Atomic absorption background of Ba in EXAFS analysis of BaFe12O19 nanoparticles

The approximate barium X‐ray atomic absorption in the energy region of L‐edges is reconstructed from the absorption spectrum of an aqueous solution of BaCl₂. The result is corroborated by comparison with pure atomic absorption spectra of neighbour elements Xe and Cs. The application of the atomic absorption signal as a proper EXAFS background is demonstrated and discussed in the analysis of Ba hexaferrite nanoparticles with a very weak structural signal. The essential gain is found in the decrease of uncertainty intervals of structural parameters and their correlations. A simple analytical model of the absorption background for the practical EXAFS analysis is demonstrated.     

Synthesis and microwave absorption properties of graphene-oxide(GO)/polyaniline nanocomposite with Fe3O4 particles

In order to investigate the impedance matching properties of microwave absorbers,the ternary nanocomposites of GO/PANI/Fe₃O₄（GPF） are prepared via a two-step method,GO/PANI composites are synthesized by dilute polymerization in the presence of aniline monomer and GO,and GO/PANI/Fe₃O₄ is prepared via a co-precipitation method.The obtained nanocomposites are characterized by scanning electron microscopy（SEM）,X-ray diffraction（XRD）,and Fourier transform infrared spectroscopy（FTIR）,respectively.The microwave absorbability reveals enhanced microwave absorption properties compared with GO,PANI,and GO/PANI.The maximum reflection loss of GO/PANI/Fe₃O₄ is up to-27 dB at 14 GHz with its thickness being 2 mm,and its absorption bandwidths exceeding-10 dB are more than 11.2 GHz with its thickness values being in the range from 1.5 mm-4 mm.It provides that GO/PANI/Fe₃O₄ can be used as an attractive candidate for microwave absorbers.     

Two-photon absorption properties of aggregation systems on the basis of (E)-4-(2-nitrovinyl) benzenamine molecules

Aggregation effect caused by the intermolecular hydrogen-bonding interactions on two-photon absorption properties of (E)-4-(2-nitrovinyl) benzenamine molecules is studied at a hybrid density functional level. The geometry optimization studies indicate that there exist two probable conformations for the dimers and three for the trimers. A strong red-shift of the charge-transfer states is shown. The two-photon absorption cross sections of the molecule for certain conformations are greatly enhanced by the aggregation effect, from which a ratio of 1.0:2.6:3.6 is found for the molecule and its dimer and trimer with nearly planar structures. Namely, a 30 or 20 percent increase of the two-photon absorption cross section is observed.     

Crystal structures and phonon modes of Ba(Ca1/2W1/2)O3, Ba(Ca1/2Mo1/2)O3 and Ba(Sr1/2W1/2)O3 complex perovskites investigated by Raman scattering

This work investigates the crystal structures and phonon modes of Ba(Ca_1/2W_1/2)O₃, Ba(Ca_1/2Mo_1/2)O₃ and Ba(Sr_1/2W_1/2)O₃ perovskites by Raman spectroscopy. The samples were produced by conventional solid‐state processing at 1200 °C. X‐ray diffraction showed that single‐phase homogeneous materials were produced, which are cubic or pseudo‐cubic in symmetry. The existing controversies in the literature for these complex perovskites were investigated by comparing experimental Raman data with group‐theory analysis. Ceramics with Ca and W or Mo were found to be cubic, space group Fm3 m. For these materials, four Raman‐active bands were observed and the fitting parameters showed that the Ba(Ca_1/2Mo_1/2)O₃ ceramic presents bands at lower wavenumbers if compared with the Ba(Ca_1/2W_1/2)O₃ sample. For the Ba(Sr_1/2W_1/2)O₃ material, two hypotheses were investigated for monoclinic or triclinic structures. The experimental results showed 12 Raman‐active modes for this ceramic, which is in perfect agreement with the theoretical predictions for a monoclinic (I2/m) structure. Copyright © 2009 John Wiley & Sons, Ltd.     

