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By J. -C. Tedenac, C. Colinet, X. Tao, P. Jund, R. Viennois

"We report an ab-initio study of the stability and electronic properties of transition metal silicides in order to study their potential for high temperature thermoelectric applications. We focus on the family M5Si3 (M = Ta, W) which is stable up to about 2000 °C. We first investigate the structural stability of the two compounds and then determine the thermopower of the equilibrium structure using the electronic density of states and Mott’s law. We find that W5Si3 has a relatively large thermopower but probably not sufficient enough for thermoelectric applications.IntroductionIn the search of new sustainable energies, thermogeneration of electricity is one of the promising ways, notably because it is able to produce electricity from different kinds of heat wastes and to its portability. However, despite recent progress in the field, the state-of-the art materials have specificities making their mass-production difficult or even impossible: toxicity (thallium, chalcogen or/and pnictogen based alloys), weak abundance (tellurium based alloys) or cost (germanium or rare-earth based alloys). For all these reasons, finding thermoelectric materials without these drawbacks is vital if we wish to use high temperature thermoelectricity for generating electricity in the near future. Due to their abundance, low cost and low toxicity, transition metal silicides are candidate materials of primary interest and the slightest advance in this field would immediately find an application for the thermogeneration of electricity."

Jan 1, 2011

By C. J. N. Buisman

THIOPAQ technology developed and marketed by PAQUES Bio Systems in Balk, Netherlands, has been successfully used at commercial scale at the Budelco zinc refinery in the Netherlands for the treatment of contaminated groundwater since 1992. In essence, THIOPAQ technology consists of two biological process steps in series: sulfate reduction to hydrogen sulfide (anaerobic) and sulfide oxidation to elemental sulfur (aerobic). The biogenic sulfide produced can be employed for the chemical precipitation of metals in solution either inside the anaerobic reactor or in a separate vessel. Since the solubilities of most metal sulfides are much lower than of their respective hydroxides, considerably lower effluent metal concentrations can be achieved with THIOPAQ systems than in neutralization processes which immobilize metals predominantly by hydrolytic precipitation. In recent years, PAQUES has made significant advances in the design and operation of aerobic and anaerobic bioreactors for metal-sulfur systems. Moreover, the company has increased its technology portfolio to allow the development of more process oriented applications of THIOPAQ technology. A new PAQUES designed plant at Budelco treating sulfatecontaining proceswaters will be started up in 1999. The sulfate reduction is accomplished in a 500 m3 reactor in which hydrogen is used as electron donor. The endproduct, ZnS, is used for Zn and H2S04 production.

Jan 1, 1999

By Yang Wang, Xiancong Zhao, Hao Bai, Qi Shi, Zhancheng Guo

Linz-Donawitz converter gas (LDG) or basic oxygen steelmaking gas (BOSG) is one of the most important secondary energy sources in iron and steel industry, whose effective use plays a vital role in energy saving and emission reduction. However, the generation of LDG suffers from great fluctuation with respect to the production status of steel making. Therefore, a long term prediction model of LDG generation would be essential in gas system balancing and optimization. In this paper, a long term prediction model for the generation volume of LDG was proposed based on the steelmaking production estimation from Gantt chart and k-means clustering algorithm. Compared with the previous model, this model considered the influence of different steel type on LDG generation. The experimental results of a steel plant demonstrate that the proposed model exhibits high accuracy and can provide an effective guidance for balancing and scheduling of byproduct gases.

