Fe－Mo二元合金显微组织的SEM观察

用扫描电镜观察分析了Ｍｏ含量为２０～５７ｗｔ％的Ｆｅ－Ｍｏ二元合金的显微组织，发现合金的相组成与相平衡图有显著差异，探讨了差异出现的原因。

First-principles thermodynamics of metal-oxide surfaces andinterfaces:A case study review

An important step for achieving the knowledge-based design freedom on nano-and interfacial materials is attained by elucidating the related surface and interface thermodynamics from the first principles so as to allow engineering the microstructures for desired properties through smartly designing fabrication processing parameters.This is demonstrated for SnO2 nano-particle surfaces and also a technologically important Ag-SnO2 interface fabricated by in-situ internal oxidation.Based on defect thermodynamics,we first modeled and calculated the equilibrium surface and interface structures,and as well corresponding properties,as a function of the ambient temperature and oxygen partial pressure.A series of first principles energetics calculations were then performed to construct the equilibrium surface and interface phase diagrams,to describe the environment dependence of the microstructures and properties of the surfaces and interfaces during fabrication and service conditions.The use and potential application of these phase diagrams as a process design tool were suggested and discussed.

Measurements of zinc oxide solubility in sodium hydroxide solution from 25 to 100 °C

The solubility of zinc oxide in sodium hydroxide solution was measured in a closed polytetrafluoroethylene vessel from 25 to 100 ℃. The ZnO solubility was determined by employing the method of isothermal solution saturation. The results show that only ZnO solid exists in the equilibrium state in the low concentration alkali regions, and the solubility of zinc oxide is almost invariable with temperature. With the increase of alkali concentration, equilibrium solid turns from ZnO to NaZn（OH）3 suddenly, this mutation is called invariant point. The alkali concentration of the invariant points increases with increasing temperature, but the solubility of NaZn（OH）3 decreases with increasing alkali concentration at the same temperature. At the same Na2O concentration, the higher the temperature is, the higher the solubility of NaZn（OH）3 is.

Phase equilibrium of CaSO_4Ca(OH)_2-H_2O system

In order to provide the theoretical guidance for applying the neutralization method to treatment of heavy metals wastewater with high concentration of sulfate, and to better understand the mechanism of calcium sulfate scale formation, the equilibrium solubility data of CaSOa-Ca（OH）2-H2O system at 298.15 K were theoretically calculated via the Pitzer semi-empirical ion-interaction theory, and determined experimentally by the optical method combining with X-ray diffractometry, and the calculated and determined phase diagrams of CaSOa-Ca（OH）2-H2O system were plotted and compared. Physical definition of each area was studied, and the physical law of characteristic point and line was explained in detail. Adjusting the pH value of neutralization-hydrolysis solution depended on the SO4z- concentration in the system. And interaction characteristics between the solubilities of CaSO4（s）and Ca（OH）2（s）were found out.

Alloy gene Gibbs energy partition function and equilibrium holographic network phase diagrams of Au_3Cu-type sublattice system

Taking Au3Cu-type sublattice system as an example, three discoveries have been presented. First, the fourth barrier to hinder the progress of metal materials science is that today’s researchers do not understand that the Gibbs energy function of an alloy phase should be derived from Gibbs energy partition function constructed of alloy gene sequence and their Gibbs energy sequence. Second, the six rules for establishing alloy gene Gibbs energy partition function have been discovered, and it has been specially proved that the probabilities of structure units occupied at the Gibbs energy levels in the degeneracy factor for calculating configuration entropy should be degenerated as ones of component atoms occupied at the lattice points. Third, the main characteristics unexpected by today’s researchers are as follows. There exists a single-phase boundary curve without two-phase region coexisting by the ordered and disordered phases. The composition and temperature of the top point on the phase-boundary curve are far away from those of the critical point of the Au3Cu compound; At 0 K, the composition of the lowest point on the composition-dependent Gibbs energy curve is notably deviated from that of the Au3Cu compounds. The theoretical limit composition range of long range ordered Au3Cu-type alloys is determined by the first jumping order degree.

Alloy gene Gibbs energy partition function and equilibrium holographic network phase diagrams of AuCu_3-type sublattice system

Taking AuCu3-type sublattice system as an example, three discoveries have been presented: First, the third barrier hindering the progress in metal materials science is that researchers have got used to recognizing experimental phenomena of alloy phase transitions during extremely slow variation in temperature by equilibrium thinking mode and then taking erroneous knowledge of experimental phenomena as selected information for establishing Gibbs energy function and so-called equilibrium phase diagram. Second, the equilibrium holographic network phase diagrams of AuCu3-type sublattice system may be used to describe systematic correlativity of the composition?temperature-dependent alloy gene arranging structures and complete thermodynamic properties, and to be a standard for studying experimental subequilibrium order-disorder transition. Third, the equilibrium transition of each alloy is a homogeneous single-phase rather than a heterogeneous two-phase, and there exists a single-phase boundary curve without two-phase region of the ordered and disordered phases; the composition and temperature of the top point on the phase-boundary curve are far away from the ones of the critical point of the AuCu3 compound.

