The separation of halogens and recovery of heavy metals from secondary copper smelting(SCS)dust using a sulfating roasting−water leaching process were investigated.The thermodynamic analysis results confirm the feasib...The separation of halogens and recovery of heavy metals from secondary copper smelting(SCS)dust using a sulfating roasting−water leaching process were investigated.The thermodynamic analysis results confirm the feasibility of the phase transformation to metal sulfates and to gaseous HF and HCl.Under the sulfating roasting conditions of the roasting temperature of 250℃ and the sulfuric acid excess coefficient of 1.8,over 74 wt.%of F and 98 wt.%of Cl were volatilized into flue gas.Approximately 98.6 wt.%of Zn and 96.5 wt.%of Cu in the roasting product were dissolved into the leaching solution after the water leaching process,while the leaching efficiencies of Pb and Sn were only 0.12%and 0.22%,respectively.The mechanism studies indicate the pivotal effect of roasting temperature on the sulphation reactions from various metal species to metal sulfates and the salting out reactions from various metal halides to gaseous hydrogen halides.展开更多
The adsorption of low-coverage of F and Cl adatoms on the Mg(0001) surface was investigated using first-principles calculations based on the density functional theory(DFT).The stability of the(2×2) structur...The adsorption of low-coverage of F and Cl adatoms on the Mg(0001) surface was investigated using first-principles calculations based on the density functional theory(DFT).The stability of the(2×2) structures formed by halogen atoms adsorbed at different sites was determined.The difference between the adsorption of F and Cl on Mg(0001) surface was also discussed.The calculation results show that hollow sites are the energetically most favorable at the low-coverage.It can be concluded from the Mulliken charges and density of states that electrons transfer from the substrate Mg atoms to the adatoms,which leads to the formation of adsorbate bond and further causes the stronger interaction between Mg atom and adatom.The interaction between Cl and Mg atoms is weaker than the interaction between F and Mg.展开更多
To shield TiAl alloy from hot corrosion attack,a compact protective coating was fabricated by the combination of aluminizing,anodization and pre-oxidation.The hot corrosion behavior of the coated-TiAl specimen was inv...To shield TiAl alloy from hot corrosion attack,a compact protective coating was fabricated by the combination of aluminizing,anodization and pre-oxidation.The hot corrosion behavior of the coated-TiAl specimen was investigated in the mixture salt consisting of 75 wt.%Na2SO4 and 25 wt.%NaCl at 700°C.Results indicated that the anodization and pre-oxidation were beneficial to the generation of Al2O3 layer,which could act as a diffusion barrier to prevent the molten salts and oxygen from diffusing into the alloy during exposure to a hot corrosion environment while the aluminizing coating could provide sufficient aluminum source to support the continuous formation of Al2O3 layer.Moreover,the internal stress of the coating was reduced due to the formation of a gradient coating consisting of TiAl3 and TiAl2.展开更多
The corrosion behaviors and electrochemical properties of Q235 A steel in the treated water containing corrosive halide anions(F-, Cl-) have been investigated with corrosion tests of static coupon and dynamic coupon t...The corrosion behaviors and electrochemical properties of Q235 A steel in the treated water containing corrosive halide anions(F-, Cl-) have been investigated with corrosion tests of static coupon and dynamic coupon testing, electrochemical measurement of open-circuit potential and linear sweep voltammetry. The results reveal that the existence of F-and Cl-ions in the simulated treated water accelerate the corrosion rate of Q235 A steel. The corrosion rate reaches maximum with F-concentration of 50 mg/L, Cl-concentration of 200 mg/L, respectively. However, Q235 A steel would passivate when an applied potential is added to the system. Meanwhile, the initiating passive potential becomes positive with F-, Cl-concentration increasing. There is a little influence of F-, Cl-concentration on the initiating passivation current density. Therefore, it is necessary to control F-, Cl-concentration in the treated water when it is recycled by the pipelines made of Q235 A steel.展开更多
