 8.37 ± 0.38 ns) by a number of radiative and collisional processes. It may then be monitored in the ‘long-time domain' by atomic spectroscopic marker methods involving either collisional activation of Ba(³D_J) by Ba(¹S₀) and He buffer gas to yield Ba[6s6p(³P_J)] with subsequent emission from the ³P₁ state (τ_e = 1.2 ± 0.1 μs): Ba[6s6p(³P₁)] → Ba[6s²(¹S₀)] + hv (λ = 791.1 nm). Alternatively, emission from Ba(¹P₁) may be monitored at long times following the generation of this short-lived state by energy pooling following self-annihilation of Ba(³D_J) + Ba(³D_J) from Ba[6s6p(¹P₁)] → Ba[6s²(¹S₀)] + hv (λ = 553.5 nm). The generation of Ba(³D_J) in the presence of atomic strontium yields emission in the long-time domain from Sr[5s5p(³P₁)] (τ_e = 19.6 μs): Sr[5s5p(³P₁)] → Sr[5s²(¹S₀)]  + hv (λ = 689.3 nm). Whilst the decay profiles at short times are complex in form, at long times all these atomic profiles show first-order kinetic removal with the decay coefficients for λ = 791.1 nm, 689.3 nm and 553.5 nm emissions in the ratio 1 : 2 : 2, consistent with overall third-order activation of the form: Ba(³D_J) + Ba(³D_J) + Sr(¹S₀) → Sr(³P_J) + 2Ba(¹S₀). The mechanism is modelled in detail, including measurement of integrated emission intensities, yielding kinetic data for fundamental collisional processes. The overall rate constant for the third-order collisional activation of Sr[5s5p(³P_J])from 2Ba[6s5d(³D_J)] + Sr[5s²(¹S₀)] takes the upper limit of 5.8 × 10⁻²⁷ cm⁶ atom⁻² s⁻¹ (T = 900 K). The rate constant for the two body collisional quenching of Ba[6s5d(³D_J)] by ground state atomic strontium, Sr[5s²(¹S₀)], is found to be (2.0 ± 0.1) × 10⁻¹² cm³ atom⁻¹ s⁻¹ (T = 900 K).     

Al_2O_3包覆Ba_(0.6)Sr_(0.4)TiO_3复合粉体制备及表征

采用液相包覆法制备了Al2O3包覆的Ba0.6Sr0.4TiO3复合粉体。通过SEM,TEM,TG-DSC,XRD,XPS和ζ电位测试对包覆前后粉体的表面形貌、组织结构、等电点进行了测试和分析。结果表明:Al2O3以无定形结构成功的包覆在Ba0.6Sr0.4TiO3粉体表面,形成了Ba-O-Al、Sr-O-Al和Ti-O-Al键,Ba0.6Sr0.4TiO3颗粒的等电点由包覆前的pH=3.2增大至pH=8。     

Synthesis,Structure, and Properties of SrC(NH)3, a Nitrogen‐Based Carbonate Analogue with the Trinacria Motif

Strontium guanidinate, SrC(NH)₃, the first compound with a doubly deprotonated guanidine unit, was synthesized from strontium and guanidine in liquid ammonia and characterized by X‐ray and neutron diffraction, IR spectroscopy, and density‐functional theory including harmonic phonon calculations. The compound crystallizes in the hexagonal space group P6₃/m, constitutes the nitrogen analogue of strontium carbonate, SrCO₃, and its structure follows a layered motif between Sr²⁺ ions and complex anions of the type C(NH)₃^2?; the anions adopt the peculiar trinacria shape. A comparison of theoretical phonons with experimental IR bands as well as quantum‐chemical bonding analyses yield a first insight into bonding and packing of the formerly unknown anion in the crystal.