Holographic alloy positioning design system and holographic network phase diagrams of Au-Cu system

Taking Au?Cu system as an example, three discoveries and two methods were presented. First, a new way for boosting sustainable progress of systematic metal materials science (SMMS) and alloy gene engineering (AGE) is to establish holographic alloy positioning design (HAPD) system, of which the base consists of measurement and calculation center, SMMS center, AGE center, HAPD information center and HAPD cybernation center; Second, the resonance activating-sychro alternating mechanism of atom movement may be divided into the located and oriented diffuse modes; Third, the equilibrium and subequilibrium holographic network phase diagrams are blueprints and operable platform for researchers to discover, design, manufacture and deploy advanced alloys, which are obtained respectively by the equilibrium lever numerical method and cross point numerical method of isothermal Gibbs energy curves. As clicking each network point, the holographic information of three structure levels for the designed alloy may be readily obtained: the phase constitution and fraction, phase arranging structure and properties of organization; the composition, alloy gene arranging structure and properties of each phase and the electronic structures and properties of alloy genes. It will create a new era for network designing advanced alloys.

Liquid-solid Equilibria in Quinary System Na^＋,K^＋,Mg^2＋//Cl^-,NO3^--H2O at 25°C

The solubilities of the quinary system Na^＋ ,K^＋ ,Mg^2＋ //Cl ,NO 3 ^-H2O and its two quaternary subsystems, Na^＋ ,K^＋ ,Mg^2＋ //NO 3 -H2O and K^ ＋ ,Mg ^2＋ //Cl ,NO 3 ^-H2O,were studied by isothermal method at 25°C and their phase diagrams were plotted.In the equilibrium phase diagram of quaternary system Na^ ＋ ,K^ ＋ ,Mg ^2＋ //NO 3 ^-H2O, there are one invariant point,three univariant curves and three regions of crystallization with one salt：NaNO3, KNO3 and Mg（NO3）2·6H2O.In the equilibrium phase diagram of quaternary system K ^＋ ,Mg ^2＋ //Cl ,NO 3 ^-H2O,there are three invariant points,seven univariant curves and five regions of crystallization with one salt：KNO3,KCl, Mg（NO3）2·6H2O,MgCl2·6H2O and KCl·MgCl2·6H2O.In the equilibrium phase diagram of the quinary system Na ^＋ , K^ ＋ ,Mg ^2＋ //Cl ,NO 3^ -H2O,there are four invariant points,and seven regions of crystallization with one salt：NaCl, KCl,NaNO3,KCl·MgCl2·6H2O,KNO3,MgCl2·6H2O and Mg（NO3）2·6H2O.

Theoretical research on vacuum separation of Au-Ag alloy

To provide an accurate prediction of the product component dependence of temperature and pressure in vacuum distillation and give convenient and efficient guidance for the designing of the process parameters of industrial production, according to the molecular interaction volume model(MIVM), the separation coefficient(β) and vapor-liquid equilibrium composition of Au-Ag alloy at different temperatures are calculated. Combined with the vapor-liquid equilibrium(VLE) theory, the VLE phase diagrams, including the temperature-composition(T-x) and pressure-composition(p-x) diagrams of Au-Ag alloy in vacuum distillation are plotted. The triple points and condensation temperatures of gold and silver vapors are calculated as well. The results show that the β decreases and the contents of gold in vapor phase increase with the distillation temperature increasing. Low pressures have positive effect on the separation of Ag and Au. The difference between the condensation temperatures of gold and silver is about 450 K in the pressure range of 1-10 Pa.

Vertical section phase diagrams of La−Fe−B ternary system

The vertical sections of the La−Fe−B system were investigated using electron probe microanalysis and differential thermal analysis.Based on the microstructures and phase compositions of the as-cast and equilibrium alloys,together with their heat flow−temperature curves,phase diagrams for three vertical sections were drawn:La_(x)Fe_(82)B_(y)(x+y=18),La_(x)Fe_(70)B_(y)(x+y=30)and La_(x)Fe_(53)B_(y)(x+y=47),where x and y represent mass fraction of La and B,respectively,%.Additionally,according to the phase diagrams,the compound La2Fe14B was identified as a stable phase at high temperatures.It was found to be stable between 926.2 and 792.6℃;at low temperatures,however,it decomposed into α-La,α-Fe and LaFe_(4)B_(4),according to the reaction La_(2)Fe_(14)B→α-Fe+α-La+LaFe_(4)B_(4).

Golay Sequence Based Time-Domain Compensation of Frequency-Dependent I/Q Imbalance

A time-domain frequencydependent I/Q imbalance compensation scheme based on Golay complementary sequence for receiver is presented. By utilizing property of Golay sequence, the signal and its conjugate interference(image interference)in preamble are separated by correlation and used to estimate I/Q imbalance parameters.After that, a Least Square(LS) estimation of compensation filter is obtained and adopted in the compensation structure. Two applications of the presented algorithm are discussed: we could either estimate the channel along with I/Q imbalance or estimate the imbalance parameter only to maintain a lower cost. Both applications are testified by simulation. The results show that the image interference is significantly suppressed even in poor SNR condition, and the computation cost of the algorithms is low.

