The mineral transition and formation mechanism of calcium aluminate compounds in CaO-Al2O3-Na2O system during the hightemperature sintering process were systematically investigated using DSC-TG,XRD,SEM-EDS,FTIR,and Ra...The mineral transition and formation mechanism of calcium aluminate compounds in CaO-Al2O3-Na2O system during the hightemperature sintering process were systematically investigated using DSC-TG,XRD,SEM-EDS,FTIR,and Raman spectra,and the crystal structure of Na4Ca3(AlO2)10 was also simulated by Material Studio software.The results indicated that the minerals formed during the sintering process included Na4Ca3(AlO2)10,CaO·Al2O3,and 12 CaO·7 Al2O3,and the content of Na4Ca3(AlO2)10 could reach 92 wt%when sintered at 1200°C for 30 min.The main formation stage of Na4Ca3(AlO2)10 occurred at temperatures from 970 to 1100°C,and the content could reach82 wt%when the reaction temperature increased to 1100°C.The crystal system of Na4Ca3(AlO2)10 was tetragonal,and the cells preferred to grow along crystal planes(110)and(210).The formation of Na4Ca3(AlO2)10 was an exothermic reaction that followed a secondary reaction model,and its activation energy was 223.97 kJ/mol.展开更多
Finite-temperature ductility-brittleness and electronic structures of Al_(3)Sc,Al_(2)Sc and AlSc are studied comparatively by first-principles calculations and ab initio molecular dynamics.Results show that Al_(3)Sc a...Finite-temperature ductility-brittleness and electronic structures of Al_(3)Sc,Al_(2)Sc and AlSc are studied comparatively by first-principles calculations and ab initio molecular dynamics.Results show that Al_(3)Sc and Al_(2)Sc are brittle at both ground state and finite temperatures,while AlSc possesses a significantly superior ductility.At ground state,AlSc is ductile from Pugh's and Poisson's criteria,while it is brittle in Pettifor's model.The ductility of all Al_(3)Sc,Al_(2)Sc and AISc improves greatly with the elevated temperature.Especially,the Cauchy pressure of AlSc undergoes a transition from negative to positive.At T>600 K,AlSc is unequivocally classified as ductile from all criteria considered.In all compounds,the Al-Al bond originated from s-p and p-p orbital hybridizations,and the Al-Sc bond dominated by p-d covalent hybridization,are the first and second strongest chemical bonds,respectively.To explain the difference in mechanical properties,the mean bond strength(MBS)is introduced in this work.The weaker Al-Al bond in AlSc,leading to a smaller MBS,could be the origin of the softer elastic stiffness and superior intrinsic ductility.The longer length of the Al-Al bond in AlSc is responsible for its weaker bond strength.Furthermore,the enhanced metallicity of the Al-Al bond in AlSc would also contribute to its exceptional ductility.The longer length of the Al-Al bond in AISc is responsible for its weaker bond strength.Furthermore,the enhanced metallicity of the Al-Al bond in AlSc would also contribute to its exceptional ductility.展开更多
The effect of lime on the pre-desilication and digestion of gibbsitic bauxite in synthetic sodium aluminate liquor at different tem- peratures was investigated. The bauxite is comprised of gibbsite, aluminogoethite, h...The effect of lime on the pre-desilication and digestion of gibbsitic bauxite in synthetic sodium aluminate liquor at different tem- peratures was investigated. The bauxite is comprised of gibbsite, aluminogoethite, hematite, kaolin, quartz, and minor boehmite. Lime in- creases the desilication efficiency of the bauxite during the pre-desilication process by promoting the conversion of sodalite and cancrinite to hydrogamet. Desilication reactions during the digestion process promoted by lime result in the loss of A1203 entering the red mud, but the amount of aluminogoethite-to-hematite conversion promoted by lime leads to the increase of aluminogoethific A1203 entering the digested liquor. The alumina digestion rate at 245~C is higher than that at 145 C due to the more pronounced conversion of aluminogoethite to hema- tite. The soda consumption during the digestion process decreases due to lime addition, especially at higher temperatures.展开更多