Magnetic and Microwave Absorbing Properties of Electrospun Ba(1−x)LaxFe12O19 Nanofibers

Ba_(1−x)La_xFe₁₂O₁₉ (0.00≤x≤0.10) nanofibers were fabricated via the electrospinning technique followed by heat treatment at different temperatures for 2 h. Various characterization methods including scanning electron microscopy (SEM), X-ray diffraction (XRD), vibrating sample magnetometer (VSM), and microwave vector network analyzer were employed to investigate the morphologies, crystalline phases, magnetic properties, and complex electromagnetic parameters of nanofibers. The SEM images indicate that samples with various values of x are of a continuous fiber-like morphology with an average diameter of 110±20 nm. The XRD patterns show that the main phase is M-type barium hexaferrite without other impurity phases when calcined at 1100 °C. The VSM results show that coercive force (H_c) decreases first and then increases, while saturation magnetization (M_s) reveals an increase at first and then decreases with La³⁺ ions content increase. Both the magnetic and dielectric losses are significantly enhanced by partial substitution of La³⁺ for Ba²⁺ in the M-type barium hexaferrites. The microwave absorption performance of Ba_0.95La_0.05Fe₁₂O₁₉ nanofibers gets significant improvement: The bandwidth below −10 dB expands from 0 GHz to 12.6 GHz, and the peak value of reflection loss decreases from −9.65 dB to −23.02 dB with the layer thickness of 2.0 mm.     

The theoretical studies on the two-photon absorption properties of symmetric 1,4-bis{2-[4-（2- aryl） phenyl] vinyl }- 2,5-bisdialkoxyb enzenes

On the level of the time-dependent hybrid density functional theory, the one- and two-photon absorption properties of a series of symmetric 4-bis 2-[4-(2-ary12) phenyl]vinyl-2,5-bisdialkoxybenzenes are studied respectively utilizing the analytic response theory and the few-state model methods. The calculated results show that the planarity of the geometrical structure plays a great role in enhancing the linear and nonlinear optical abilities of the molecule. However the effect of the length of the chain linked to the π-centre on the optical property is very little. For the investigated compounds, the A–π–A type charge-transfer molecules display more superior one- and two-photon absorption characteristics than the D–π–D type ones. Furthermore, the two-photon absorption results by use of few-state model are generally consistent with those by analytic response theory, demonstrating the reliability of the few-state model for evaluating the two-photon absorption cross section. The numerical simulations are in good agreement in tendency with the available experimental measurements.     

Infrared absorption spectra studies in (NaNO3–NaNO2) system

A complete infrared study of the mixed crystal system of NaNO₃ and NaNO₂ is carried out in the region 600—3000 cm^—1 at room temperature. The study includes fundamental internal normal vibrations of the NO^—₂ and NO^—₃ ions. The IR spectra, spectral band shape intensities, combination modes, and frequencies of the internal modes were studied as a function of NO^—₃ ion concentration. Special attention is paid to the bending mode, the combination mode, and a symmetric stretching mode.     

Collision-induced absorption in the V2 fundamental band of ^12CH4

The integrated intensities of the collision-induced absorption of the V2 band of ^12CH4 perturbed by Ar have been calculated theoretically using the ab initio calculations, and the value of the quadrupole transition moment we obtained is （0/Q/V2） = 5.226ea^2.. The corresponding experimental value obtained from ^12 CH4-Ar spectra is /〈0/Q/V2）/ = 4.931ea^2. Ignoring vibration-rotation interaction and Coriolis interaction, and considering both the theoretical approximations and experimental uncertainties, the agreement can be regarded as good, thus confirming that the enhancement is due to the quadrupole collision-induced mechanism.[第一段]     

Disorder‐induced symmetry lowering in Ba(Y1/2Nb1/2)O3 ceramics probed by Raman spectroscopy

This work investigates the evolution of the crystal structure of microwave‐hydrothermal synthesized Ba(Y_1/2Nb_1/2)O₃ powders as a function of firing temperature by Raman spectroscopy. The samples were produced at 200 °C and fired at temperatures ranging from 600 to 1600 °C. Raman spectra were obtained at room temperature for all samples and the results showed that materials fired at 1600 °C exhibited tetragonal (I4/m or ) structure, whereas those fired at lower temperatures exhibited the triclinic (P1 or C_i¹) structure. The results were compared with those observed for ceramics obtained by conventional solid‐state methods. It is believed that the lowering of the symmetry verified in materials fired below 1600 °C is a consequence of the local disorder of Y⁺³ and Nb⁺⁵ ions in octahedral sites. Copyright © 2008 John Wiley & Sons, Ltd.     