Jan 1, 2016

By P. K. Jimack, C. E. Goodyer, A. M. Mullis, P. C. Bollada

"We review the application of advanced numerical techniques such as adaptive mesh refmement, implicit time-stepping, multigrid solvers and massively parallel implementations as a route to obtaining solutions to the 3-dimensional phase-field problem with a domain size and interface resolution previously possible only in 2-dimensions. Using such techniques it is shown that such models are tractable even as the interface width approaches the solute capillary length.IntroductionMulti-scale modelling impinges upon many areas of science, engineering and technology where the interplay between processes occurring on disparate length and/or timescales can affect the properties of systems in a complex, and sometimes unforeseen, manner. One such is the processing of materials where interactions at the atomic scale, through the nano- and microstructural scale can have a profound affect on the macro-scale response of engineering components. Here we focus on one such problem, the crystallisation of alloy melts, to illustrate how a range of advanced numerical techniques make the modelling of such systems tractable.The modelling of solidification structures, in particular the growth of dendritic crystals, is a subject of intense and enduring interest within the scientific community, both because dendrites are a prime example of spontaneous pattern formation and they have a pervasive influence on the engineering properties of metals. For alloy systems, which form the vast majority of engineering materials, solidification involves the rejection of both solute and latent heat from the growing solid, forming a coupled diffusion problem in which both the chemical and thermal diffusion equations should be solved. The multi-scale nature of this problem arises from the disparity between the thermal and solutal diffusivities for most liquid metals, which are typically 10-5 m2 s-1 and 10-9 m2 s-1 respectively. The ratio of these two, referred to as the Lewis number (Le =Dia), is therefore typically of the order 10,000 and gives a measure of the multi-scale nature of the problem. In fact, in many cases the thermal diffusivity is so much larger than its solutal counterpart that thermal diffusion is considered instantaneous, wherein the system can be approximated as isothermal such that the multi-scale calculation does not need to be performed. This is certainly a reasonable approach in most conventional castings. However, there is a class of solidification problem in which this approach is far from satisfactory, namely Rapid Solidification (RS). The application of isothermal phase-field models in such situations are highly likely to produce spurious results or to fail totally, particularly for temperatures below To (the temperature at which the free energies of the solid and liquid phases are equal at the concentration of the bulk alloy), wherein partitionless solidification may occur."

Jan 1, 2013

By Kazuaki Mita

There are various intermetallic compounds in the Zn-Fe system. We synthesized them at about 673K. A specimen was examined chemically and X-ray diffraction was applied to ensure the formation of intermetallic compounds. Material containing two phases was placed in a Knudsen type effusion cell and the mass spectrum studied to evaluate the vapor pressure of zinc. The thermodynamic properties of intermetallics was then evaluated through measured intensity.

Jan 1, 1999

By Victor Zavodinsky, Sergey Rogov

"Pseudo-potential fully relaxed total energy calculations are used to predict a hypothetical Si1-xCxO2 (x<0.5) compound formed from SiO2 ß -cristobalite by substitution of some SiO2 complexes by CO2 molecules. The simulation shows that the Si1-xCxO2 compound can be quasi stable if the CO2 content is less than fifty per cent. It is assumed that six-molecule Si6-nCnO12 (n=3) rings can play a role of nucleuses for formation of the Si1-xCxO2 compound from SiO2 and CO2 molecules. Thus, silicon dioxide can be considered as a possible solid store for gaseous CO2.IntroductionThe problem of increasing of CO2 in the Earth atmosphere is one of the main modern problems of mankind. One of conceivable ways to decrease the harmful value of CO2 is to convert a part of it to solid state. Iota et al. [1] reported a polymeric (quartz-like) phase of CO2 solid synthesized at high pressure (~40 GPa) and at high temperature (~1800 K). Shortly after this experimental work, Serra et al. [2] reported a total energy calculation of several possible phases of CO2 using plane wave pseudo-potential density functional theory. They concluded that there should be a transition from a molecular phase to a phase isostructural to SiO2 -quartz in the range of 35 to 60 GPa. The latest calculations by Dong et al. [3] have shown that the more favored solid CO2 phase is ß -cristobalite. Recently, Kume et al. [4] have demonstrated the polymerization of CO2 even at room temperature at high pressures up to 80 GPa. Transformations of gaseous CO2 to different solid phases were studied recently experimentally and theoretically [5-8]. The main obstacle for using synthesized CO2 solid as a solution for the CO2 problem is its pressure instability. However the SiO2 ß -cristobalite with the same structure is stable.The question is whether a silicon-oxide system in which a part of atoms of silicon is replaced by atoms of carbon will be stable? If the answer is positive, this system can be considered, in our opinion, as a possible store for CO2."

