The segregation behavior of alloying elements X（ X = Zr,V,Cr,Mn,Mo,W,Nb,Y） on the ferrite（ 100） /TiC（ 100） interface has been investigated using first principles method,and the work of separation and interface e...The segregation behavior of alloying elements X（ X = Zr,V,Cr,Mn,Mo,W,Nb,Y） on the ferrite（ 100） /TiC（ 100） interface has been investigated using first principles method,and the work of separation and interface energy of ferrite / TiC interfaces alloyed by these elements were also analyzed. The results indicated that all these alloying additives except Y were thermodynamically favorable because of the negative segregation energy,showing that they have the tendency to segregate to the ferrite / TiC interface. When the Fe atom in the ferrite /TiC interface is replaced by Y,Zr,or Nb,the adhesive strength of the interface will be weakened due to the lower separation work,larger interfacial energy,and weaker electron effects. However,the introduction of Cr,Mo,W,Mn and V will improve the stability of the ferrite / TiC interface through strong interaction between these elements and C,and Cr-doped interface is the most stable structure. Therefore,the Cr,Mo,W,Mn and V in ferrite side of the interface can effectively promote ferrite heterogeneous nucleation on TiC surface to form fine ferrite grain.展开更多
A novel size-dependent model is developed herein to study the bending behavior of beam-type micro/nano-structures considering combined effects of nonlocality and micro-rotational degrees of freedom. To accomplish this...A novel size-dependent model is developed herein to study the bending behavior of beam-type micro/nano-structures considering combined effects of nonlocality and micro-rotational degrees of freedom. To accomplish this aim, the micropolar theory is combined with the nonlocal elasticity. To consider the nonlocality, both integral (original) and differential formulations of Eringen’s nonlocal theory are considered. The beams are considered to be Timoshenko-type, and the governing equations are derived in the variational form through Hamilton’s principle. The relations are written in an appropriate matrix-vector representation that can be readily utilized in numerical approaches. A finite element (FE) approach is also proposed for the solution procedure. Parametric studies are conducted to show the simultaneous nonlocal and micropolar effects on the bending response of small-scale beams under different boundary conditions.展开更多
Interaction rule between representative RE and Sn, Sb, Pb, Cu, S, P low melting point elements respectively in Fe , Cu , Al , Ni base liquid solutions including totally 34 ternary and quarternary systems was inve...Interaction rule between representative RE and Sn, Sb, Pb, Cu, S, P low melting point elements respectively in Fe , Cu , Al , Ni base liquid solutions including totally 34 ternary and quarternary systems was investigated. For each system some thermodynamic properties were obtained, such as the standard free energies of equilibrium reactions, activity interaction coefficients etc ..展开更多
Heterogeneous oxidation of gas-phase Hg 0 by nano-Fe 2 O 3 was investigated on a fixed bed reactor, and the effects of oxygen concentration, bed temperature, water vapour concentration and particle size have been disc...Heterogeneous oxidation of gas-phase Hg 0 by nano-Fe 2 O 3 was investigated on a fixed bed reactor, and the effects of oxygen concentration, bed temperature, water vapour concentration and particle size have been discussed. The results showed that Hg 0 could be oxidized by active oxygen atom on the surface of nano-Fe 2 O 3 as well as lattice oxygen in nano-Fe 2 O 3 . Among the factors that affect Hg 0 oxidation by nano-Fe 2 O 3 , bed temperature plays an important role. More than 40% of total mercury was oxidized at 300°C, however, the test temperature at 400°C could cause sintering of nano-catalyst, which led to a lower efficiency of Hg 0 oxidation. The increase of oxygen concentration could promote mercury oxidation and led to higher Hg 0 oxidation efficiency. No obvious mercury oxidation was detected in the pure N 2 atmosphere, which indicates that oxygen is required in the gas stream for mercury oxidation. The presence of water vapour showed different effects on mercury oxidation depending on its concentration. The lower content of water vapour could promote mercury oxidation, while the higher content of water vapour inhibits mercury oxidation.展开更多
