Thermodynamic analysis on synthesis of fibrous Ni-Co alloys precursor and Ni/Co ratio control

According to the principles of simultaneous equilibrium and mass equilibrium, a series of thermodynamic equilibrium equations in Ni（II）-Co（II）-C2O4^2--NH3-NH4^＋-H2O system at ambient temperature were deduced. The diagrams of logarithm ion concentrations versus pH values at different solution compositions were drawn. The results show that Ni^2＋ and Co^2＋ can completely precipitate at pH less than 5.0 and the predefined Ni/Co ratios can be well kept in the precursor. The precursor morphology is granular aggregation. However, rod aggregation precursor is obtained in the pH range of 5.0-8.0, and fibre-shape precursor is got at pH value higher than 8.0. The Ni/Co ratios in the above two precursors are not reproduced as that in the feed due to the formhtion of multi-coordinated Ni（NH3）n^2＋ and Co（NH3）n^2＋ （n=1-6）. Modification of precipitation medium is favorable for the precursors to keep the predefined Ni/Co ratios of the feed in the pH range of 2.0-8.6. Meanwhile, the precursors with fibrous morphology can be obtained.

Thermodynamic analysis on the direct preparation of metallic vanadium from NaVO_3 by molten salt electrolysis

A novel and environmentally friendly route to directly prepare metallic vanadium from NaV03 by molten salt electrolysis is proposed. The feasibility about the direct electro-reduction of NaV03 to metallic vanadi- um is analyzed based on the thermodynamic calculations and experimental verifications. The theoretical decomposition voltage of NaV03 to metallic vanadium is only 0.47 V at 800 ℃ and much lower than that of the alkali and alkali earth metal chloride salts. The value is slightly higher than that of low-valence vanadium oxides such as V203, V305 and VO. However, the low-valence vanadium oxides can he further electro-reduced to metallic vanadium thermodynamically. The thermodynamic analysis is verified by the experimental results. The direct preparation of metallic vanadium from NaV03 by molten salt electrolysis is feasible.

Thermodynamic analysis of combined reforming process using Gibbs energy minimization method: In view of solid carbon formation

Thermodynamic analysis was applied to study combined partial oxidation and carbon dioxide reforming of methane in view of carbon formation. The equilibrium calculations employing the Gibbs energy minimization were performed upon wide ranges of pressure （1-25 atm）, temperature （600-1300 K）, carbon dioxide to methane ratio （0-2） and oxygen to methane ratio （0-1）. The thermodynamic results were compared with the results obtained over a Ru supported catalyst. The results revealed that by increasing the reaction pressure methane conversion decreased. Also it was found that the atmospheric pressure is the preferable pressure for both dry reforming and partial oxidation of methane and increasing the temperature caused increases in both activity of carbon and conversion of methane. The results clearly showed that the addition of O2 to the feed mixture could lead to a reduction of carbon deposition.

Thermodynamic analysis on tin precipitation behavior in Ti-bearing peritectic steel after magnesium treatment

TiN,which is ubiquitous in Ti-bearing steel,has a critical influence on both the mechanical properties and the welding process of steel,and therefore researche on the precipitation behavior of TiN in molten steel bath is of great significance.In this paper,Ti-bearing peritectic steel was taken as the study object and FactSage was adopted to explore how the precipitation behavior of typical inclusions in steel was affected by the steel composition.Furthermore,microsegregation models were used to analyze the precipitation process of TiN at solidification front,and the calculation results were finally verified by scanning electron microscope(SEM).Research showed that a multitude of dispersed particles of high melting oxide MgAl2O4 or MgO always existed in molten steel after magnesium treatment.In consideration of the segregation and enrichment of solute elements at the solidification front,the Ohnaka microsegregation model was employed to compute the precipitation during solidification.In the event of the solid fraction reaching 0.95 or more,the concentration product of[Ti][N]at the solidification front exceeded the equilibrium concentration product,then TiN began to precipitate.MgO or MgAl2O4 cores were generally found in TiN particles of peritectic steel after the magnesium treatment,which was consistent with the thermodynamic calculation results.Moreover,the average size of TiN particles was reduced by approximately 49%.This demonstrated that Mg-rich high melting inclusions were formed after the magnesium treatment,by which the heterogeneous nucleation of TiN was promoted it;therefore,favorable nucleation sites were provided for further refining the high-temperature ferrite phase.

