Nickel-based single-crystal superalloys are crucial materials for the preparation of aero-engine turbine blades. Many solute elements are added to superalloys for strengthening. However, the relationship between the c...Nickel-based single-crystal superalloys are crucial materials for the preparation of aero-engine turbine blades. Many solute elements are added to superalloys for strengthening. However, the relationship between the clustering behavior of solute atoms and the properties of nickel-based single-crystal superalloys is still unclear. Herein, we conduct first-principles calculations onγ phases with Mo-Mo and Mo-Mo-Ru clusters to reveal the possibility and stabilizing mechanism of solute clusters. Introducing Mo lowers the total energy, binding energy, and formation energy of the γ phase due to the replacement of weak Ni-Ni interaction with strong Mo-Ni bonding. Note that the γ phase containing the Mo-Mo cluster is more stable than that containing a Mo single atom, possibly owing to a wide affecting range. The Ru atom added to the γ phase can further boost system stability, and it tends to form a Mo-Mo-Ru cluster. The stabilizing impact of the Mo-Mo-Ru cluster is demonstrated to be the replacement of weak Ni-Mo interaction by the strong Ru-Mo interaction, which may be derived from the enhanced d-orbital hybridization.展开更多
Plastic instability, called Portevin-Le-Chatelier(PLC) effect, manifests itself as an unstable plastic flow during tensile tests of structural materials. This phenomenon has a strong influence on diverse properties, l...Plastic instability, called Portevin-Le-Chatelier(PLC) effect, manifests itself as an unstable plastic flow during tensile tests of structural materials. This phenomenon has a strong influence on diverse properties, leading to unexpected vulnerabilities in the service environment.Among various magnesium-based alloys, PLC phenomenon is most prominently observed in the Mg-Mn-Nd alloy under elevated temperature and low strain rate conditions. An important aim of the study is to clarify and compare the significance of the RE and Ca addition, which are known to cause a formation of a largely weakened non-basal type texture, in the occurrence of plastic instability. Due to the PLC phenomenon, there is a risk of weakening texture and formability improvement by the addition of RE and Ca elements in Mg alloys. Based on the understanding of the role of Nd to the PLC phenomenon in Mg-Mn alloy identified in previous studies, the PLC characteristics according to alloying elements and deformation conditions were compared and analyzed. To identify the micromechanical mechanisms of the PLC phenomenon, varies in the microstructure and mechanical properties during deformation of Mg-Mn binary and Ca or Nd-containing Mg-Mn-based ternary alloys in various conditions were systemically analyzed. The addition of Ca did not show a marked PLC effect due to the formation of low number density Mn-Ca and Ca-Ca solute clusters and an unbalanced Mn:Ca ratio. In contrast, the addition of Nd leads to the formation of a higher number density of Nd-Nd and Mn-Nd solute clusters than that of Ca-Ca and Mn-Ca solute clusters of the Mg-Mn-Ca alloy, resulting in a stable solute-dislocation interaction atmosphere under specific ranges of deformation temperature and strain rate. The deformation in the regime of PLC phenomenon, results in a decrease in ductility and an increase in strength, despite deformation at elevated temperatures with maintaining the weakened texture.展开更多
Composition homogenization in solid solution is important for industrial alloys. In the present work, a solute homogenization model is proposed based on the chemical short-range-order tendency in Mg-Gd- based alloys. ...Composition homogenization in solid solution is important for industrial alloys. In the present work, a solute homogenization model is proposed based on the chemical short-range-order tendency in Mg-Gd- based alloys. After a calculation using the cluster-plus-glue-atom model, the stable Mg-Gd structural unit is derived, [Gd-Mg12 ]Mg6, where one solute Gd is nearest-neighbored with twelve Mg atoms to form the characteristic hcp cluster [Gd-Mg12 ] and this cluster is matched with six Mg glue atoms. Such a local unit is then mixed with [Mg-Mg12 ]Mg3, the stable unit for pure Mg. Assuming that the Gd-containing units are arranged in fcc- or bcc-like lattice points and the Mg units in their octahedral interstices, three proportions between the two units are obtained, 1：1, 2：3, and 1：3, which constitute three solute homogenization modes. The prevailing Mg-Gd-based alloys are consequently classified into three groups, respectively exemplified by GW103 K （Mg-10Gd-3Y-0.4Zr, wt%）, GW83 K （Mg-SGd-3Y-0.4Zr）, and GW63 K （Mg-6Gd- 3Y-0.4Zr）. Mg-Gd-Y-Zr alloys were designed following the model （where Y and Zr were also added in substitution for Gd） and prepared by permanent-mould casting. According to their mechanical properties, the 1：3 alloy （Mg-5.9Gd-1.6Y-0.4Zr） shows the best comprehensive properties （ultimate tensile strength 305 MPa, yield strength 186 MPa, elongation 9.0%） in solution plus ageing state.2017 Published by Elsevier Ltd on behalf of The editorial office of Journal of Materials Science ＆ Technology.展开更多