Laser ablation–inductively coupled plasma–mass spectrometry（LA–ICP–MS） was used to determine the trace element concentrations of magnetite from the Heifengshan, Shuangfengshan, and Shaquanzi Fe（–Cu） deposits ...Laser ablation–inductively coupled plasma–mass spectrometry（LA–ICP–MS） was used to determine the trace element concentrations of magnetite from the Heifengshan, Shuangfengshan, and Shaquanzi Fe（–Cu） deposits in the Eastern Tianshan Orogenic Belt. The magnetite from these deposits typically contains detectable Mg, Al, Ti, V, Cr, Mn, Co, Ni, Zn and Ga. The trace element contents in magnetite generally vary less than one order of magnitude. The subtle variations of trace element concentrations within a magnetite grain and between the magnetite grains in the same sample probably indicate local inhomogeneity of ore–forming fluids. The variations of Co in magnetite between samples are probably due to the mineral proportion of magnetite and pyrite. Factor analysis has discriminated three types of magnetite： Ni–Mn–V–Ti（Factor 1）, Mg–Al–Zn（Factor 2）, and Ga– Co（Factor 3） magnetite. Magnetite from the Heifengshan and Shuangfengshan Fe deposits has similar normalized trace element spider patterns and cannot be discriminated according to these factors. However, magnetite from the Shaquanzi Fe–Cu deposit has affinity to Factor 2 with lower Mg and Al but higher Zn concentrations, indicating that the ore–forming fluids responsible for the Fe–Cu deposit are different from those for Fe deposits. Chemical composition of magnetite indicates that magnetite from these Fe（–Cu） deposits was formed by hydrothermal processes rather than magmatic differentiation. The formation of these Fe（–Cu） deposits may be related to felsic magmatism.展开更多
Three kinds of models based on the same flexible pipe with 8 layers have been separately created to investigate the effects of different modeling approaches on numerical simulation results of finite element(FE)models ...Three kinds of models based on the same flexible pipe with 8 layers have been separately created to investigate the effects of different modeling approaches on numerical simulation results of finite element(FE)models for unbonded flexible pipes.Then the mechanical property of the unbonded flexible pipe under tension,torsion and bending load has been analyzed and compared via ABAQUS software on the basis of three created models.The research shows that different modeling methods of flexible pipes make a great difference in the results.Especially,modeling simplifications of the carcass and pressure armor have a great impact on the accuracy of the results.Model 3,in which the carcass is simulated by spiral isot ropic shell and other layers are Simula ted by solid element,possesses good adaptability,which has been proved by comparing the experiment data and other models.This paper can offer a reference for the FE modeling methods,selection and mechanical property analysis of unbonded flexible pipe.展开更多
By use of self-consistent field Xα scattered-wave (SCF-Xα-SW) method, the electronic structure was calculated for four models of Ti4Al14X (X=Al, Fe, Ni and Cu) clusters. The Ti4Al14X cluster was developed based on L...By use of self-consistent field Xα scattered-wave (SCF-Xα-SW) method, the electronic structure was calculated for four models of Ti4Al14X (X=Al, Fe, Ni and Cu) clusters. The Ti4Al14X cluster was developed based on L12 Al3Ti-base intermetallic compound. The results are presented using the density of states (DOS) and one-electron properties, such as relative binding tendency between the atom and the model cluster, and hybrid bonding tendency between the alloying element and the host atoms. By comparing the four models of Ti4Al14X cluster, the effect of the Fe, Ni or Cu atom on the physical properties of Al3Ti-based L12 intermetallic compounds is analyzed. The results indicate that the addition of the Fe, Ni or Cu atom intensifies the relative binding tendency between Ti atom and Ti4Al14X cluster. It was found that the Fermi level (EF) lies in a maximum in the DOS for Ti4Al14Al cluster; on the contrary, the EF comes near a minimum tn the DOS for Ti4Al14X (X=Fe, Ni and Cu) cluster. Thus the L12 crystal structure for binary Al3Ti alloy is unstable, and the addition of the Fe, Ni or Cu atom to Al3Ti is benefical to stabilize L12 crystal structure. The calculation also shows that the Fe, Ni or Cu atom strengthens the hybrid bonding tendency between the central atom and the host atoms for Ti4Al14X cluster and thereby may lead to the constriction of the lattice of Al3Ti-base intermetallic compounds.展开更多
The effect of the addition of rare earths in Fe-based high chromium alloy powders on elements distribution in matrix materials and mechanical properties were studied. The results show that the addition of cerium can i...The effect of the addition of rare earths in Fe-based high chromium alloy powders on elements distribution in matrix materials and mechanical properties were studied. The results show that the addition of cerium can increase the chromium amount in carbonides and increase the micro-hardness after carbonization and the wear-resistant property of materials.展开更多