Thermodynamic analysis and combined cycle research on recoverable pressure energy in natural gas pipeline

Current research and ways of capturing mechanical energy are discussed in this paper. By the aid of the comprehensive thermodynamic analysis and Aspen simulation tool, the amount of a vailable work that can be produced from capturing the pressure energy has been calculated. Based on the comprehensive thermodynamic analysis, two systems have been proposed to capture pressure energy of natural gas to generate electricity. In this study, the expression of exergy is given which can be used in evaluating purposes. A problem with this multidisciplinary study is the complicated boundary condition. In conclusion, a technical prospect on recoverable natural gas pressure energy has been presented based on total energy system theory.

Thermodynamic analysis of the carbothermic reduction of a high-phosphorus oolitic iron ore by FactSage

A thermodynamic analysis of the carbothermic reduction of high-phosphorus oolitic iron ore（HPOIO） was conducted by the Fact Sage thermochemical software. The effects of temperature, C/O ratio, additive types, and dosages both on the reduction of fluorapatite and the formation of liquid slag were studied. The results show that the minimum thermodynamic reduction temperature of fluorapatite by carbon decreases to about 850°C, which is mainly ascribed to the presence of SiO_2, Al_2O_3, and Fe. The reduction rate of fluorapatite increases and the amount of liquid slag decreases with the rise of C/O ratio. The reduction of fluorapatite is hindered by the addition of CaO and Na_2CO_3, thereby allowing the selective reduction of iron oxides upon controlled C/O ratio. The thermodynamic results obtain in the present work are in good agreement with the experimental results available in the literatures.

Commercial AM60 alloy for semisolid processing:Alloy optimization and thermodynamic analysis

Semisolid processing is now a commercially successful manufacturing route to produce net-shape parts in automotive industry. The conspicuous results of alloy optimization with thermodynamic simulations for semisolid processing of commercial AM60 alloy were present. The results indicate that the available processing temperature range of AM60 alloy is 170 ℃. The temperature sensitivity of solid fraction decreases with increasing solid fraction or with decreasing temperature above eutectic reaction temperature of AM60 alloy. When the solid fraction φs is 0.4, corresponding processing temperature is 603.8 ℃ and the sensitivity -dφs/dT is 0.0184. The effects of various alloying elements on the solidification behavior and SSM processability of AM60 alloy were calculated with Pandat software.

Thermodynamic Analysis of Alternative Marine Fuels for Marine Gas Turbine Power Plants

The marine shipping industry faces challenges to reduce engine exhaust emissions and greenhouse gases （GHGs） from ships, and in particular, carbon dioxide. International regulatory bodies such as the International Maritime Organization and National Environmental Agencies of many countries have issued rules and regulations to drastically reduce GHG and emissions emanating from marine sources. This study investigates the possibility of using natural gas and hydrogen as alternative fuels to diesel oil for marine gas turbines and uses a mathematical model to assess the effect of these alternative fuels on gas turbine thermodynamic performance. Results show that since natural gas is categorized as a hydrocarbon fuel, the thermodynamic performance of the gas turbine cycle using natural gas was close to that of the diesel case. However, the gas turbine thermal efficiency was found to be slightly lower for natural gas and hydrogen fuels compared to diesel fuel.

Thermodynamic analysis of Na−S−Fe−H_(2)O system for Bayer process

Thermodynamic diagrams of Na−S−Fe−H_(2)O system were constructed to analyze the behavior of sulfur and iron in the Bayer process.After digestion,iron mainly exists as Fe_(3)O_(4) and Fe_(2)O_(3) in red mud,and partial iron transfers into solution as Fe(OH)_(3)^(−),HFeO_(2)^(−),Fe(OH)_(4)^(−)and Fe(OH)_(4)^(2−).The dominant species of sulfur is S^(2−),followed by SO_(4)^(2−),and then SO_(3)^(2−)and S_(2)O_(3)^(2−).The thermodynamic analysis is consistent with the iron and sulfur species distribution in the solution obtained by experiments.When the temperature decreases,sulfur and iron can combine and precipitate.Controlling low potential and reducing temperature are beneficial to removing them from the solution.XRD patterns show that NaFeS_(2)·2H_(2)O,FeS and FeS_(2) widely appear in red mud and precipitates of pyrite and high-sulfur bauxite digestion solution.Thermodynamic analysis can be utilized to guide the simultaneous removal of sulfur and iron in the Bayer process.