Jan 1, 2009

By Mahmood Alemrajabi

When LKAB processes their iron ores in northern Sweden, they generate apatite as a by-product. The apatite has been recovered by flotation and the concentrate contains about 0.4 wt% rare earth elements (REE). Both phosphate rock and REE are listed as critical raw materials for the European union. In the present study, the recovery of REE within the nitrophosphate process of fertilizer production has been studied. In the first stage, the REE are precipitated and isolated as a phosphate concentrate. For further purification and individual separation of REE by solvent extraction, removal of phosphorous from the concentrate to enhance the dissolution of REE in mild acidic solutions is essential. In this study, thermal treatment of the concentrate with sodium hydroxide at elevated temperatures followed by water leaching has been studied in order to separate the phosphorous and thereby facilitate dissolution of the REE. The results show that 95% of total phosphorous initially present in the REE phosphate concentrate is removed after thermal treatment with NaOH 1:1 mass ratio, at 400 °C.

By Jian Li, J. Miles, P. Liu, W. Cook, W. Zheng, Alvin Qian

"High temperature corrosion resistance is one of the key challenges in water-cooled nuclear reactor material development. Iron based materials with low Cr content exhibits superior high temperature mechanical properties. However, due to the relatively low Cr content, their corrosion resistances under supercritical water (SCW) conditions are generally poor. High-Cr alloys, despite their much improved corrosion resistance, often suffer from embitterment due to the precipitation of sigma phase in the microstructure. In this study, corrosion resistance of an in-house produced high Cr steel (25%Cr) showed much better corrosion resistance compared to that of low Cr alloy (14%Cr). This high-Cr steel can potentially be used as a corrosion-resistant coating for structural materials in sew applications.INTRODUCTIONThe supercritical water-cooled reactor (SCWR) concept is one of the promising designs for the next generation nuclear reactor, in which the water coolant is designed to be at about 625°C and 25 MPa at the outlet of the reactor core. Under these relatively high-temperature and high-pressure conditions, the cooling water is at supercritical state. High-temperature mechanical properties, corrosion resistance and radiation damage are some of the key challenges. At present, no single commercial material can meet all the requirements of the severe SCWR in-core conditions. Canada supports research in several key areas of SCWR development, including materials selection. A major focus is on materials development, selection and evaluation for both in-core and out-of-core components.Allen et. al. [1] carried out a comprehensive study on the SCW corrosion resistance up to 600 °C on commercially available high temperature materials including Ni-based super alloys, various types of stainless steels and ferritic/matensitic steels. They concluded that ferritic steels develop a relatively thick but mechanically stable oxide layer, while austenitic alloys develop a thinner oxide layer that has been found to spall in some cases. Of the three types of alloys examined, the Ni-based alloys exhibited the lowest oxide thickness, however pitting was observed in the vicinity of intermetallic precipitates."

Jan 1, 2011

By Yuan Lu, Yiming Rong, Richard D. Sisson Jr

With the development of quench technology, there is a trend of using gas quench to replace liquid quench for less distortion and residual stress. The fundamental difference between the liquid and gas quench is the heat transfer coefficient, not only the values but also the shape of the curve as a function of temperature. The equivalent heat transfer coefficient for the liquid and gas quench is analyzed by simulations and experiments. Even it may result in the same hardness in the liquid and gas quench, the steel microstructure may be different because of the different cooling processes, and therefore other steel properties, such as toughness, may be different. The cooling process, microstructures and properties such as hardness and toughness should be examined when designing the liquid or gas quench processes.

Jan 1, 2015

By Robert D. Pehlke

"The evolution of oxygen steelmaking is reviewed and new operating processes are described. The developments which could impact this technology are summarized. Staged and continuous steelmaking are considered in the light of new technologies. The future opportunities for oxygen steelmaking processes are overviewed. IntroductionThe use of oxygen in steelmaking was originally brought on the scene by the development of pneumatic steelmaking. Sir Henry Bessemer in England originally conceptualized the use of gaseous oxygen in steelmaking, and then he and William Kelly in Eddyville, Kentucky independently developed the original pneumatic process which involved blowing air through a bath of molten pig iron to oxidize the carbon and silicon and produce steel. This process and many following processes, including those which would use pure oxygen gas, have been proposed.Beginning with the first commercial oxygen steelmaking vessels at Linz, Austria in 1952, the world steelmaking industry has adopted this style of processing. In general, the process has involved the use of steel scrap in amounts from 20 to 35% of the metallic charge with molten pig iron produced in blast furnaces making up the remainder. The impurities in the charge are oxidized through the use of oxygen gas injected into the steelmaking vessel.However, currently being adopted into commerical practice and on the horizon are a number of advances in this process which include the use of iron ores as a source of iron and oxygen, the use of an all scrap charge, incorporation of pre-reduced iron, the use of auxillary fuels to change the balance of cold and liquid iron-base charge materials and numerous refining techniques."

