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By Gennadiy M. Poletayev, Mikhail D. Starostenkov, Alexandra S. Starostenkova

"The process of the combustion synthesis was modeled by computer simulation using the molecular dynamics method. The set of the critical parameters regulating the velocity of the reaction was found from these computer experiments. It was established that the character of structure-energetical transformations at the combustion synthesis in the systems Ni-Al and TiAl depended on the type of boundaries used for the phases delimitation in the bimetal thin films.IntroductionProducing new materials and products, based on the combustion synthesis (CS), is the objective of scientific investigations as one of the most perspective one for industrial applications. But there are several problems connected with theory and experiment. It allows us to forecast the properties of materials. First of all, the main problems are stipulated by structure-energetical transformations taking place at high velocities of the reaction and at high temperatures. It prevents the analyzing of the transformation mechanisms in materials, taking place at microscopic, atomic levels in details.It is evident, that computer simulation allows to decide some problems and to approach to more exact theoretical presentation of structure-energetical reactions taking place at CS. It is known, that the most typical systems, where CS is observed, are bimetals Ni-Al and Ti-Al. The investigation of interphase boundary stability in the systems of Ni-Al and Ni-Fe was made by the method of molecular dynamics in [1]. The bimetal thin film was presented by the packing of atoms in the plane (111) of FCC lattice. It was found that the discrepancy in the sizes of atoms A and B of bimetal was compensated by the formation of 60° top dislocations, set against interphase boundary in the absence of point defects and free volume. The density of top dislocations was proportional to the factor of size discrepancy of atomic components of the bimetal. Diffusional reconstruction of the interphase boundary and areas, situated near it, was observed only at definite concentration of point defects - vacancies, inculcated in the structure of the bimetal at the definite temperature. The atoms of the bimetal component of less size penetrated in the area of the second component with higher velocity. The clusters of intermetallic germs began to form. It led to the growth of the system temperature and acceleration of the process of the diffusional reconstruction of thin film. The following transformations were found: top dislocations splitted into single ones, which climbed from interphase boundary into the zone of more plastic component; the formation of sub grain structures took place."

Jan 1, 2001

By Duclerc Fernandes Parra, Luis Filipe Carvalho Pedroso de Lima, Washington Luiz Oliani, Danilo Marin Fermino, Ademar Benevolo Lugao

The modified polypropylene was obtained from isotactic polypropylene (iPP) in spheres by irradiation with gamma rays in the presence of acetylene. A new morphology with distinct rheology is obtained by this process in which occurs: degradation, branching and/or crosslinking. The objective of this study was to investigate the effects of thermal aging on the crystallinity and morphology of the modified polypropylene, High Melt Strength Polypropylene (HMS-PP). The thermal stability was evaluated after aging of samples using a stove at temperature of 90 °C, in presence of air at different periods of time. Aging effects were characterized by: Thermogravimetry analysis (TG), Differential scanning calorimetry (DSC), Infrared spectroscopy (FTIR) and Scanning electron microscopy (SEM). In thermooxidative conditions, the formation of oxidation products essentially involves a hydrogen abstraction by the peroxyl radical, leading to hydroperoxides as primary products and chemical degradation in the immediate crack tips. The effect of thermal degradation (chain scission and oxygen diffusion) on iPP was a more intense crack formation. Surface cracks increased with the aging time. In comparison of iPP, the modified PP samples had a morphological barrier inhibiting the penetration of oxygen into the sample and in consequence limit the propagation of degradation

Jan 1, 2015

By Tong Zhilin

The reasons why the pits were formed on the cathode in the process of Ni electrowinning and the methods how to prevent these pits from forming are described. Some examples are presented. It has 'been proven that P507 and P204 present in the electrolyte can effectively prevent pits from forming on the cathode.

Jan 1, 1993

By Feng Gao

A general unsteady- state model, based on a cracked substrate, has been developed to account for reaction and diffusion within porous substrate during oxidation of Carbon Fiber Reinforced Carbon matrix (CIC) composites. The effects of several parameters, such as diffusion and reaction rate ratio, oxygen concentration, and composite density, on oxidation process are explored. Also, theoretical results for a set of parameter values of the CIC composites are compared with experimental data. It shows that the model predicted values agreed well with the experimental data in weight loss. Based on this model, quantitative predictions of oxidation of a composite with cracked substrate can be made.