Dispersion of the birefringence in (CH12H25NH3)2ZnCl4 and (C12H25NH3)2ZnCl4: Co around their isotropic points

The optical dispersion of (C₁₂H₂₅NH₃)₂ZnCl₄ and (C₁₂H₂₅NH₃)₂ZnCl₄: Co is investigated by means of birefringence and optical absorption measurements in the temperature region around their isotropic points. The birefringence dispersion is analyzed in terms of a simple oscillator model based on the absorption band structure of both materials. A fairly good agreement is found between the thermal behaviour of the adjustable parameters of the oscillator model and the temperature dependence of the absorption spectra. The results suggest the existence of a structural phase transition at 315 K.     

(Na1/2Bi1/2)Cu3Ti4O12陶瓷的微观结构和电学性质

利用固相反应法在不同烧结温度条件下制备了一系列(Na_1/2Bi_1/2)Cu₃Ti₄O₁₂(NBCTO)陶瓷样品,研究了它们的晶体结构、微观组织结构、介电性质和复阻抗及其随温度的变化. 实验发现NBCTO陶瓷所呈现出的电学性质与CaCu₃Ti₄O₁₂陶瓷相应的电学性质非常类似. 烧结温度为990℃至1060℃范围的NBCTO陶瓷样品室 关键词： 高介电材料 介电性质 复阻抗 内阻挡层电容     

Improvement in magnetic properties of La substituted BaFe12O19 particles prepared with an unusually low Fe/Ba molar ratio

In this study, effect of lanthanum substitution on the phase composition, lattice parameters and magnetic properties of barium hexaferrite has been studied in samples synthesized in ammonium nitrate melt. Samples, prepared with different lanthanum amount and having various initial Fe/(Ba+La) ratios in between 12 and 2 {(Ba_1−xLa_x)·n Fe₂O₃, where 0≤x≤1 and 1≤n≤6)}, are sintered at temperatures from 800 to 1200 °C. The lattice parameters, both a and c, decreases with increasing La amount which results in a decrease of the unit cell volume. The scanning electron microscope micrographs show that the pure and La-substituted sample with x=0.3, both calcinated at 1000 °C, have grain sizes smaller than 1 μm. The coercivities of the La-substituted samples increase with increasing La amount and reaches to a maximum value of 5.73 kOe, when x=0.3. Sintering at higher temperatures (above 1000 °C) decreases the coercivity, resembling a transition from single to multi-domain behavior of the particles, while saturation magnetization of the samples continues to increase due to the increasing grain size. Magnetization measurements of the samples prepared with different Fe/(Ba+La) molar ratios, n's, revealed that the specific saturation magnetization slightly increases with decreasing n, while coercivities fluctuates around 5.5 kOe. However, a sharp increase in the saturation magnetization has been observed in the sample having n=1 and washed in HCl. It was measured as 59.2 emu/g at 15 kOe, which is higher than that of the pure sample (57.5 emu/g). Thus, the magnetic parameters are optimized in the sample Ba_0.7La_0.3Fe₁₂O₁₉ so as to maximize both coercivity and specific saturation magnetization in the HCl-washed sample synthesized by starting with an unusually low Fe/(Ba+La) molar ratio of 2 (or n=1).     

Effect of iron doping and oxygen stoichiometry on infrared absorption in Y1Ba2Cu3O7−δ

We report infrared absorption of Y₁Ba₂Cu₃O_7−δ as a function of oxygen stoichiometry (0<δ<1) and copper substitution by iron in the spectral range of 450–700 cm⁻¹. The strong bands associated with Cu-O vibrations undergo significant changes in their frequencies and intensities asδ is varied across the orthorhombic to tetragonal phase. These changes coupled with those arising as a result of doping with iron has helped in identifying the nature of the vibrational modes.     

(E,E)-1,4-双{2''-[5''-(B,B-二甲基苯硼)-2-噻吩基]乙烯基}-苯分子双光子吸收特性的理论研究

在密度泛函水平上,利用响应函数方法,研究了分子的单光子和双光子吸收特性.计算出了该分子在低能量范围内的最大双光子吸收截面为6.47×10-47cm4s/photon,与实验符合的较好.研究结果表明该分子具有较强的双光子吸收特性,是较好的双光子吸收材料.     