The formation kinetics and mechanism of tricalcium aluminate hydrate and calcium oxalate in dilute sodium aluminate solution and sodium oxalate solution were studied respectively based on the lime causticization, and ...The formation kinetics and mechanism of tricalcium aluminate hydrate and calcium oxalate in dilute sodium aluminate solution and sodium oxalate solution were studied respectively based on the lime causticization, and the optimal conditions for removing the oxalate in dilute sodium aluminate solution as well as the mechanism were finally obtained.The formation processes of tricalcium aluminate hydrate and calcium oxalate are mainly controlled by the chemical reaction and the inner diffusion respectively,and the corresponding reaction rate equations as well as the apparent activation energy were calculated. The hydrocalumite with a spatially interleaved structure will form in dilute sodium aluminate solution with sodium oxalate, greatly removing the oxalate impurity by absorption. Calcium oxalate can be converted to tricalcium aluminate hydrate with the increasing reaction time. The oxalate causticization efficiency and the alumina loss rate can be over 90% and below 31% respectively when reacted at 50℃ with a stirring rate of 200 r/min.展开更多
A two-stage oxidation—alkali leaching—acid leaching method was proposed to recovery Fe,V,and Ti in modified Ti-bearing blast furnace slag.The optimal experiment conditions of iron extraction were one-stage oxidation...A two-stage oxidation—alkali leaching—acid leaching method was proposed to recovery Fe,V,and Ti in modified Ti-bearing blast furnace slag.The optimal experiment conditions of iron extraction were one-stage oxidation time 40 s and holding time 8 min.The recovery rate of iron was 89.93%.The optimum experiment conditions of vanadium extraction were total oxidation time of 126 s,NaOH concentration of 4.0 mol/L,leaching temperature of 95℃,leaching time of 90 min,and the number of cycle was 4.The leaching rate of vanadium was 92.13%.The optimal experiment conditions of titanium extraction were HCl concentration of 4.5 mol/L,leaching temperature of 75℃,and leaching time of 90 min.The TiO_(2)content of synthetic rutile was 98.61%.展开更多
The rapid development of photovoltaic (PV) industries has led to a shortage of silicon feedstock. However, more than 40% silicon goes into slurry wastes due to the kerf loss in the wafer slicing process. To effectiv...The rapid development of photovoltaic (PV) industries has led to a shortage of silicon feedstock. However, more than 40% silicon goes into slurry wastes due to the kerf loss in the wafer slicing process. To effectively recycle polycrystalline silicon from the kerf loss slurry, an innovative double-layer organic solvent sedimentation process was presented in the paper. The sedimentation velocities of Si and SiC particles in some organic solvents were investigated. Considering the polarity, viscosity, and density of solvents, the chloroepoxy propane and carbon tetrachloride were selected to separate Si and SiC particles. It is found that Si and SiC particles in the slurry waste can be successfully separated by the double-layer organic solvent sedimentation method, which can greatly reduce the sedimentation time and improve the purity of obtained Si-rich and SiC-rich powders. The obtained Si-rich powders consist of 95.04% Si, and the cast Si ingot has 99.06% Si.展开更多
The effect of rutile crystal shapes on its settlement in a modified slag was studied by theoretical analysis,FactSage simulation,X-ray diffraction and scanning electron microscopy.The results show that the settling ve...The effect of rutile crystal shapes on its settlement in a modified slag was studied by theoretical analysis,FactSage simulation,X-ray diffraction and scanning electron microscopy.The results show that the settling velocities of spherical rutile crystals are faster than those of other shapes of rutile crystals under the same volume conditions,and the shape transformation of rutile crystals from rod to sphere can be achieved by adding titanium slag to Ti-bearing blast furnace slag.The volume fractions of the rutile crystals in the upper and lower parts of the modified slag are 30%and 71%when the added titanium slag increases to 278 g,indicating that rutile settling is obvious.Due to the rutile settling,half shaker sorting task is saved,and the recovery rate of TiO2 is significantly increased.The TiO2 content of rutile is greater than 93%,and the total content of CaO and MgO is less than 0.4%,meeting the requirements for the raw materials of titanium white in the chloride process.展开更多