Phases of Cu-（0.4%-2.0%） Cr-（0.05%-0.16%） Zr alloys were analyzed in both as cast and deformed state. Solute-rich clusters of Cr, which was supposed to form during aging treatment, were observed in as cast state; ...Phases of Cu-（0.4%-2.0%） Cr-（0.05%-0.16%） Zr alloys were analyzed in both as cast and deformed state. Solute-rich clusters of Cr, which was supposed to form during aging treatment, were observed in as cast state; along with the morphology character, corresponding preferential orientation of Cr phase in as cast state was also investigated. Precipitates were observed to distribute in the matrix with a bimodal distribution, viz. coarse precipitates with dimension larger than several hundred nanometers and fine precipitates with size of 2- 10 nm. Three types of intermetallics, the common compound of Cu51Zr14, correspondingly infrequent Cu5Zr and rare Cu5Zr3, were characterized in different samples.展开更多
Along with higher and higher integration of intellectual properties(IPs) on a single chip, traditional bus-based system-on-chips(So C) meets several design difficulties(such as low scalability, high power consumption,...Along with higher and higher integration of intellectual properties(IPs) on a single chip, traditional bus-based system-on-chips(So C) meets several design difficulties(such as low scalability, high power consumption,packet latency and clock tree problem). As a promising solution, network-on-chips(No C) has been proposed and widely studied. In this work, a novel algorithm for No C topology synthesis, which is decomposing and cluster refinement(DCR) algorithm, has been proposed to minimize the total power consumption of application-specific No C. This algorithm is composed of two stages: decomposing with cluster generation, and cluster refinement.For partitioning and cluster generation, an initial low-power solution for No C topology is generated. For cluster refinement, the clustering is optimized by performing floorplan to further reduce power consumption. Meanwhile,a good tradeoff between power consumption and CPU time can be achieved. Experimental results show that the proposed method outperforms the existing work.展开更多
The Discrete Variational Xα Method DV-Xα with an embeded cluster scheme was used to investigate electronic structure, energy levels, charge distribution and chemical bonding in p-type thermoelectric ceramics :Sb2Te3...The Discrete Variational Xα Method DV-Xα with an embeded cluster scheme was used to investigate electronic structure, energy levels, charge distribution and chemical bonding in p-type thermoelectric ceramics :Sb2Te3-Bi2Te3-Sb2Se3. The results obtained are in agreement with experiment ones, which are instructive to material design.展开更多
Inter-femtocell interference becomes serious when femtocells are densely deployed. To mitigate the inter-femtocell interference, this paper proposes a cluster-based bandwidth allocation algorithm. We create femtocell ...Inter-femtocell interference becomes serious when femtocells are densely deployed. To mitigate the inter-femtocell interference, this paper proposes a cluster-based bandwidth allocation algorithm. We create femtocell clusters by constructing a weighted interference graph and allocate bandwidth to each cluster based on a Nash bargaining solution(NBS). Simulation results show that the cluster-based bandwidth allocation algorithm can reduce the inter-femtocell interference and meet the minimum rate constraint of each cluster.展开更多
基金financially supported by the National Natural Science Foundation of China (No. 52371114 and No. 51971118)。
文摘Nickel-based single-crystal superalloys are crucial materials for the preparation of aero-engine turbine blades. Many solute elements are added to superalloys for strengthening. However, the relationship between the clustering behavior of solute atoms and the properties of nickel-based single-crystal superalloys is still unclear. Herein, we conduct first-principles calculations onγ phases with Mo-Mo and Mo-Mo-Ru clusters to reveal the possibility and stabilizing mechanism of solute clusters. Introducing Mo lowers the total energy, binding energy, and formation energy of the γ phase due to the replacement of weak Ni-Ni interaction with strong Mo-Ni bonding. Note that the γ phase containing the Mo-Mo cluster is more stable than that containing a Mo single atom, possibly owing to a wide affecting range. The Ru atom added to the γ phase can further boost system stability, and it tends to form a Mo-Mo-Ru cluster. The stabilizing impact of the Mo-Mo-Ru cluster is demonstrated to be the replacement of weak Ni-Mo interaction by the strong Ru-Mo interaction, which may be derived from the enhanced d-orbital hybridization.