溶剂对N-{4-[(反式)-2-(4-硝基苯基)乙烯基]苯基}-N,N-二苯氨基分子双光子吸收特性的影响

在从头计算的基础上,利用两态模型对溶剂对N-{4-[(反式)-2-(4-硝基苯基)乙烯基]苯基}-N,N-二苯氨基分子双光子吸收特性的影响进行了理论研究.计算结果表明,溶剂对该分子的双光子吸收截面影响较大,双光子吸收截面随着溶剂极性的增加而增加.     

Magnetic and microwave absorption properties of BaFe12−x (Mn0.5Cu0.5Zr)x/2O19 synthesized by sol–gel processing

BaFe_12−x (Mn_0.5Cu_0.5Zr)_x/2O₁₉ hexaferrites with x=1, 2 and 3 were prepared by sol–gel process. The ferrite powders possess hexagonal shape and are well separated from one another. The powders of these ferrites were mixed with polyvinylchloride (PVC) plasticizer to be converted into a microwave absorbing composite ferrite with a thickness of 1.8 mm. X-ray diffractometer (XRD), scanning electron microscope (SEM), ac susceptometer, vibrating sample magnetometer and vector network analyzer were used to analyze its structure, electromagnetic and microwave absorption properties. The results showed that magnetoplumbite structures for all samples were formed. The sample with higher magnetic susceptibility and coercivity exhibits a larger microwave absorbing ability. Also the present investigation demonstrates that a microwave absorber using BaFe_12−x(Mn_0.5Cu_0.5Zr)_x/2O₁₉ (x=2 and 3)/PVC with a matching thickness of 1.8 mm can be fabricated for applications over 15 GHz, with reflection loss more than −25 dB for specific frequencies, by controlling the molar ratio of the substituted ions.     

Improvement of the remanence properties and the weakening of interparticle interactions in BaFe12O19 particles by B2O3 addition

In the present study, the effects of B₂O₃ addition on the remanence properties of barium ferrite magnets are examined. The relationship between isothermal magnetization remanence M_R(H) and demagnetization remanence M_D(H) for non-interacting single domain particles, M_D(H)=M_R(H_max)−2M_R(H), was used in order to investigate the interactions between particles. We have found that remanence magnetization M_R increased by 40% in magnitude with B₂O₃ addition in addition to the weakened couplings between particles. The B₂O₃ addition seems to supply the required conditions for usage of these materials in the magnetic recording media.     

Kinetics of oxygen desorption in Y Ba2Cu3O7-δ

In this paper the kinetics of oxygen desorption from Y Ba₂Cu₃O_7-δ has been investigated and measurements carried out in the temperature range 350–750 C. It is shown that the oxygen desorption is diffusion-controlled (and not surface-controlled), and characteristic of diffusion from small grains in a loosely coupled porous matrix. At every temperature a number of time constants with well-defined ratios appear and have been identified and measured. These time constants can be related to the average bulk diffusion constant which shows an Arrhenius behaviour with deviations around 750°C which are ascribed to the well-known orthorhombic to tetragonal transition. In this paper we establish the basic underlying physical mechanism of oxygen desorption in Y Ba₂Cu₃O_7-δ.     

Study on nonlinear optical absorption properties of [(CH3)4N]2[Cu(dmit)2] by Z-scan technique

The third-order optical nonlinearities of an organo-metallic compound, [(CH₃)₄N]₂[Cu(dmit)₂] (dmit²⁻=4,5-dithiolate-1,3-dithiole-2-thione), abbreviated as MeCu, dissolved in acetone are characterized by Z-scan technique with picosecond and nanosecond laser pulses in the near-infrared region. Two-photon absorption has been found when the sample solution is irradiated by 40 ps pulse width at 1064 nm and the two-photon absorption (TPA) coefficient β_TPA is 4×10⁻¹³ m/W. While excited by 15 ns laser pulses at 1053 nm, the Z-scan spectra reveal strong reverse saturable absorption (RSA) and the nonlinear absorption coefficient β_RSA is estimated to be as high as 7.07×10⁻¹¹ m/W which is much larger than β_TPA. An explanation for this enhancement is given. All the results suggest that MeCu may be a promising candidate for the application to optical limiting in the near-infrared region.