Jan 1, 1993

By Fei Ruan, Chang Jie, Jieyu Zhang, Jifang Xu, Kuochih Chou

"Viscosity is an important physical parameter of slag in metallurgical processes. Most studies of aluminosilicate and aluminate systems assume that aluminum occurs in tetrahedral coordination. In this case, the O/Al value was utilized to describe the slag structure in terms of the network character of aluminosilicate and aluminate systems. Composition and viscosity data from the literature and the trends were analyzed according to the O/Al value and temperature. It is shown that the O/Al value explains the trends in more than ten systems, containing more than 200 data points. In aluminosilicate system, the trend that viscosity value changed with the O/Al value which implies that alumina works as network modifier such as basic oxides or works as network former. In aluminate system, irrespective of the system and temperature, viscosity decreased steadily when O/Al value increased.IntroductionMetallurgical slags, which are made of oxides and many also contain fluorides, play an important role in metallurgical processes such as iron making, steel making and secondary refining processes. Aluminosilicate slags are applied in a wide range in metallurgical processes. A polymerizing effect of the addition of aluminum and an association of aluminum with low-field strength cations is further supported by the physical variations in aluminosilicate and aluminate systems. The behavior of alumina in silicate melts has been studied by various authors [1-6]. It is generally accepted that Al2O3 is amphoteric [7] because Al3+ ions can behave in profoundly different ways in a silicate melt. When added to a pure silica melt, Al2O3 acted as a network modifier, breaking the bridging oxygen of the pure silica network, thereby decreasing the viscosity in a similar manner to other network modifiers, such as CaO, MgO etc. to form [1/2Ca (AlO4)]4- complexes. However, when added with alkali or alkali-earth metal oxides, some of the Al3+ ions assumed tetrahedral coordination and replaced Si in the liquid network, the missing charge was compensated by Me+ or Me2+ ions. Therefore Al2O3 acted as network former [8, 9]."

Jan 1, 2011

By Ruiling DU, Xiao YUAN, Keng Wu, Daan XU, Changyao CHAO

To utilize low grade coals to produce high quality semi-coke which can be used in blast furnaces, the pyrolysis of low grade coals was studied in this paper. According to the characteristics of coal pyrolysis process, the temperature range was divided into three parts. The interfacial chemical reaction model, random pore model and the internal diffusion model with the shrinking volume of resultant were established to describe the different ranges of pyrolysis process respectively. The results showed that the experimental data was fitted well, and all the correlation coefficients (r2) exceeded 0.97. Finally, the kinetic parameters for each temperature range have been calculated, which laid a necessary foundation for the simulation and expanded production.

Jan 1, 2016

By E. A. Thiers

The causes of structural changes in the markets for high technology alloying metals are discussed in terms of technological, economic, and financial trends. Recent market imbalances have affected producers in developed and developing countries differently. Possible response strategies for suppliers in the two types of countries are examined that may alleviate future market imbalances.

Jan 1, 1988

By Joel Anderson

Allvac 718Plus is a newly developed superalloy with a good potential for use in fabricated aircraft engine structures when service temperatures exceed 650°C; the limit for standard alloy 718. Fabrication involves welding, where cracking usually is a prohibitive factor. Comparison of the solidification cracking behavior between these two alloys was made by Transvarestraint testing. It was shown that the total amount of cracking was significantly lower for 718Plus alloy, which was associated with a lower amount of ?/Laves or ?/NbC eutectic-type constituents. This in turn is believed to be due to the lower iron content of the Allvac 718Plus material. The analysis of alloying element segregation both within primary dendrite and interdendritic constituents clearly indicates that the segregation of Nb is the controlling factor in determining the final solidification microstructure in these alloys. The Nb concentrations of these constituents are significantly higher compared to the bulk alloy concentration. This was confirmed by the SEM-EDS analysis and calculations assessed with JMatPro, the latter also indicated that alloy 718 is more prone to form Laves and NbC eutectic-type constituents compared to Allvac 718Plus material.

Jan 1, 2008

By G. Gomathi, K. Asokan, K. Subramanian

An electrochemical reactor with anode and cathode chambers separated by a composite perfluoro polymer cation exchange membrane was designed, fabricated and used for the reduction of dissolved carbon dioxide under ambient conditions to formate. The flow reactor enhanced the mass transfer of carbon dioxide compared to the batch reactor. Experiments were conducted using two different perfluoro polymer membranes - Nafion 961. Efficacy of CO2 reduction on various cathode materials (Cd, Pb, Sn and Zn plated stainless steel woven mesh) were determined. Optimum values of flow rate and current density were evaluated for the energy efficient formation of formate in aqueous KHCO3 (pH 7.5-8.5) buffer solutions.