We performed a systematic trace and rare earth element analysis for the bedded Fe-Mn carbonate rocks related to the stratiform Ag-Pb-Zn mineralization in the Lengshuikeng ore district, Jiangxi Province, South China. T...We performed a systematic trace and rare earth element analysis for the bedded Fe-Mn carbonate rocks related to the stratiform Ag-Pb-Zn mineralization in the Lengshuikeng ore district, Jiangxi Province, South China. Three types of Fe-Mn carbonates are distinguished, namely, the massive, breccia, and vein types. Both carbonate and silicate fractions in the samples are analyzed for their trace and rare earth element concentrations using a step acid-leaching technique. Our results show that the carbonate fractions in the massive type samples have the lowest REE concentrations but pronounced positive Eu and Y anomalies with Eu/Eu＊ value from 1.3 to 6.2 and Y/Ho value from 40.1 to 59.5, and similar characteristics are also shown for the silicate fractions in the massive type samples（Eu/Eu＊=1.0-6.7, Y/Ho=20.7-55.1）. These REE characteristics are similar to those of Sedex type massive sulfide deposits worldwide, and we suggest that the massive type Fe-Mn carbonate rocks were likely formed from an exhalative volcanic-hydrothermal fluid feeding the depression basin of a volcanic lake. The high concentrations of redox-sensitive elements and ratios such as U/Th, V/Cr and V/（V＋Ni） indicate a dysoxic environment for the Fe-Mn carbonate deposition. In contrast, the breccia type and vein type Fe-Mn carbonate samples show different trace and rare earth element features from those of massive type samples, and they are more similar to the volcanic rocks and magmatic-hydrothermal fluids in the Lengshuikeng ore district and may reflect strong overprinting from volcanic and sub-volcanic magmatism related to the porphyry type mineralization in the district.展开更多
REE and other trace elements in ores, wall rocks, alkaline volcanic rocks and diabase dikes have been determined in the Yinachang Fe-Cu-REE deposit. Comparative studies of REE and trace element geochemical characteris...REE and other trace elements in ores, wall rocks, alkaline volcanic rocks and diabase dikes have been determined in the Yinachang Fe-Cu-REE deposit. Comparative studies of REE and trace element geochemical characteristics of these geological bodies indicate that the ores and alkaline volcanic rocks contain abundant REE and Y ({65.9}-{4633})×10+{-6}, with higher abundances of As, Mo, Nb, Co and U than those of the crust. Their chondrite-normalized patterns show a strong enrichment of LREE and a positive Eu anomaly, in contrast to those of the dolomites which are characterized by slight LREE enrichment and moderate negative Eu anomaly. The REE patterns of ores are similar to those of hydrothermal sediment cores in the East Pacific Rise, whereas the REE patterns of dolomites are similar to those of PAAS (Post-Archean Average Shale). In combination with the geological setting of the deposit, the primary ore-forming fluids might have higher REE and volatile elements, and might have been derived from mantle degassing, or the alkaline volcanic magmas. The Yinachang Fe-Cu-REE ore deposit is considered to be of volcanic exhalation-hydrothermal sedimentary origin.展开更多
基金financially sponsored by National Natural Science Foundation of China(51304053)
文摘The segregation behavior of alloying elements X（ X = Zr,V,Cr,Mn,Mo,W,Nb,Y） on the ferrite（ 100） /TiC（ 100） interface has been investigated using first principles method,and the work of separation and interface energy of ferrite / TiC interfaces alloyed by these elements were also analyzed. The results indicated that all these alloying additives except Y were thermodynamically favorable because of the negative segregation energy,showing that they have the tendency to segregate to the ferrite / TiC interface. When the Fe atom in the ferrite /TiC interface is replaced by Y,Zr,or Nb,the adhesive strength of the interface will be weakened due to the lower separation work,larger interfacial energy,and weaker electron effects. However,the introduction of Cr,Mo,W,Mn and V will improve the stability of the ferrite / TiC interface through strong interaction between these elements and C,and Cr-doped interface is the most stable structure. Therefore,the Cr,Mo,W,Mn and V in ferrite side of the interface can effectively promote ferrite heterogeneous nucleation on TiC surface to form fine ferrite grain.
文摘A novel size-dependent model is developed herein to study the bending behavior of beam-type micro/nano-structures considering combined effects of nonlocality and micro-rotational degrees of freedom. To accomplish this aim, the micropolar theory is combined with the nonlocal elasticity. To consider the nonlocality, both integral (original) and differential formulations of Eringen’s nonlocal theory are considered. The beams are considered to be Timoshenko-type, and the governing equations are derived in the variational form through Hamilton’s principle. The relations are written in an appropriate matrix-vector representation that can be readily utilized in numerical approaches. A finite element (FE) approach is also proposed for the solution procedure. Parametric studies are conducted to show the simultaneous nonlocal and micropolar effects on the bending response of small-scale beams under different boundary conditions.