Thermodynamic Analysis of the Gasification of Municipal Solid Waste

This work aims to understand the gasification performance of municipal solid waste （MSW） by means of thermodynamic analysis. Thermodynamic analysis is based on the assumption that the gasification reactions take place at the thermodynamic equilibrium condition, without regard to the reactor and process characteristics. First, model components of MSW including food, green wastes, paper, textiles, rubber, chlorine-free plastic, and polyvinyl chloride were chosen as the feedstock of a steam gasification process, with the steam temperature ranging from 973 K to 2273 K and the steam-to-MSW ratio （STMR） ranging from 1 to 5. It was found that the effect of the STMR on the gasification performance was almost the same as that of the steam temperature. All the differences among the seven types of MSW were caused by the variation of their compositions. Next, the gasification of actual MSW was analyzed using this thermodynamic equilibrium model. It was possible to count the inorganic components of actual MSW as silicon dioxide or aluminum oxide for the purpose of simplification, due to the fact that the inorganic components mainly affected the reactor temperature. A detailed comparison was made of the composition of the gaseous products obtained using steam, hydrogen, and air gasifying agents to provide basic knowledge regarding the appropriate choice of gasifying agent in MSW treatment upon demand.

Thermodynamic Analysis for Carbothermal Reduction and Nitridation of TiO_2

The diagrams of stability relations（namely,Predominance area phase diagram,PAPD）of nitride,carbide and oxides in Ti-C-N-O system were plotted by thermodynamic calculation.The optimum conditions and main influence factors for the synthesis of titanium nitride and titanium carbide by carbothermal reduction in nitrogen atmosphere were discussed.

Thermodynamic Analysis on Interaction between Molten Ti Alloys and Oxide Molding Materials

A thermodynamic model has been built up for the interactions between molten Ti alloys and oxide molding materials in the way of decomposition and solution of molding materials, then the influences on the reaction free energy changes have been calculated and discussed.

Experimental and Thermodynamic Analysis on Phase Equilibria of Ni-rich Region in Ni-Al-Ti System

Phase equilibria including γ,γ′,η,β and H in Ni Al Ti system were investigated by diffusion couple method and calculated with thermodynamic model.The experimental phase equilibria generally agree with ones reported till now.Regular solution and sublattice models were used in order to calculate these phase equilibria.The calculated results show agreement with experimental data.

Thermodynamic analysis and preparation of β-SiC/ZrO_2 composites

A predominance area diagram for the Zr-Si-C-O system at 1773 K was plotted according to correlative thermodynamic data. β-SiC/ZrO2 composites were prepared based on the phase diagram by carbothermal reduction of zircon （ZrSiO4） in argon atmosphere. Zircon and carbon black were mixed according to the C/ZrSiO4 mass ratio of 0.2, and with 0, 1wt% and 2wt% extra addition of La2O3. Phase evolution of the mixture was investigated at 1723-1803 K by X-ray powder diffraction, and the microstructure of the product prepared at 1803 K for 4 h was examined by scanning electronic microscope. The results show that the decomposition of ZrSiO4 and the formation of β-SIC can be promoted by increasing the heating temperature and adding La2O3. The β-SiC/ZrO2 composites can be prepared at 1803 K for 4 h in a mixture of zircon, carbon black and La2O3, and the contents of β-SIC and m-ZrO2 in the product sample with 2wt% La2O3 reach the highest values of 10.8wt% and 89.2wt%, respectively. The crystal size of the products is about 200 nm.

Thermodynamic Analysis of a Condensate Heating System from a Marine Steam Propulsion Plant with Steam Reheating

The thermodynamic(energy and exergy)analysis of a condensate heating system,its segments,and components from a marine steam propulsion plant with steam reheating is performed in this paper.It is found that energy analysis of any condensate heating system should be avoided because it is highly influenced by the measuring equipment accuracy and precision.All the components from the observed marine condensate heating system have energy destructions lower than 3 kW,while the energy efficiencies of this system are higher than 99%.The exergy efficiency of closed condensate heaters continuously increases from the lowest to the highest steam pressures(from 70.10%to 92.29%).The ambient temperature variation between 5℃and 45℃notably influences the exergy efficiency change of both low pressure heaters and the low pressure segment equal to 31.61%,12.37%,and 18.35%,respectively.

