In the ideal A2B2O6O′ pyrochlore structure, the x-value of O atom position is a variable parameter. In Bi1.5ZnNb1.5−xTaxO7 (BZNT) cubic pyrochlores, the x-values alter with the different compositions of Nb/Ta. In this work, a series of initial models for BZNT were established by analyzing X-ray diffraction data. Then three structure modifying methods, including Rietveld refinement, Rietveld refinement with energy and geometry optimization based on quantum mechanics, were employed to obtain the precise models using Materials Studio. Moreover, the reflectivities of BZNT were computed by quantum mechanical simulation based on the refined models. Comparing the simulation results from different modifying models with the experimental results, it is found that Rietveld refinement with energy optimization is the most accurate method for BZNT pyrochlores. According to the simulation results, the different reflectivities correspond well with various x-values of O atom positions in BZNT pyrochlores. 相似文献
Advanced sol–gel methods using a secondary solvent addition into (Pb, La)(Zr, Ti)O3 (PLZT) sol–gel solution and a methanol pre-treatment of sapphire substrates are demonstrated. For the secondary solvent addition, the additive affected the crystallinity and electro-optic (EO) property of PLZT films and only methanol addition can improve them. In addition, the methanol pre-treatment is also appeared to be effective to improve film characteristics.
Through these optimizations, epitaxially grown PLZT thin films on r-cut sapphire are obtained and a high Pockels coefficient which is comparable to those of bulk PLZTs is achieved. It is believed that these PLZT thin films are applicable for integrated EO devices and open the door for the future data communication systems. 相似文献
Inorganic–organic hybrid materials are attracting a strong scientific interest mainly for their outstanding inherent mechanical and thermal properties, which can be traced back to the intimate coupling of both inorganic and organic components. By carefully choosing the experimental parameters used for their synthesis, chemically and thermally stable acrylate-based hybrid material embedding the zirconium oxocluster Zr4O4(OMc)12, where OMcCH2C(CH3)C(O)O, can be deposited as UV-cured films on aluminium alloys.
In particular, the molar ratios between the oxocluster and the monomer, the polymerisation time, the amount of photo-initiator and the deposition conditions, by using an home-made spray-coating equipment, were optimised in order to obtain the best performing layers in terms of transparency and hardness to coat aluminium alloy (AA1050, AA6060 and AA2024) sheets. Furthermore, it was also evaluated whether the hybrid coatings behave as barrier to corrosion.
Several coated samples were prepared and characterised. Environmental scanning electronic microscopy (ESEM) and scratch test were used to investigate the morphology of the films and to evaluate their scratch resistance, respectively. Electrochemical impedance spectroscopy (EIS) was performed in order to evaluate if the coatings actually protect the metallic substrate from corrosion.
In order to measure shear storage modulus (G′) and loss modulus (G″) of the materials used for coatings, bulk samples were also obtained by UV-curing of the precursors solution. Dynamical mechanical thermal analysis (DMTA) was performed in shear mode on cured disks of both the hybrid materials and pristine polymer for comparison. The values of Tg were read off as the temperatures of peak of loss modulus. The length and mass of all the samples were measured before and after the DMTA analysis, so that the shrinkage of the materials in that temperature range was exactly evaluated. 相似文献
The present work is aimed to extend the knowledge of mechanical properties of sandwich structures used for marine applications
focusing on the possibility to increase the performances of such structures by adding a bonder at the skin/core interface.
Therefore, three sandwich structures that are utilised in different structural components of a yacht were realised by manual
lay-up. The mechanical characterisation was performed by flatwise compressive, edgewise compressive and three point flexural
tests. The tests execution has allowed both to determine the mechanical performances and to understand the fracture mechanisms
that take place when the bonder is added in the stacking sequence of the samples. 相似文献
In polyolefin processes the melt index (MI) is the most important control variable indicating product quality. Because of
the difficulty in the on-line measurement of MI, a lot of MI estimation and correlation methods have been proposed. In this
work a new dynamic MI estimation scheme is developed based on system identification techniques. The empirical MI estimation
equation proposed in the present study is derived from the 1st-order dynamic models. Effectiveness of the present estimation scheme was illustrated by numerical simulations based on plant
operation data including grade change operations in high density polyethylene (HDPE) processes. From the comparisons with
other estimation methods it was found that the proposed estimation scheme showed better performance in MI predictions. The
virtual sensor model developed based on the estimation scheme was combined with the virtual on-line analyzer (VOA) to give
a quality control system to be implemented in the actual HDPE plant. From the application of the present control system, significant
reduction of transition time and the amount of off-spec during grade changes was achieved 相似文献
Isotropic conductive adhesives (ICAs) have recently received a lot of focus and attention from the researchers in electronics industry as a potential substitute to lead-bearing solders. Numerous studies have shown that ICAs possess many advantages over conventional soldering such as environmental friendliness, finer pitch printing, lower temperature processing and more flexible and simpler processing. However, complete replacement of soldering by ICAs is yet not possible owing to several limitations of ICAs which are mainly related to reliability aspects like limited impact resistance, unstable contact resistance, low adhesion and conductivity etc. Continued efforts for last 15 years have resulted in development of ICAs with improved properties. This review article is aimed at providing a better understanding of ICAs, their principles, performance and significant research and development work addressing the technological utility of ICAs. 相似文献
The production of steel reinforcing bars for civil engineering is investigated by means of FEM-simulation. An integrated system for computing appropriate thermo-mechanical parameters of the rolling process is proposed. Generalized plane strain approach and coupled thermal-mechanical solution are applied. The microstructural model combines both the effect of the recrystallization mechanisms (static, dynamic and metadynamic) upon the austenite grain forming in hot rolling and that of phase transformation upon the final microstructure. The phases are created during interrupted below the temperature of martensite transition cooling. Thus a typical industrial process for thermo-mechanical strengthening of reinforcing bars, known as Tempcor-process is considered. Computational results are validated to experimental measured mechanical properties of the steel. By means of computer simulation the system can perform different solutions, giving the possibility to obtain a reasonable choice of different thermo-mechanical rolling conditions. 相似文献
ZnO-based varistor samples were prepared by the direct mixing of the constituent phases (DMCP) and sintering at 1100 °C for 2 h. The influence of the starting powder mixture's composition – the amounts of the pre-reacted varistor compounds and their composition – and its preparation, either with or without mechano-chemical activation (MCA), on the microstructure, phase composition and electrical characteristics of the varistor samples was studied. It showed that MCA improved the density and microstructural homogeneity of the varistor samples. MCA strongly affected the grain growth: it enhanced the nucleation of inversion boundaries (IBs) in the ZnO grains and the IBs-induced grain-growth mechanism resulted in uniform grain growth and hence a microstructure with smaller ZnO grains and a narrower grain size distribution. The final phase composition of the samples prepared by the DMCP method mainly depended on the presence of varistor dopants that can prevent the formation of the pyrochlore phase, especially Cr2O3, while MCA can affect it mostly by providing a homogeneous distribution of those dopants. The DMCP varistor samples prepared with MCA had much better current–voltage characteristics than the samples of the same composition prepared from unactivated powders. 相似文献