基金Project Sponsored by the National Natural Science Foundation
文摘Interaction rule between representative RE and Sn, Sb, Pb, Cu, S, P low melting point elements respectively in Fe , Cu , Al , Ni base liquid solutions including totally 34 ternary and quarternary systems was investigated. For each system some thermodynamic properties were obtained, such as the standard free energies of equilibrium reactions, activity interaction coefficients etc ..
基金supported by the Scientific Funds for Outstanding Young Scientists of China(No.50525619)the National Natural Science Foundation of China(No.51078163,50706014)the National High Technology Research and Development Program(863)of China(No.2006AA05Z304)
文摘Heterogeneous oxidation of gas-phase Hg 0 by nano-Fe 2 O 3 was investigated on a fixed bed reactor, and the effects of oxygen concentration, bed temperature, water vapour concentration and particle size have been discussed. The results showed that Hg 0 could be oxidized by active oxygen atom on the surface of nano-Fe 2 O 3 as well as lattice oxygen in nano-Fe 2 O 3 . Among the factors that affect Hg 0 oxidation by nano-Fe 2 O 3 , bed temperature plays an important role. More than 40% of total mercury was oxidized at 300°C, however, the test temperature at 400°C could cause sintering of nano-catalyst, which led to a lower efficiency of Hg 0 oxidation. The increase of oxygen concentration could promote mercury oxidation and led to higher Hg 0 oxidation efficiency. No obvious mercury oxidation was detected in the pure N 2 atmosphere, which indicates that oxygen is required in the gas stream for mercury oxidation. The presence of water vapour showed different effects on mercury oxidation depending on its concentration. The lower content of water vapour could promote mercury oxidation, while the higher content of water vapour inhibits mercury oxidation.
基金financially supported by the Chinese 973 project(2012CB416804)the ‘‘CAS Hundred Talents’’ Project from the Chinese Academy of Sciences(KZCX2-YW-BR-09)to Qi Liang
文摘Laser ablation–inductively coupled plasma–mass spectrometry（LA–ICP–MS） was used to determine the trace element concentrations of magnetite from the Heifengshan, Shuangfengshan, and Shaquanzi Fe（–Cu） deposits in the Eastern Tianshan Orogenic Belt. The magnetite from these deposits typically contains detectable Mg, Al, Ti, V, Cr, Mn, Co, Ni, Zn and Ga. The trace element contents in magnetite generally vary less than one order of magnitude. The subtle variations of trace element concentrations within a magnetite grain and between the magnetite grains in the same sample probably indicate local inhomogeneity of ore–forming fluids. The variations of Co in magnetite between samples are probably due to the mineral proportion of magnetite and pyrite. Factor analysis has discriminated three types of magnetite： Ni–Mn–V–Ti（Factor 1）, Mg–Al–Zn（Factor 2）, and Ga– Co（Factor 3） magnetite. Magnetite from the Heifengshan and Shuangfengshan Fe deposits has similar normalized trace element spider patterns and cannot be discriminated according to these factors. However, magnetite from the Shaquanzi Fe–Cu deposit has affinity to Factor 2 with lower Mg and Al but higher Zn concentrations, indicating that the ore–forming fluids responsible for the Fe–Cu deposit are different from those for Fe deposits. Chemical composition of magnetite indicates that magnetite from these Fe（–Cu） deposits was formed by hydrothermal processes rather than magmatic differentiation. The formation of these Fe（–Cu） deposits may be related to felsic magmatism.
基金the National Natural Science Foundation of China(Nos.11627802 and 51709118)the China Postdoctoral Science Foundation(No.2017M612669)+2 种基金the Science and Technology Program of Guangzhou(No.201804010482)the Fundamental Research Funds for the Central Universities of China(No.2017BQ089)the Fund of State Key Laboratory of Ocean Engineering of Shanghai Jiao Tong University(No.1708)
文摘Three kinds of models based on the same flexible pipe with 8 layers have been separately created to investigate the effects of different modeling approaches on numerical simulation results of finite element(FE)models for unbonded flexible pipes.Then the mechanical property of the unbonded flexible pipe under tension,torsion and bending load has been analyzed and compared via ABAQUS software on the basis of three created models.The research shows that different modeling methods of flexible pipes make a great difference in the results.Especially,modeling simplifications of the carcass and pressure armor have a great impact on the accuracy of the results.Model 3,in which the carcass is simulated by spiral isot ropic shell and other layers are Simula ted by solid element,possesses good adaptability,which has been proved by comparing the experiment data and other models.This paper can offer a reference for the FE modeling methods,selection and mechanical property analysis of unbonded flexible pipe.
