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By Jamil M. Khalifeh, Shadia J. Ikhmayies, Bothina A. Hamad

"The structural and electronic properties of cubic d -NbN are investigated using density functional theory (DFT) and all-electron full potential linearized augmented plane wave method (FPLAPW). The equilibrium structural parameters are determined by fitting the total energy as a function of volume to the Murnaghan's equation of state. We calculated the total and partial densities of states (DOS) and compared them with those computed by different authors. Our DOS at Fermi level is found to be very close to the experimental value. The band structure is computed, discussed and used to find the characteristic energy separations. Valence electron density contours are recorded and discussed. We deduced the partial charge densities of different bands and binding energies of valence core levels and compared them with experimental and theoretical results obtained by different authors.IntroductionNiobium nitride has been intensively investigated over the last decades because of its interesting physical properties and technological applications (superconducting microdevices, microelectronic, catalytic probes, and hard coatings) [l]. While the group IV transition metal nitrides (TMN) mainly crystallize in the cubic NaCl structure (Bl type), those of group V and VI nitrides occur as different phases. Thus for niobium nitride, many phases have been reported in the literature: cubic fcc d -NbN, tetragonal ? -Nb4N3, hexagonal d -NbN, hexagonal e -NbN, and low nitrogen content hexagonal ß -Nb2N [l, 2].Structural and electronic properties of niobium nitride were investigated theoretically and experimentally by many authors. For example, in 1975 Schwarz [3] obtained the partial density of states for NbC and NbN from APW band structure calculations. In 1975 Kallne and Pessa [4] studied the electronic structure of Nb, NbC and NbN by using X-ray emission. In 2003 Amriou et al. [5] studied the electronic structure and bonding mechanism of NbC and NbN compounds using first principle total energy calculations using the full-potential linearized augmented plane wave method. Also in 2006 Sanjines et. al [l] studied the electronic structure of the hexagonal~Nb2N, hexagonal' d -NbN, and cubic d -NbN thin fihns by using X-ray photoemission spectroscopy. They [l] also calculated the densities of states for these phases and used them in the interpretation of the experimental valance band spectra. Most of these studies are old and there is a need for more recent studies. According to our knowledge, there are little comprehensive theoretical studies on this subject by using FP-LAPW method [5], which proved its ability to give accurate results. In this work we used the FP-LAPW method to study the structural and electronic properties of the cubic (fee) o-NbN (space group Fm-3m, prototype NaCl) crystal."

Jan 1, 2013

By Ahmad Umar

A variety of ZnO nanostructures such as sea-urchin-like structures composed of nanowires and nanorods, nanocombs, nano/micro spheres and cages, star-shaped ZnO nanostructures, flower-shaped nanostructures, needle-like nanostructures etc. have been synthesized applying two different fabrication techniques i.e. thermal evaporation and cyclic feeding chemical vapor deposition techniques at different reaction parameters such as reaction temperature, growth period, reactant concentrations, types of source material and substrates etc. It was observed from the experiments that the morphologies of the grown structures were highly influenced by the reaction parameters and fabrication techniques and specific morphology can be obtained at particular reaction parameters in a specific synthetic procedure. Extensive morphological investigations of the obtained products demonstrate that the grown structures are single crystalline and having a wurtzite hexagonal phase. Room-temperature photoluminescence spectra of all the deposited products exhibited good optical properties. Finally, the growth process of the fabricated structures were proposed and discussed in detail.