Jan 1, 2008

By Jorge Gibson, P. Chris Pistorius, Megha Jampani

Increased utilization of natural gas in blast furnace ironmaking can decrease both the cost and the carbon intensity of ironmaking, given current US natural gas prices. In this paper, three ways to utilize natural gas are compared: tuyère injection, prereduction of iron ore, and shaft injection. The basis for comparison includes coke replacement ratios, carbon intensity and furnace productivity. These were calculated using relevant mass and energy balances, a blast furnace productivity correlation based on the bosh gas flow rate, and measured and modeled prereduction kinetics. Of the natural gas utilization methods, prereduction has the highest effective coke replacement ratio (and hence the largest advantage in raw material cost), but is likely to have the highest capital requirement.

Mar 1, 2017

By Zhanjun Wang, Yongqi Sun, Mei Zhang, Zuotai Zhang, Min Guo

The role of fluorine on the viscous and crystallization behavior of CaO-SiO2-MgO-Al2O3-FetO-P2O5-(CaF2) slags were explored using the rotating cylinder method, non-isothermal differential scanning calorimeter (DSC), X-ray diffraction (XRD) and scanning electron microscopy (SEM) techniques. It was found that the viscosity slightly decreased with increasing CaF2 content. It was also found that CaF2 addition can promote the primary phase transformed from MgFe2O4 spinel to Ca3(PO4)F, which was beneficial to the enrichment of phosphorus. Additionally, the structure of the slags explained by X-ray photoelectron spectroscopy (XPS) and magic angular spinning nuclear magnetic resonance (MAS-NMR) were further analyzed, which was well in accordance with the above analysis.

Jan 1, 2016

By A. McLean, Y. Uchida, M. Iwase, M. Myochin, K. Wiikimoto

"Phase diagrams of FeO-containing ternary systems could be derived from experimental data for the activities of FeO. The systems investigated are CaO-CaF2-FeO, SrO-SrF2-FeO; BaO-BaF2-FeO, CaO-CaCl2-FeO, SrO-SrC12-FeO, BaO-BaC12-FeO, CaO-A12O3-FeO and BaO-SiO2-FeO.IntroductionThe importance of phase diagram cannot be overemphasized. In a book, ""Alloy Phase Equilibria""[l], the author, Professor A Prince, states, ""A metallurgist has been defined as a person who thinks in terms of phase diagram"". Whether one accepts this statement or not, it is self-evident that an ability to interpret phase equilibria is essential to the professional metallurgists.The physical chemistry studies of iron and steelmaking process often require phase diagrams of FeO-containing slags. Iso-thermal section of the phase· diagrams of such systems can be derived from experimental data for chemical potentials of FeO. Due to the recent developments in the area of solid state electrochemistry, rapid determinations of the FeO activities have become possible. The present paper is aimed at documenting the derivation of the phase diagrams of FeO containing slags.Experimental AspectsAn electrochemical method incorporating stabilized zirconia can be used for the measurements of the activities of FeO in various slags and fluxes[2]. For the details of the experimental technique, reference should be made to reference 2"

Jan 1, 2000

By Singareddy R. Reddy, Ramana G. Reddy

"The Margules equation is used for interpreting excess Gibbs energy of several ternary systems. An expression for the activity coefficient of a dilute solute, 2(oxygen), in a binary solvent 1-3 is derived. It is used to calculate the logarithmic activity coefficient of oxygen in Pb-O-Gu, Pb-O-Bi, AgO- Sn, Pb-O-Sn and Ag-O-Pb metallic systems. Self interaction parameter of the solute is derived from the partial Gibbs energy of solute using constant compositional path. The derived equation is used successfully to deduce the self interaction parameter of oxygen in Pb-O-Gu and Pb-O-Bi metallic systems. The predicted thermodynamic parameter data i.e activity coefficient and self-interaction parameters are in an excellent agreement with the experimental data and also our predictions are far more accurate than the predictions made by other models.1 IntroductionThe nature of solute interactions such as oxygen, nitrogen and sulfur with the metallic solutions are important for a number of chemical and metallurgical processes. Several theories [1-23] have been developed to evaluate fundamental thermodynamic properties of solutes constituting two elements. The activity of solutes has been calculated using statisticalor quasi- chemical approach.Wagner's [4] Ideal Solvent Model is based on one energy parameter to describe the compositional dependencies of the activity coefficient of nonmetallic solutes such as oxygen in binary metallic solutions. This model depends on a constant energy of interaction for the exchange of atoms from the coordination shell of an oxygen atom to the shell of an interstitial site and cannot account for properties of strongly interacting systems [4]. Therefore, several attempts have been made to improve the Wagner's model for the strongly interacting systems. [10-16]."