Mixed halide perovskites(MHPs)are a class of semiconductor materials with great promise for many optoelectronic applications due to their outstanding photophysical properties.Understanding and tailoring the photogener...Mixed halide perovskites(MHPs)are a class of semiconductor materials with great promise for many optoelectronic applications due to their outstanding photophysical properties.Understanding and tailoring the photogenerated carrier dynamics is essential for further improvement of perovskite performance.Herein,we report a study about the carrier transport and interfacial charge transfer dynamics in Br-gradient MAPbI_(3-x)Br_(x) perovskite thin films prepared by surface ion-exchange method.Driven by the bandgap gradient in MAPbI_(3-x)Br_(x) films,the accelerated internal hole transport and enhanced interfacial extraction efficiency were both observed.Meanwhile,the interfacial electron transfer was also found to be evidently facilitated due to the surface modification during post-treatment.Our findings suggest the possibility of simultaneous acceleration of interfacial electron and hole transfer processes in halide perovskite films via surface post-treatment technique,which is of great importance in further improving the power conversion efficiency of perovskite solar cells.展开更多
Some more new fluorinated 1,2,4-triasino[3,4-b][1,3,4]thiadiazolones (6-9 and 11-16) have been synthesized from cyclocondensation of 5-hydrazino-2-(4'-fluorophenyl)-1,3,4-thiadiazole with bifunctional oxygen and ...Some more new fluorinated 1,2,4-triasino[3,4-b][1,3,4]thiadiazolones (6-9 and 11-16) have been synthesized from cyclocondensation of 5-hydrazino-2-(4'-fluorophenyl)-1,3,4-thiadiazole with bifunctional oxygen and halogen compounds. Structures of the products have been deduced from their elemental, chemical and spectral data (UV, IIL 1H/13C NMR (nuclear magnetic resonance) and mass). All the new compounds evaluated as molluscicidal against towards snails which responsible for Bilharziasis diseases.展开更多
The density functional theory based hybrid-method B3LYP was used to investigate the interaction of the halogen ions with crown tetraalanylpeptide which was the coronary structures of homodetic cyclotetraalapeptide and...The density functional theory based hybrid-method B3LYP was used to investigate the interaction of the halogen ions with crown tetraalanylpeptide which was the coronary structures of homodetic cyclotetraalapeptide and was represented as the model basic. Many properties including combination energy, optimum geometry structures and population analysis were calculated. It was shown that there was scarcely any change in the coronary structure of C4-Ala after combination with X. The electrons moved from halogen ions to C4-Ala during the combining process. Combination of C4-Ala with F was obviously stronger than that of Cl^- and Br. When the energy of C4-Ala-X was at minimum, the distances between halogen ions and the center of C4-Ala were 0.084 nm, 0.210 nm and 0.200 nm, respectively.展开更多
基金the National Key Research and Development Program of China(No.2019YFC1908400)the National Natural Science Foundation of China(Nos.52174334,52374413)+3 种基金the Jiangxi Provincial Cultivation Program for Academic and Technical Leaders of Major Subjects,China(Nos.20212BCJ23007,20212BCJL23052)the Jiangxi Provincial Natural Science Foundation,China(Nos.20224ACB214009,20224BAB214040)the Double Thousand Plan of Jiangxi Province,China(No.S2021GDQN2970)the Distinguished Professor Program of Jinggang Scholars in Institutions of Higher Learning of Jiangxi Province,China.
文摘The separation of halogens and recovery of heavy metals from secondary copper smelting(SCS)dust using a sulfating roasting−water leaching process were investigated.The thermodynamic analysis results confirm the feasibility of the phase transformation to metal sulfates and to gaseous HF and HCl.Under the sulfating roasting conditions of the roasting temperature of 250℃ and the sulfuric acid excess coefficient of 1.8,over 74 wt.%of F and 98 wt.%of Cl were volatilized into flue gas.Approximately 98.6 wt.%of Zn and 96.5 wt.%of Cu in the roasting product were dissolved into the leaching solution after the water leaching process,while the leaching efficiencies of Pb and Sn were only 0.12%and 0.22%,respectively.The mechanism studies indicate the pivotal effect of roasting temperature on the sulphation reactions from various metal species to metal sulfates and the salting out reactions from various metal halides to gaseous hydrogen halides.
基金Project (51201079) supported by the National Natural Science Foundation of ChinaProject (2012Z099) supported by the Scientific Research Fund of Department of Education of Yunnan Province,ChinaProject (KKSY201251033) supported by the Scientific Research Foundation for Introduced Talents of KMUST,China
文摘The adsorption of low-coverage of F and Cl adatoms on the Mg(0001) surface was investigated using first-principles calculations based on the density functional theory(DFT).The stability of the(2×2) structures formed by halogen atoms adsorbed at different sites was determined.The difference between the adsorption of F and Cl on Mg(0001) surface was also discussed.The calculation results show that hollow sites are the energetically most favorable at the low-coverage.It can be concluded from the Mulliken charges and density of states that electrons transfer from the substrate Mg atoms to the adatoms,which leads to the formation of adsorbate bond and further causes the stronger interaction between Mg atom and adatom.The interaction between Cl and Mg atoms is weaker than the interaction between F and Mg.