High-pressure Vapor-Liquid Equilibrium Studies for DME-CO_2-CH_3OH and DME-CO_2-C_2H_5OH Systems

In this study, the Gibbs-Duhem equation was applied to make the thermodynamic consistency test and thermodynamic model estimation for systems of CO2-DME (dimethyl ether), DME-CH3OH, CO2-CH3OH and DME-C2H5OH systems on the basis of the vapor-liquid equilibrium (VLE) experimental data in published reports. And the NRTL binary interaction parameters of the systems mentioned above were regressed by the VLE data and were subjected to a thermodynamic consistency test because the study showed that PR-NRTL model combination was appropriate for the four systems mentioned above. The regressed binary interaction parameters were used to es-timate the VLE for DME-CO2-CH3OH at temperatures of 313.15K and 333.15K, and the estimated result was coin-cident with the experimental data. On the basis of the predicted VLE data for systems of DME-CO2-CH3OH and DME-CO2-C2H5OH, the VLE behaviors of the two systems were studied by the phase diagrams of these two ter-nary systems, with the forms of both the two dimensional and three dimensional phase diagrams, respectively.

Phase equilibria in the Mg-rich corner of the Mg-Zn-La system at 350°C

The phase equilibria in the Mg-rich comer of the Mg-Zn-La system at 350℃ have been investigated by scanning electron microscopy, X-ray diffraction, and electron probe microanalysis. It has been shown that the linear compound （Mg,Zn）17La2 existed in the Mg-Zn-La system at 350℃. The linear cornpound （so-called Tphase） was with the C-centred orthorhombic crystal structure induced by the solution of significant quantities of the third element. The three-phase region α（Mg） ＋ MgZn（La） ＋ T and the two-phase region composed of the α（Mg） and the linear-compound T phase existed in the Mg-rich comer of the Mg-Zn-La system at 350℃.

Study on Solution Crystallization of Musk Ketone and Musk Xylene

The ternary phase diagrams of musk ketone, musk xylene and various solvent were obtained by calcu- lations. Moreover, the double saturated lines were found to be curve for the first time. The methods to separate eutectic mixtures of musks by solution crystallization were suggested on the basis of these phase diagrams. A new process was proposed to get musk ketone and musk xylene from the eutectics by adding acetonitrile and heptane in turn, which was verified by experiments. Musk xylene with purity of 97.50% and musk ketone with purity of 98.10% were obtained.

Experimental measurement and thermodynamic modeling of binary and ternary solid–liquid phase equilibrium for the systems formed by L-arabinose,D-xylose and water

Solid–liquid phase equilibrium data for binary(L-arabinose–water) and(D-xylose–water) systems at temperatures from(269.85–298.05) K and ternary(L-arabinose–D-xylose–water) system at temperatures of 273.85 K,278.85 K and 284.45 K were measured at atmospheric pressure.The ternary phase diagrams of the systems were constructed on the base of the measured solubility.Two pure solid phases were formed at given temperatures,including pure L-arabinose and pure D-xylose,which were con firmed and determined by the method of Schreinemakers' wet residue.At the same temperature,the crystallization region of L-arabinose was larger than D-xylose's.The acquired solubility data were then correlated using the NRTL model,Wilson model and Xu model.The calculated solubility with the three models agreed well with the experimental values.

电石生产工艺再认识

电石生产行业自行业问世已经发展了一个多世纪,距国内第一台电石炉建成至今,已经有70年的历史,从最初的一盏电石灯到金属切割和焊接,再到现今的有机合成工业、钢铁脱硫和制造乙炔的重要原料,电石的应用愈发广泛.但人们的眼中,电石生产仍然是一个“神秘”的行业.在电石产能迅猛发展的今天,电石生产可以说是遍地开花,但对于电石生产的核心操作却是五花八门,没有一个统一的操作标准,本文将电石生产理论与实际相结合,帮助我们重新认识电石生产.

Effect of Cu content on the glass forming ability of Cu-Zr-Ti system studied by ion beam mixing

Based on the Cu-Zr-Ti ternary phase diagram,four sets of Cu-Zr-Ti multilayered films with various compositions of Cu20Zr36Ti44,Cu36Zr31Ti33,Cu49Zr24Ti27,and Cu67Zr16Ti17 were prepared and then the ion beam mixing was carried out.It turned out that the increase of Cu content doesn't always have a positive effect on the glass forming ability.The glass forming ability of Cu49Zr24Ti27 was degraded due to the appearance of a Cs Cl-type B2 structure Cu Zr phase in the eutectic region.The experimental observations justify the existence of the Cu Zr phase under the non-equilibrium condition.Possible formation mechanisms for the crystalline phase were also discussed in terms of the atomic collision theory.