基金financially supported by the National Key R&D Program of China(No.2018YFC1901903)the National Nature Science Foundation of China(Nos.51674075 and 51774079)the Fundamental Research Funds for the Central Universities,China(No.N182508026)。
文摘The mineral transition and formation mechanism of calcium aluminate compounds in CaO-Al2O3-Na2O system during the hightemperature sintering process were systematically investigated using DSC-TG,XRD,SEM-EDS,FTIR,and Raman spectra,and the crystal structure of Na4Ca3(AlO2)10 was also simulated by Material Studio software.The results indicated that the minerals formed during the sintering process included Na4Ca3(AlO2)10,CaO·Al2O3,and 12 CaO·7 Al2O3,and the content of Na4Ca3(AlO2)10 could reach 92 wt%when sintered at 1200°C for 30 min.The main formation stage of Na4Ca3(AlO2)10 occurred at temperatures from 970 to 1100°C,and the content could reach82 wt%when the reaction temperature increased to 1100°C.The crystal system of Na4Ca3(AlO2)10 was tetragonal,and the cells preferred to grow along crystal planes(110)and(210).The formation of Na4Ca3(AlO2)10 was an exothermic reaction that followed a secondary reaction model,and its activation energy was 223.97 kJ/mol.
基金financially supported by the National Key R&D Program of China(No.2022YFB3504401)。
文摘Finite-temperature ductility-brittleness and electronic structures of Al_(3)Sc,Al_(2)Sc and AlSc are studied comparatively by first-principles calculations and ab initio molecular dynamics.Results show that Al_(3)Sc and Al_(2)Sc are brittle at both ground state and finite temperatures,while AlSc possesses a significantly superior ductility.At ground state,AlSc is ductile from Pugh's and Poisson's criteria,while it is brittle in Pettifor's model.The ductility of all Al_(3)Sc,Al_(2)Sc and AISc improves greatly with the elevated temperature.Especially,the Cauchy pressure of AlSc undergoes a transition from negative to positive.At T>600 K,AlSc is unequivocally classified as ductile from all criteria considered.In all compounds,the Al-Al bond originated from s-p and p-p orbital hybridizations,and the Al-Sc bond dominated by p-d covalent hybridization,are the first and second strongest chemical bonds,respectively.To explain the difference in mechanical properties,the mean bond strength(MBS)is introduced in this work.The weaker Al-Al bond in AlSc,leading to a smaller MBS,could be the origin of the softer elastic stiffness and superior intrinsic ductility.The longer length of the Al-Al bond in AlSc is responsible for its weaker bond strength.Furthermore,the enhanced metallicity of the Al-Al bond in AlSc would also contribute to its exceptional ductility.The longer length of the Al-Al bond in AISc is responsible for its weaker bond strength.Furthermore,the enhanced metallicity of the Al-Al bond in AlSc would also contribute to its exceptional ductility.
基金the National Natural Science Foundation of China(Nos.51104041 and 51174054)
文摘The effect of lime on the pre-desilication and digestion of gibbsitic bauxite in synthetic sodium aluminate liquor at different tem- peratures was investigated. The bauxite is comprised of gibbsite, aluminogoethite, hematite, kaolin, quartz, and minor boehmite. Lime in- creases the desilication efficiency of the bauxite during the pre-desilication process by promoting the conversion of sodalite and cancrinite to hydrogamet. Desilication reactions during the digestion process promoted by lime result in the loss of A1203 entering the red mud, but the amount of aluminogoethite-to-hematite conversion promoted by lime leads to the increase of aluminogoethific A1203 entering the digested liquor. The alumina digestion rate at 245~C is higher than that at 145 C due to the more pronounced conversion of aluminogoethite to hema- tite. The soda consumption during the digestion process decreases due to lime addition, especially at higher temperatures.