Jan 1, 1996

By H. K. Lin

Thermodynamics of Cu-C1-H2O system and the kinetics of copper dissolution in cupric chloride solution were studied with emphasis on possible difficulties which may occur during copper electrowinning. E,-pC1 diagram of this system wasestablished. Equilibriumdistributionof various copper chloride complexes of different valent states at the presence of metallic copper was computed through the relations of the simultaneous equilibria. The mechanism-of copper dissolution in the cupric chloride solutions was proposed and the mechanism of copper electroposition was discussed. The researched results were used for guiding the investigation of copper electrowinning from cupric chloride solution.

Jan 1, 1991

By A. V. Reddy, C. Beckermann

"The DC continuous casting of a grain refined AI-4.5%Cu round ingot with realistic boundary conditions is numerically simulated. Of particular interest are the effects of the transport of free solid in the form of equiaxed grains on the macro segregation patterns and the final grain size distribution. The study uses a previously developed two-phase model that incorporates descriptions of heat transfer, solute redistribution, melt convection, and solid transport on the system scale with microscopic models of solutal undercooling, microsegregation and grain impingement. The numerical results indicate that grain transport inhibits the formation of inverse segregation in the ingot shell and promotes negative centerline segregation. This is explained by the reduction in the solid coherency next to the mold and the advection of solute-lean grains towards the centerline. Comparisons with the experiments of Finn et al. [5] illustrate the need for considerable improvements in the model. IntroductionMacrosegregation continues to be one of the concerns in DC continuous casting of aluminum ingots. The variation in composition over the ingot cross section results in the need to adjust alloy composition in order to meet mechanical property specifications in finished products. The extent of macrosegregation is greatly affected by the casting conditions, such as casting speed, superheat, cooling rate, mold size, alloy composition, and grain refining practices. Thus, it is of great interest to develop a comprehensive mathematical model to simulate the casting process, enabling the selection of conditions that minimize macrosegregation while maintaining a high productivity."

Jan 1, 1994

By Takahiro Miki

Soldering material widely used is Sn-Pb alloy, which have low melting point and excellent electrical, strength properties and wettability. However, Pb is one of the toxic elements, which is undesirable due to environmental and safety reasons, thus Pb-free alternative alloy is preferred for new soldering material. Sn-Ag and Sn-Zn based alloys have been viewed as very promising candidates, among many potential substitutes. Addition of third element to these alloys will decrease melting point of the alloys. Hence, Sn-Ag-In and Sn-Zn-Mg alloys are expected to be suitable for replacing Sn-Pb solder alloy. In order to design new Pb-free soldering materials, it is crucial to understand precise thermodynamic properties and phase diagrams of alloy systems. In the present work, ion current ratios of Ag to In and Mg to Zn were measured for Sn-Ag-In and Sn-Zn-Mg alloys by mass spectrometry, respectively. Also, the authors reviewed the thermodynamic properties of terminal binary alloys determined by other researchers and evaluated a thermodynamic functions to express the excess Gibbs free energy of each binary alloy. Thermodynamic functions to express the excess Gibbs free energy of liquid Sn-Ag-In and Sn-Zn-Mg ternary alloys were determined, utilizing the assessed Gibbs free energy of terminal binary alloys with the measured ion current ratios using mass spectrometer.