Thermodynamic Analysis of Hydrocarbon Refrigerants-Based Ethylene BOG Re-liquefaction System

The present study aims to make a thermodynamic analysis of an ethylene cascade re-liquefaction system that consists of the following two subsystems: a liquefaction cycle using ethylene as the working fluid and a refrigeration cycle operating with a hydrocarbon refrigerant. The hydrocarbon refrigerants considered are propane(R290), butane(R600), isobutane(R600a), and propylene(R1270). A computer program written in FORTRAN is developed to compute parameters for characteristic points of the cycles and the system's performance, which is determined and analyzed using numerical solutions for the refrigerant condensation temperature, temperature in tank, and temperature difference in the cascade condenser. Results show that R600 a gives the best performance, followed by(in order) R600, R290, and R1270. Furthermore, it is found that an increase in tank temperature improves system performance but that an increase in refrigerant condensation temperature causes deterioration. In addition, it is found that running the system at a low temperature difference in the cascade condenser is advantageous.

Thermodynamic analysis of carbon migration in W1-1.0C steel in plasma surface chromizing

W 1-1.0C steel was chromized at 1173 K with double glow plasma surface alloying process, and the distribution of Fe, Cr, and C contents in the chromized layer was measured using glow discharge spectrum analysis （GDA）. The behavior and mechanism of carbon migration during the formation of chromized layer were studied through thermodynamic analysis and calculation. The gradient of carbon chemical potential was regarded as the driving force of carbon migration. An equation was derived to describe the carbon content varying with the chromium content within the carbon-rich region. The calculated results from the equation approximated closely to the experimental ones.

Thermodynamic analysis of the Ti-Al-N system

Motivated by the application of （Ti, Al）N alloy compound in the coating layer, the ternary phase diagram of Ti-Al-N was analyzed by the calculation of the phase diagram （CALPHAD） technique. The isothermal sections of the Ti-Al-N ternary system were constructed and compared with the literature experimental results. The thermodynamic parameters of the Ti-Al-N ternary system and the related Ti-N and Al-N binary systems were adopted from literatures, whereas, those of the Ti-Al binary from the literatures were adjusted according to both the ternary and the binary phase equilibria. The consistency between the calculated results and the experimental data shows that considering the ternary thermodynamic relationship, the adjustments to the thermodynamic parameters of the related binaries are necessary.

Thermodynamic Analysis and Comparison on Low Temperature CO_2-NH_3 Cascade Refrigeration Cycle

This paper is focused on the cascade refrigeration cycle using natural refrigerant CO 2-NH 3. The properties of refrigerants CO 2 and NH 3 are introduced and analyzed.CO 2 has the advantage in low stage of cascade refrigeration cycle due to its good characteristics and properties. The thermodynamic analysis results of the CO 2-NH 3 cascade refrigeration cycle demonstrates that the cycle has an optimum condensation temperature of low stage and also has an optimum flow rate ratio.By comparing with the R13-R22 and NH 3-NH 3 cascade refrigeration cycles, the mass flow rate ratio of CO 2-NH 3 is larger than those of R13-R22 and NH 3-NH 3, the theoretical COP of CO 2-NH 3 cascade refrigeration cycle is larger than that of the R13-R22 cascade cycle and smaller than that of the NH 3-NH 3 cascade cycle. But the real COP of CO 2-NH 3 cascade cycle will be higher than those of R13-R22 and NH 3-NH 3 because the specific volume of CO 2 at low temperature does not change much and its dynamic viscosity is also small.

Thermodynamic Analysis of Formation of Low-carbon Olefins via Coal Gasification Coupling C_1 Reaction

The complex reaction system of the coal gasification coupling C1 reaction was analyzed based on the principles of thermodynamics. The results show that an increase in the temperature is beneficial to the generation of hydrocarbons with high carbon-atom contents, in which the alkane yield is higher than the alkene yield. The complex reaction system consisting of C, H20, CO, CO2, H2, C2H4, C3H6 and C4Hs was studied, and the obtained results indicated that when the maximum mole fraction content of C2-C4 olefins was regarded as the optimized objective function, the optimum temperature was approximately 648 K, the pressure was 0.1 MPa, the feed ratio was approximately 0.6, and the maximum mole fraction content of C2-C4 olefins was approximately 28.24%. The thermodynamic simulation and calculation of the complex reaction system can provide a basis for the determination and optimization of actual process conditions and are therefore of great theoretical and practical significance.