Jan 1, 2006

By Jyri Talja, Shaolong Chen, Hannu Mansikkaviita

"For optimum smelting results, proper treatment of the feed is needed to ensure favourable conditions for ignition characteristics, heat balance, mass balance with tolerable impurity levels, and overall process economics. Feed preparation consists of physical treatments before drying (blending), chemical treatments before drying, (roasting, if required), drying itself and physical treatments after drying (fractioning, if required).Effects of fluctuation on mineralogy and moisture should be minimized by blending the concentrates in a bedding plant prior to drying. As an alternative to drying, additional treatments such as roasting for impurity removal may be needed for part of the concentrate.Sustainability, energy efficiency, utilization of waste energy, low gas and dust emissions, product quality, availability and occupational exposure reduction are decisive criteria in drying today. These criteria are best met by the Kumera steam dryer, which has the best energy efficiency, zero CO2 emission, lowest operational and maintenance expenses, and superior availability and product quality.IntroductionFeed preparation plays a crucial role in having a smooth smelting operation and also the overall smelting economics in metal production. Therefore, it is of significant importance for all copper, nickel and lead smelter operations in which sulphide concentrates are fed to the primary smelting furnace. Generally speaking, the higher the metal content in the matte after primary smelting, the more important the feed preparation. This is of particular importance in the direct blister (DB) process for copper production and direct oxygen nickel (DON) for nickel production.Bedding is the first stage in feed preparation. This is very important for the sake of smoothing the mineralogical fluctuation in the feed for better smelting control. Its importance increases as the number of concentrates available for the feed mix decreases."

Jan 1, 2012

By Christopher Solnordal

A mathematical model was developed to simulate the performance of the reaction shaft at BHP-Billiton?s Olympic Dam copper flash smelter. In order to have confidence in the predictions of the mathematical model, validation was performed by comparing and reconciling the predictions from the model with the results from a campaign of sampling and plant measurements. The model was based on the computational code CFX4.4 utilizing a combustion sub-model purpose-built by CSIRO. The combustion sub-model employed the concept of a composite particle which contained the three components of the solid charge: concentrate, flux and returned dust. Plant measurements were made and samples taken immediately below the burner and through a port halfway down the reaction shaft. Parameters measured included temperature, solid loading and SO2 concentration in the gas. Comparison of the measured and predicted values then showed that: predicted far field gas temperatures were within ±50C of measured values; predicted temperatures in the central plume were lower than measured, and, the predicted plume width was slightly smaller than measured. An optimum composite particle size of 19 m was identified for use in future modeling work at Olympic Dam.

Jan 1, 2006

By Du Sichen

The present paper presents the modeling of gas-solid reactions in the case of the decomposition of CaCO3, describing the reaction kinetics on the basis of heat-transfer concepts which could be compared with thermogravimetric results. In the case of solid-solid reactions, the present paper describes the model developed for describing solid-solid reactions from dynamic X-ray diffraction technique, developed by the present team. The model has been successful in explaining the formation of spinel from MgO and Al2O3.

Jan 1, 2006

By Paul B. Queneau

U.S. plants solely devoted to recovering values from metal-rich wastes have established market niches based on one or more competitive advantages: superior process technology, access to key feedstocks, unique equipment, special knowledge of markets, and an appropriate exit for outfall water. Plant methodology, competitiveness, environmental factors, and economics are examined, with particular attention to feedstocks, technologies, products, and outputs.

Jan 1, 2003

By Alexander I. Raitchenko

"An electroconductive viscous liquid may flow in laminar or turbulent regime under Lorentz-force generated by the intercrossed electric current and magnetic field. When there is a starting flat layer between hard and free boundaries with surface tension the spatial Lorentz-force can create a specific stationary regime of flow: the plane free surface will transform into the wavy one, and the movement in the depth will be not laminar and not turbulent, but this regime will be characterized by organized forms with indications of ""rolling of long cylindrical drops"". Wave-length is determined by the viscosity, the density, the surface tension, the average thickness of layer, and Lorentz-force. ·The limit of wavy regime is determined by most long of wave which is directly proportional to the critical value of specific flow and inversely proportional to the kinetic viscosity. The proper critical value of Reynolds number is determined by the dimensionless combination containing surface tension, density, viscosity, and Lorentz-force. The mentioned dimensio.nless combination in our case is some criterion substituting the known Kapitsa number for case of the thin viscous liquid layers under gravity. Spreading of admixture by mechanism of wavy regime is more rapid than by common diffusion or by laminar flow. The suggested conception can be a contribution into the theoretical basis for elaboration of some specific liquid metals technologies."