基金Project(2018YFC1901903)supported by the National Key R&D Program of ChinaProjects(51774079,51674075)supported by the National Natural Science Foundation of ChinaProject(N182508026)supported by the Fundamental Research Funds for the Central Universities,China
文摘The formation kinetics and mechanism of tricalcium aluminate hydrate and calcium oxalate in dilute sodium aluminate solution and sodium oxalate solution were studied respectively based on the lime causticization, and the optimal conditions for removing the oxalate in dilute sodium aluminate solution as well as the mechanism were finally obtained.The formation processes of tricalcium aluminate hydrate and calcium oxalate are mainly controlled by the chemical reaction and the inner diffusion respectively,and the corresponding reaction rate equations as well as the apparent activation energy were calculated. The hydrocalumite with a spatially interleaved structure will form in dilute sodium aluminate solution with sodium oxalate, greatly removing the oxalate impurity by absorption. Calcium oxalate can be converted to tricalcium aluminate hydrate with the increasing reaction time. The oxalate causticization efficiency and the alumina loss rate can be over 90% and below 31% respectively when reacted at 50℃ with a stirring rate of 200 r/min.
基金financial support from the National Science and Technology Support Program of China(No.2015BAB18B00)。
文摘A two-stage oxidation—alkali leaching—acid leaching method was proposed to recovery Fe,V,and Ti in modified Ti-bearing blast furnace slag.The optimal experiment conditions of iron extraction were one-stage oxidation time 40 s and holding time 8 min.The recovery rate of iron was 89.93%.The optimum experiment conditions of vanadium extraction were total oxidation time of 126 s,NaOH concentration of 4.0 mol/L,leaching temperature of 95℃,leaching time of 90 min,and the number of cycle was 4.The leaching rate of vanadium was 92.13%.The optimal experiment conditions of titanium extraction were HCl concentration of 4.5 mol/L,leaching temperature of 75℃,and leaching time of 90 min.The TiO_(2)content of synthetic rutile was 98.61%.
基金financially supported by the National Natural Science Foundation of China(No.51074043)the National Key Technology R&D Program(No.2011BAE03B00)the Fundamental Research Funds for the Central Universities(No.N120409004)
文摘The rapid development of photovoltaic (PV) industries has led to a shortage of silicon feedstock. However, more than 40% silicon goes into slurry wastes due to the kerf loss in the wafer slicing process. To effectively recycle polycrystalline silicon from the kerf loss slurry, an innovative double-layer organic solvent sedimentation process was presented in the paper. The sedimentation velocities of Si and SiC particles in some organic solvents were investigated. Considering the polarity, viscosity, and density of solvents, the chloroepoxy propane and carbon tetrachloride were selected to separate Si and SiC particles. It is found that Si and SiC particles in the slurry waste can be successfully separated by the double-layer organic solvent sedimentation method, which can greatly reduce the sedimentation time and improve the purity of obtained Si-rich and SiC-rich powders. The obtained Si-rich powders consist of 95.04% Si, and the cast Si ingot has 99.06% Si.
基金Project(2015BAB18B00)supported by the National Science and Technology Support Program of China。
文摘The effect of rutile crystal shapes on its settlement in a modified slag was studied by theoretical analysis,FactSage simulation,X-ray diffraction and scanning electron microscopy.The results show that the settling velocities of spherical rutile crystals are faster than those of other shapes of rutile crystals under the same volume conditions,and the shape transformation of rutile crystals from rod to sphere can be achieved by adding titanium slag to Ti-bearing blast furnace slag.The volume fractions of the rutile crystals in the upper and lower parts of the modified slag are 30%and 71%when the added titanium slag increases to 278 g,indicating that rutile settling is obvious.Due to the rutile settling,half shaker sorting task is saved,and the recovery rate of TiO2 is significantly increased.The TiO2 content of rutile is greater than 93%,and the total content of CaO and MgO is less than 0.4%,meeting the requirements for the raw materials of titanium white in the chloride process.