Jan 1, 1988

By Xie Gang

The leaching experiment used by bacteria on the low grade sulfide copper ore which is difficult to leach was carried out. Some leaching bacteria which have good physiological and leaching activity were isolated and domesticated, and were adapted to leaching ore. The effective domesticated method was put forward. Some technological parameters such as ore acidification, potential controlling, leaching method, ore granularity, leaching acidity, leaching liquid quantity and acid consumption were obtained by column experiment and leaching ore in situ under the ore well. The results show it could leach 30.62% of copper from the low-grade sulfide copper ore within 24 weeks by column leaching method, and the bioleaching rate of copper is 22.83% by leaching in situ under the ore well in 8 months.

Jan 1, 2006

A rotating-discelectrode system was used to evaluate the electrochemical behaviour of Eu(III) during its reduction in NaCl solutions. The solution pH and NaCl concentration have a great effect on the reduction kinetics. The thermodynamic modelling study also revealed that Eu(III) exists in various forms in NaCl solutions. At a low concentration of NaCl, the predominant species is the free Eu3+. Other Eu-chloro complexes become more predominant when the NaCl concentration increases.

Jan 1, 1992

By John J. Mahoney, George P. Demopoulos, Matthew T. Bohan

In recent times processing of arsenic-laden complex ores and heightened awareness of the detrimental health effects of arsenic has put an increasing burden on metallurgical operations to remove arsenic from processes for disposal in an environmentally stable form. At present, arsenic is removed and prepared for storage by precipitation of insoluble secondary arsenic-bearing minerals. It has been suggested that Ca(II)-Fe(III)-As(V) phases resembling the natural mineral yukonite, under certain conditions, may have a role in controlling arsenic pore water concentrations in arsenical waste storage facilities. In this study, a previous synthesis method of yukonite (Ca3Fe5(AsO4)4(OH)9⋅4H2O) is revisited and new solubility/stability data is presented based on a modified method.

Jan 1, 2014

By V. Bhagavathy

This paper describes a method for the determination of traces of rare earths using energy dispersive x-ray fluorescence spectrometry (EDXRF) after preconcentration of their oxine complexes onto activated carbon. Various parameters that influence adsorptive preconcentration of rare earths onto activated carbon viz. pH, amounts of activated carbon and oxine, time of stirring and aqueous phase volume were systematically studied. A numerical method based on simple least square procedure using fifth order polynomial with 25 consecutive values was developed for smoothing and differentiation of EDXRF data which was previously digitized and averaged. First order derivative EDXRF in conjunction with adsorptive preconcentration on activated carbon enables to determine as low as 10 ppb of each of individual rare earth elements.

Jan 1, 1989

By Yiming Rong, Gang Wang

"Water quenching is one of common heat treatment processes but with complex physical phenomenon, in which vaporizing, bubbling and convection are involved. The general simulation of liquid quenching processes is conducted by using temperature dependent value of heat transfer coefficient (HTC) obtained from experimental measurement under a strong assumption. A preliminary multiphase flow model developed by using Ansys-CFX for water quenching has been presented in this paper, which shows a distributed HTC with a time dependent feature. The conjugate heat transfer is used to describe thermal conduction in the simplified workpiece, and generation, growth and flow of bubbles are modeled by using Eulerian-Eulerian method for the gas-liquid multiphase flow. The simulation result shows the intense variation of heat exchange through the interface between workpiece and liquid, and the unsteady distribution around the solid surface.IntroductionQuenching is a rapid cooling process which makes the desired solid phase transformations happen for the certain material properties. For aluminum alloy, rapid quenching will prevent all phase transformation and generate a supersaturated single phase."