Jan 1, 1999

By Leiv Kolbeinsen, Stian Seim, In-ho Jung

"The current work presents new experimental data in the iron-unsaturated region of the FeTiO3-Ti2O3-TiO2 slag system. The samples are prepared by melting pure reactants in a high frequency induction furnace that employs a cold crucible. A similar experimental set-up has been described in literature and proven suitable to investigate high titania slags. The FeO content of the samples range from 3.7 to 21.8 wt% and the Ti2O3 content range from 3.6 to 30.1 wt%. The liquidus temperatures of the samples are measured in-situ by a spectropyrometer and range from 1450 to 1645 °C.In addition, an improved thermodynamic database for the FeO-Ti2O3-TiO2 system has been developed. Ternary parameters have been included and optimized to fit previously published experimental data. This optimization minimizes the discrepancy between experimental data and thermodynamic calculations as previously discussed in literature. New liquidus projection plots are proposed for the FeO-Ti2O3-TiO2 and the FeTiO3-Ti2O3-TiO2 systems.IntroductionIlmenite (FeTiOs) smelting is a relatively small industry world-wide. However, a reasonable focus on the process has been applied in Norway due to the location of one such smelter in Tyssedal, which is located in the western part of Norway. The process is essentially carbothermal reduction, where most of the iron in the ilmenite is reduced to its metallic state, and the titanium oxide is concentrated in the slag product. The metallic iron is sold as a high purity pig iron and finds applications in cast products. The slag concentrate is further processed for the production of TiOvpigment and/or titanium metal. This further processing can be performed through different routes according to the purity of the slag concentrate."

Jan 1, 2012

By Sergio Bustos

Covellite resulting from an original 0.5 % Cu(tot) chalcocite ore has been leached in columns at different temperatures, in the lower range of 10 - 20 °C, under acid - ferric bacterial leaching conditions. Dissolution of copper from covellite depends on the rate and extent of sulphide oxidation by ferric ion. While it is recognised that the dissolution of sulphide minerals is electrochemical in nature, an apparent chemically controlled dissolution pattern was measured with activation energy of 78.09 kJ/mol (18.66 kcal/mol). Ferric iron is the main oxidant and its production and availability will depend on the bacterial activity developed in the system. This activity is characterised by the population size and by the specific oxidation rate of the bacteria. Bacterial growth was followed directly by the number of bacteria appearing in the column effluent solutions and indirectly by the generation of ferric iron or by the total oxidation observed in the columns. These results have been interpreted by using the heap oxidative capacity parameter, which indicates an equivalent ferric production of about 0.07 - 0.15 kg Fe +3/t/day at 20°C. Although bacterial activity decreases to about 0.03 kg Fe +3/t/day with decreasing temperature, a significant bacterial oxidation is still observed at 10 °C. However, extended lag times are observed, which delay the start of bacterial growth to times concurring with covellite leaching. Under these conditions, bacterial activity is displayed through a population controlled by the rate at which- ferrous iron is released from the reducing covellite surface. These results suggest the potential benefit of including some kind of inoculation when operating at lower temperatures. Also, heat loss control and/or heat addition to the heaps should be considered during process design and operation of ferric bacterial heap leaching of secondary copper sulphide ores at temperatures lower than 20°C.