基金The authors are grateful for the financial supports from the National Natural Science Foundation of China(51971205)Shenzhen Science and Technology Innovation Program,China(JCYJ20190807154005593)the Fundamental Research Funds for the Central Universities,China(19lgpy20).
文摘To shield TiAl alloy from hot corrosion attack,a compact protective coating was fabricated by the combination of aluminizing,anodization and pre-oxidation.The hot corrosion behavior of the coated-TiAl specimen was investigated in the mixture salt consisting of 75 wt.%Na2SO4 and 25 wt.%NaCl at 700°C.Results indicated that the anodization and pre-oxidation were beneficial to the generation of Al2O3 layer,which could act as a diffusion barrier to prevent the molten salts and oxygen from diffusing into the alloy during exposure to a hot corrosion environment while the aluminizing coating could provide sufficient aluminum source to support the continuous formation of Al2O3 layer.Moreover,the internal stress of the coating was reduced due to the formation of a gradient coating consisting of TiAl3 and TiAl2.
基金Project(2018YFC1900304)supported by the National Key R&D Program of ChinaProject(2018SK2026)supported by the Key R&D Program of Hunan Province,ChinaProject(2017SK2420)supported by the Science and Technology of Hunan Province,China。
文摘The corrosion behaviors and electrochemical properties of Q235 A steel in the treated water containing corrosive halide anions(F-, Cl-) have been investigated with corrosion tests of static coupon and dynamic coupon testing, electrochemical measurement of open-circuit potential and linear sweep voltammetry. The results reveal that the existence of F-and Cl-ions in the simulated treated water accelerate the corrosion rate of Q235 A steel. The corrosion rate reaches maximum with F-concentration of 50 mg/L, Cl-concentration of 200 mg/L, respectively. However, Q235 A steel would passivate when an applied potential is added to the system. Meanwhile, the initiating passive potential becomes positive with F-, Cl-concentration increasing. There is a little influence of F-, Cl-concentration on the initiating passivation current density. Therefore, it is necessary to control F-, Cl-concentration in the treated water when it is recycled by the pipelines made of Q235 A steel.
基金financial support from the Ministry of Science and Technology of China(No.2018YFA0208704 and No.2016YFA0200602)the National Natural Science Foundation of China(No.21725305)financial support from the National Natural Science Foundation of China(No.21773237)。
文摘Mixed halide perovskites(MHPs)are a class of semiconductor materials with great promise for many optoelectronic applications due to their outstanding photophysical properties.Understanding and tailoring the photogenerated carrier dynamics is essential for further improvement of perovskite performance.Herein,we report a study about the carrier transport and interfacial charge transfer dynamics in Br-gradient MAPbI_(3-x)Br_(x) perovskite thin films prepared by surface ion-exchange method.Driven by the bandgap gradient in MAPbI_(3-x)Br_(x) films,the accelerated internal hole transport and enhanced interfacial extraction efficiency were both observed.Meanwhile,the interfacial electron transfer was also found to be evidently facilitated due to the surface modification during post-treatment.Our findings suggest the possibility of simultaneous acceleration of interfacial electron and hole transfer processes in halide perovskite films via surface post-treatment technique,which is of great importance in further improving the power conversion efficiency of perovskite solar cells.
文摘Some more new fluorinated 1,2,4-triasino[3,4-b][1,3,4]thiadiazolones (6-9 and 11-16) have been synthesized from cyclocondensation of 5-hydrazino-2-(4'-fluorophenyl)-1,3,4-thiadiazole with bifunctional oxygen and halogen compounds. Structures of the products have been deduced from their elemental, chemical and spectral data (UV, IIL 1H/13C NMR (nuclear magnetic resonance) and mass). All the new compounds evaluated as molluscicidal against towards snails which responsible for Bilharziasis diseases.
文摘The density functional theory based hybrid-method B3LYP was used to investigate the interaction of the halogen ions with crown tetraalanylpeptide which was the coronary structures of homodetic cyclotetraalapeptide and was represented as the model basic. Many properties including combination energy, optimum geometry structures and population analysis were calculated. It was shown that there was scarcely any change in the coronary structure of C4-Ala after combination with X. The electrons moved from halogen ions to C4-Ala during the combining process. Combination of C4-Ala with F was obviously stronger than that of Cl^- and Br. When the energy of C4-Ala-X was at minimum, the distances between halogen ions and the center of C4-Ala were 0.084 nm, 0.210 nm and 0.200 nm, respectively.