Jan 1, 2003

By E. O. Stensholt

The Hybinette electrorefining process for production of cathode nickel was in use at Falconbridge Nikkelverk A/S, Norway, until 1975 when conversion to the new chlorine leach process was started. In 1978 the conversion to electrowinning had been completed, but further major improvements to the process have been made up to 1987. After a major expansion program in 1985 - 87 the refinery has a nickel capacity of 54 000 mt Ni/year. The main feed materials to the process are converter matte from the Falconbridge smelter in Sudbury, Ontario, Canada, and from the BCL smelter in Selebi-Phikwe, Botswana. A typical composition of the mixed feed to the refinery is: 40 - 45% Ni, 25 - 30% Cu, 20 - 22% S, 2 - 3% Fe and 1.0 - 1.5% Co. The matte is chlorine-leached in the first process step, nickel being dissolved selectively in a train of leach-cementation tanks. Essentially all copper and sulphur that was present in matte appears in the leach residue as CuS. In 1986 an autoclave treatment stage was added to the process to improve nickel extraction from the leach residue. The resulting strong nickel chloride solution is purified by the process steps (1) precipitation of iron and arsenic, (2) solvent extraction of cobalt and other minor elements and (3) precipitation of lead and the remaining impurities. The nickel solution is then fed to the tankhouse, where various nickel products are produced by electrowinning. The chlorine gas that is produced during the electrolysis is returned directly to the chlorine leaching tanks to dissolve more matte. After stripping from the loaded organic phase and solution purification cobalt is also produced by electrowinning. The copper sulphide leach residue, which contains some nickel, is dead- roasted in fluidized-bed roasters. The sulphur is recovered and sold as sulphuric acid. The calcine is leached in spent copper electrolyte, from which cathode copper is produced by electrowinning. Precious metals and the remaining base metals are recovered from the copper leach residue. The Falconbridge chlorine process is very versatile. It can accept a wide range of impurities in the feed and still produce metals of exceptional purity.

Jan 1, 1988

By Manju Gurung, Birendra Babu Adhikari, Keisuke Ohto, Hidetaka Kawakita, Katsutoshi Inoue, Shafiq Alam

Novel bio-adsorbent gel was prepared by immobilizing functional groups of glycidyltrimethyl ammonium chloride, a kind of quaternary ammonium chloride, onto polymer matrices of persimmon extract for the recovery of precious metals such as palladium(II) and platinum(IV) from chloride media. It was found that this adsorption gel exhibits high selectivity to gold(III), palladium(II) and platinum(IV) over base metals such as copper(II) and iron(III) while crude persimmon extract, the feed material, exhibits high selectivity only for gold(III). From the adsorption isotherms study, the maximum adsorption capacities for gold(III), palladium(II) and platinum(IV) were evaluated as 3.30, 1.67 and 1.00 mol/kg, respectively. Those for palladium(II) and platinum(IV) are higher than those of simple quaternary ammonium chloride type of chemically modified persimmon tannin gel and commercially available anion exchange resin.

Jan 1, 2016

By Nan Wang

Based on the commercial computational fluid dynamics software, Fluent, a three dimensional finite-volume model has been established, and the fluid flow and heat transfer in the super-wide slab mold (cross section 3250mm×150mm) of Nanjing Iron and Steel Company has been simulated. The basic feature of flow and temperature field in a super-wide mold has been analyzed, and the effects of mold width, the submergence depth of SEN, outlet angle of SEN, casting speed, superheat and cooling rate on the flow and temperature field have been investigated. The results by comparing several simulated calculations for 3250mm×150mm slab show that a more proper fluid flow and temperature field in the super-wide mold can be obtained with 15°outlet angle, 120~150mm submergence depth of SEN and 1.2~1.4m/min casting speed. The results through numerical simulation provide a theoretical basis for optimizing the configuration design of SEN and choosing reasonable processing parameters for the continuous casting mold of super-wide slab.

Jan 1, 2009

By Xirneng Zhu

The electrochemical behavior of Pittsburgh and Illinois coal pyrite in basic and neutral borate/sulfate solutions was investigated. In the transpassive region, aggressive oxidation of pyrite occurred. The reaction products in this region were Fe(III) oxide, sulfate ion and partially oxidized sulfur intermediates. The formation of sulfur and polysulfides was identified by in-situ Raman spectroscopy. The growth kinetics of the reaction product film, resulting from transpassive oxidation of coal pyrites, were studied using chronoamperometry measurement with both stationary and rotating disk electrodes. The reaction rate was well correlated by a paralinear rate equation. The effects of electrode rotation speed, solution pH and temperature were examined. The kinetics were compared to those for mineral pyrite.

Jan 1, 1994