Jan 1, 1999

By Xiyun Yang

Magnetite was prepared by hydrogen reduction method. For a conversion to cobalt-modified magnetite, magnetite particles were suspended into a solution containing Co2+ and Fe2+ to precipitate a cobalt ferrite layer on the surface. pH value influences the particle composition directly, the desirable CoFe2O4 is obtained when pH value is 12. The coercivity increases with the increase of cobalt content, cobalt efficiency reaches a maximum value at cobalt content of 2.71wt%. With cobalt modification, magnetite particles have similar lattice constant and squareness ratio to that without cobalt modification. TEM and XPS analyses indicate that acicular morphology is retained during the coating process, the epitaxial growth layer consists of CoFe2O4and 0.3Co2O3CoFe2O4 at cobalt content of 2.71wt% and 5.03wt%, respectively.

Jan 1, 2006

By D. N. Collins

A sampling program was conducted in which both spoon and isokinetic sampling techniques were used to collect samples from the reaction shaft. The samples were then characterised by chemical, XRD and mineralogical analysis. Further information was acquired by measuring the oxygen potential and temperature at the bottom of the shaft using disposable probes. Comparison of the results of the two sampling methods showed that the spoon samples were devoid of material less than 25 m. Sulfur analyses on the samples provided information on the extent of reaction, plume shape and recirculation patterns. Disposable probe measurements showed the measurable particle temperatures ranged from 1150 to 1700 °C and that the material falling into the bath had a normalised oxygen potential similar to the slag. These latter measurements combined with the sulphur elimination and mineralogical analyses provided further information on the extent of reaction and enabled the reaction sequence to be ascertained.

Jan 1, 1999

By Qingcai Liu

The effect of the TiC addition on corrosion resistance of the Al2O3-C refractories in smelting reduction melts has been studied by quasi-station immersion and rotary immersion. The corrosion rate of Al2O3-C refractories is decreased with the TiC addition. The corrosion mechanism of Al2O3-C refractories is oxidization of graphite carbon by the oxides of the melts and the formation of deteriorate layer.

Jan 1, 2006

By Finn Olesen, Melina Garcia, Mark William Kennedy

"Furnace resistance is a function of the complex interrelationship between many factors including: operating practice, slag conductivity, temperature, power intensity, and geometry (electrode shape, diameter, spacing, immersion, slag depth, etc.).Accurate prediction of resistance is critical for success of the overall furnace design. The sizing of electrodes, columns, bus-bars, and transformers are all impacted. Estimation of minimum and maximum resistance or maximum operational current, as well as the maximum operating voltage are of fundamental importance.Various mathematical tools have been developed to assist designers with the selection of furnace dimensions and the prediction of resistance. Elkem found the methods of Downing and Urban 1965 and Westly 1975, to be particularly useful.In the current paper, comparisons are drawn between data from spent aluminum pot lining (SPL) demonstration testing at Elkem Bjolvefossen and predictions based on these classical tools and 3D finite element modeling (FEM) with COMSOL.®"

Jan 1, 2012

By Guojun Ma

The entrainment of charge materials, evaporation or volatilization of elements and ejection of slag and metal by spitting or the bursting of gas bubbles are mechanisms whereby stainless steel plant dust are generated from the electric arc furnace and refining converter. TCLP and ASTM D 3987-85 tests on dust that was collected from the baghouse filter system of a South African Stainless Steel plant showed that this dust can be considered hazardous according to South African legislation, due to the high degree of Cr (VI) leachability (~13mg/l for TCLP and ~8mg/l for ASTM vs. regulation threshold of 0.05mg/l in drinking water). The dust is therefore considered to be harmful to both the environment and human health, due to its high solubility in water and carcinogenic properties. It should therefore be treated before being stockpiled or land filled. This paper consequently describes an investigation into the formation of Cr(VI)-containing stainless steel plant dust and the stabilisation thereof in a sintering process, whereby the dust was mixed with a silica-rich clay. It is postulated that Cr(VI) form when the (Mg,Fe,Mn,Cr)3O4spinel phase, CaO, Ca(OH)2 and CaF2 (all of which are present in the dust) react. This reaction was found to take place both at ambient and at high temperatures (1100°C). Stabilization of Cr(VI) in the dust could be achieved at an optimum sintering temperature of 1100°C for a 50mass% dust : 50mass% clay mixture. Chromium emission during the sintering process was found to be low, and within environmental limits.