Jan 1, 2012

By Jesús Contreras

Since the commencement of its activities in Huelva in 1970, Atlantic Copper has maintained a course of action that has been more demanding than the successive environmental legislations current at different times. As its primary objective it has sought compatibility between the protection of the environment and both its industrial activity and the social and economic development of the area in which its Metallurgical Complex is located. For this reason, since the seventies it has maintained a continuous programme of investments which have allowed it to attain its present environmental situation. As a consequence of the Environmental Policy of Atlantic Copper, in April 1998 it obtained certification for its Integrated System of Environmental Management (SIGMA) according to international standard IS0-14001, and under European Community Regulation 1836/93 (replaced by the 76112001) for the Eco-Management and Eco-Audit System (EMAS). The SIGMA formalises the environmental management practices of Atlantic Copper and engages it to have available a system that can be fully audited. Atlantic Copper was the first European Company in the non-ferrous metallurgical sector to obtain both the UNE-EN-ISO 14001 certification and the EMAS registration. The present paper reviews the actions by Atlantic Copper in environmental matters that have allowed it to achieve its present position. It also describes the coming stages of improvement planned and the modifications to be carried out in the near future, in particular the criteria for the selection of technologies on the basis of the concept of BAT (Best Available Techniques) introduced by the European Union, and always guided by the final objective of converting Atlantic Copper into a reference within the sector, comparable to the best designed and operated installations in the world.

Jan 1, 2003

By Pradip

The selective adsorption of chemisorbing fatty acids at high temperatures together with the addition of soda ash and lignin sulfonate as depressants is the key to the industrial processing of bastnaesite ores. This paper presents the results of a fundamental investigation that indicate that alkyl hydroxamates can be an alternative collector for the beneficiation of bastnaesite ores that contain barite and calcite as the principal gangue minerals. The primary mechanism for providing sites for the chemisorption of hydroxamate on bastnaesite appears to be through dissolution of cations, formation of the respective hydroxo complexes and readsorption at the interface.

Jan 1, 1989

By C. M. Acuña

Copper losses in slags are of great concern, specially in smelting and slag cleaning processes. It is widely accepted that the suspension of metallic copper and matte droplets is strongly affected by the viscosity of the slag. The Chuquicamata Division of Codelco- Chile produces concentrates high in zinc, an element which reports mainly to the slag phase. The ZnO may affect the viscosity and therefore the copper losses. This work aimed to investigate the effect of lime to control the viscosity of slags, and in turn to control the copper losses. By using the experimental viscosity data and the Stoke&apos;s law, the settling rate of matte prills in various slags was estimated. The results indicate the possibility of increasing the recovery of copper and/or decrease the process time.

Jan 1, 1999

By M. Sadayappan

The grain refinement characteristics of four low-lead and lead-free copper base alloys for plumbing applications were investigated. These are leaded yellow brass (C85800). SeBiLOY III (C89550), silicon brasses (C87500 & C87800) and silicon bronzes (C87600 & C87610); Boron and zirconium were found to be the most effective .grain refiners for copper .alloys produced using the permanent mold cast processes. The study indicates that the type of grain refiner to be used is dependent on the alloy type, alloying constituents and their content. After grain refinement, hot tearing resistance of the alloys was improved but mechanical properties remained unaffected. Alloys refined with boron are prone to the formation of hard spots, which will have adverse effect on the surface quality of the castings during polishing and buffing.

Jan 1, 1999

By A. K. Kyllo

The use of Composite Furnace Module cooling systems has been shown to give improved refractory performance in a number of above bath locations in WMC flash furnaces. To test the behaviour of modules in contact with a melt, a set of instrumented modules have been installed in the reaction shaft of a. nickel flash furnace. The location was chosen to provide a suitably harsh environment to ensure rigorous testing, while still allowing relatively easy access for module installation. The modules were continuously monitored to provide information on the module performance, as well as the temperature in the shaft itself. The shaft temperature showed significant transient behaviour, which resulted in heat fluxes through the modules ranging from 10 to 92 kW m-2. The modules were capable of handling the highest heat flux with no risk of the coolant boiling. This paper details the design and operation of the modules over a period of seven weeks.

Jan 1, 1999