文摘By use of self-consistent field Xα scattered-wave (SCF-Xα-SW) method, the electronic structure was calculated for four models of Ti4Al14X (X=Al, Fe, Ni and Cu) clusters. The Ti4Al14X cluster was developed based on L12 Al3Ti-base intermetallic compound. The results are presented using the density of states (DOS) and one-electron properties, such as relative binding tendency between the atom and the model cluster, and hybrid bonding tendency between the alloying element and the host atoms. By comparing the four models of Ti4Al14X cluster, the effect of the Fe, Ni or Cu atom on the physical properties of Al3Ti-based L12 intermetallic compounds is analyzed. The results indicate that the addition of the Fe, Ni or Cu atom intensifies the relative binding tendency between Ti atom and Ti4Al14X cluster. It was found that the Fermi level (EF) lies in a maximum in the DOS for Ti4Al14Al cluster; on the contrary, the EF comes near a minimum tn the DOS for Ti4Al14X (X=Fe, Ni and Cu) cluster. Thus the L12 crystal structure for binary Al3Ti alloy is unstable, and the addition of the Fe, Ni or Cu atom to Al3Ti is benefical to stabilize L12 crystal structure. The calculation also shows that the Fe, Ni or Cu atom strengthens the hybrid bonding tendency between the central atom and the host atoms for Ti4Al14X cluster and thereby may lead to the constriction of the lattice of Al3Ti-base intermetallic compounds.
文摘The effect of the addition of rare earths in Fe-based high chromium alloy powders on elements distribution in matrix materials and mechanical properties were studied. The results show that the addition of cerium can increase the chromium amount in carbonides and increase the micro-hardness after carbonization and the wear-resistant property of materials.
基金supported by the National 973 Program of China (No. 2012CB416706)
文摘We performed a systematic trace and rare earth element analysis for the bedded Fe-Mn carbonate rocks related to the stratiform Ag-Pb-Zn mineralization in the Lengshuikeng ore district, Jiangxi Province, South China. Three types of Fe-Mn carbonates are distinguished, namely, the massive, breccia, and vein types. Both carbonate and silicate fractions in the samples are analyzed for their trace and rare earth element concentrations using a step acid-leaching technique. Our results show that the carbonate fractions in the massive type samples have the lowest REE concentrations but pronounced positive Eu and Y anomalies with Eu/Eu＊ value from 1.3 to 6.2 and Y/Ho value from 40.1 to 59.5, and similar characteristics are also shown for the silicate fractions in the massive type samples（Eu/Eu＊=1.0-6.7, Y/Ho=20.7-55.1）. These REE characteristics are similar to those of Sedex type massive sulfide deposits worldwide, and we suggest that the massive type Fe-Mn carbonate rocks were likely formed from an exhalative volcanic-hydrothermal fluid feeding the depression basin of a volcanic lake. The high concentrations of redox-sensitive elements and ratios such as U/Th, V/Cr and V/（V＋Ni） indicate a dysoxic environment for the Fe-Mn carbonate deposition. In contrast, the breccia type and vein type Fe-Mn carbonate samples show different trace and rare earth element features from those of massive type samples, and they are more similar to the volcanic rocks and magmatic-hydrothermal fluids in the Lengshuikeng ore district and may reflect strong overprinting from volcanic and sub-volcanic magmatism related to the porphyry type mineralization in the district.
文摘REE and other trace elements in ores, wall rocks, alkaline volcanic rocks and diabase dikes have been determined in the Yinachang Fe-Cu-REE deposit. Comparative studies of REE and trace element geochemical characteristics of these geological bodies indicate that the ores and alkaline volcanic rocks contain abundant REE and Y ({65.9}-{4633})×10+{-6}, with higher abundances of As, Mo, Nb, Co and U than those of the crust. Their chondrite-normalized patterns show a strong enrichment of LREE and a positive Eu anomaly, in contrast to those of the dolomites which are characterized by slight LREE enrichment and moderate negative Eu anomaly. The REE patterns of ores are similar to those of hydrothermal sediment cores in the East Pacific Rise, whereas the REE patterns of dolomites are similar to those of PAAS (Post-Archean Average Shale). In combination with the geological setting of the deposit, the primary ore-forming fluids might have higher REE and volatile elements, and might have been derived from mantle degassing, or the alkaline volcanic magmas. The Yinachang Fe-Cu-REE ore deposit is considered to be of volcanic exhalation-hydrothermal sedimentary origin.