Jan 1, 2006

By P. Barrios

The copper refinery of Atlantic Copper was modernised and converted to the Isa permanent cathode system in 1995. The technology installed has proved to be an excellent platform for the development of operational improvements. During the years it has been working, the progressive assimilation of the new technology has been achieved and the level of operator knowledge has allowed design production to be reached and surpassed by more than 10%. At the same time, modifications to the work programmes, using existing equipment, have permitted the incorporation of new cells and the achievement of annual production levels of 250,000 tonnes and a productivity of 0.43 t/man-hour.

Jan 1, 1999

By B. Wan

The process of synthesizing silica nanopowder by the gas phase thermal oxidation of tetraethylorthosilicate (TEOS) in a diffusion flame reactor was simulated using a commercial computational fluid dynamic (CFD) code. The fuel combustion process and silica particle formation and growth in the flame are modeled. The temperature, velocity and particle size distribution (PSD) fields inside the reactor are computed. Chemical reaction rate and population balance model (PBM) were used to calculate the particle formation and growth and PSD.

Jan 1, 2006

New method for processing of copper and nickel production feed has been developed and tested at pilot unit having 10 t/hr capacity. The process allows single-stage treatment of ore feed including that with high magnesium oxide content and resulting in the production of rich matte, high-grade matte, or moralised alloy for further leaching, as well as dump slag and off-gasses suitable for production of elemental sulphur, liquid sulphur dioxide, or sulphuric acid. Tests results and principal technical and economical parameters are presented.

Jan 1, 2006

By Jin-Chun Kim

Nanosized W based powders (W, WC, WC-Co) were produced by chemical vapor condensation (CVC) process. Two different solid W(CO)6 and Co2(CO)8 metal-organic materials were used as precursors. CVC experiment was conducted in the temperature range of 400-1100. As-CVC WC1-x powder which had non-stoichiometric composition was carburized by using of the CH4-H2 mixed gas in temperature range of 750-850. The CVC W and WC1-x powders showed loosely agglomeration structure, and the Co powder had intricate long stand structure because of intrinsic magnetic properties of Co phase. Carbon content of the CVC powders controlled by gas-phase carburization was well matched with theoretical WC stoichiometry (6.13wt%).

Jan 1, 2006

By M. Z. Sukiennik

A static method for vapor pressure measurement up to 1450 K and above 1 hPa is presented. The method is designed for equilibrium and kinetic studies of metallic systems, including those with a chemical reaction. Application examples are given for determination of activities in condensed phases, and heterogeneous reaction rates and equilibrium constants.

Jan 1, 1993

By J. Partinen

Drying is a unit process which has numerous applications in metallurgical process industry. Kumera Technology Center, being a worldwide equipment and process supplier, has developed sophisticated solutions for both direct and indirect drying. In conventional direct drum drying, the energy is taken from combustion of fossil fuels, requiring energy input and emitting considerable amount of off gases. In modem copper smelters, thermal energy from the off gases is recovered in waste heat boilers making the steam available. Using that steam as the energy source for concentrate drying, the total volume of off gases can be considerably reduced and releasing of harmful combustion gases into the atmosphere can be avoided. Kumera Technology Center has recently developed and promotes a new steam drying process for drying of copper concentrates. In the development of the new dryer, Kumera's approach has been to combine the best properties of both the steam dryers and the drum dryers. In the design special attention has been paid to overcome problems of excessive wear and clogging and to reduce the required maintenance operations. In this paper the environmental issues and energy consumption related to both direct and indirect drying processes are discussed. The estimated operation costs and emission levels are compared, based on calculations and the data collected from industry. Finally, the development project of the Kumera Steam Dryer is briefly reviewed

Jan 1, 1999