基金financial support of German Research Foundation (DFG)(Grant Nr. YI103/3-1 and AL1343/8-1)。
文摘Plastic instability, called Portevin-Le-Chatelier(PLC) effect, manifests itself as an unstable plastic flow during tensile tests of structural materials. This phenomenon has a strong influence on diverse properties, leading to unexpected vulnerabilities in the service environment.Among various magnesium-based alloys, PLC phenomenon is most prominently observed in the Mg-Mn-Nd alloy under elevated temperature and low strain rate conditions. An important aim of the study is to clarify and compare the significance of the RE and Ca addition, which are known to cause a formation of a largely weakened non-basal type texture, in the occurrence of plastic instability. Due to the PLC phenomenon, there is a risk of weakening texture and formability improvement by the addition of RE and Ca elements in Mg alloys. Based on the understanding of the role of Nd to the PLC phenomenon in Mg-Mn alloy identified in previous studies, the PLC characteristics according to alloying elements and deformation conditions were compared and analyzed. To identify the micromechanical mechanisms of the PLC phenomenon, varies in the microstructure and mechanical properties during deformation of Mg-Mn binary and Ca or Nd-containing Mg-Mn-based ternary alloys in various conditions were systemically analyzed. The addition of Ca did not show a marked PLC effect due to the formation of low number density Mn-Ca and Ca-Ca solute clusters and an unbalanced Mn:Ca ratio. In contrast, the addition of Nd leads to the formation of a higher number density of Nd-Nd and Mn-Nd solute clusters than that of Ca-Ca and Mn-Ca solute clusters of the Mg-Mn-Ca alloy, resulting in a stable solute-dislocation interaction atmosphere under specific ranges of deformation temperature and strain rate. The deformation in the regime of PLC phenomenon, results in a decrease in ductility and an increase in strength, despite deformation at elevated temperatures with maintaining the weakened texture.
基金supported financially by the National Key Research and Development Program of China (No. 2016YFB0701201)the Natural Science Foundation of China (No. 11674045)
文摘Composition homogenization in solid solution is important for industrial alloys. In the present work, a solute homogenization model is proposed based on the chemical short-range-order tendency in Mg-Gd- based alloys. After a calculation using the cluster-plus-glue-atom model, the stable Mg-Gd structural unit is derived, [Gd-Mg12 ]Mg6, where one solute Gd is nearest-neighbored with twelve Mg atoms to form the characteristic hcp cluster [Gd-Mg12 ] and this cluster is matched with six Mg glue atoms. Such a local unit is then mixed with [Mg-Mg12 ]Mg3, the stable unit for pure Mg. Assuming that the Gd-containing units are arranged in fcc- or bcc-like lattice points and the Mg units in their octahedral interstices, three proportions between the two units are obtained, 1：1, 2：3, and 1：3, which constitute three solute homogenization modes. The prevailing Mg-Gd-based alloys are consequently classified into three groups, respectively exemplified by GW103 K （Mg-10Gd-3Y-0.4Zr, wt%）, GW83 K （Mg-SGd-3Y-0.4Zr）, and GW63 K （Mg-6Gd- 3Y-0.4Zr）. Mg-Gd-Y-Zr alloys were designed following the model （where Y and Zr were also added in substitution for Gd） and prepared by permanent-mould casting. According to their mechanical properties, the 1：3 alloy （Mg-5.9Gd-1.6Y-0.4Zr） shows the best comprehensive properties （ultimate tensile strength 305 MPa, yield strength 186 MPa, elongation 9.0%） in solution plus ageing state.2017 Published by Elsevier Ltd on behalf of The editorial office of Journal of Materials Science ＆ Technology.
文摘Phases of Cu-（0.4%-2.0%） Cr-（0.05%-0.16%） Zr alloys were analyzed in both as cast and deformed state. Solute-rich clusters of Cr, which was supposed to form during aging treatment, were observed in as cast state; along with the morphology character, corresponding preferential orientation of Cr phase in as cast state was also investigated. Precipitates were observed to distribute in the matrix with a bimodal distribution, viz. coarse precipitates with dimension larger than several hundred nanometers and fine precipitates with size of 2- 10 nm. Three types of intermetallics, the common compound of Cu51Zr14, correspondingly infrequent Cu5Zr and rare Cu5Zr3, were characterized in different samples.
文摘Along with higher and higher integration of intellectual properties(IPs) on a single chip, traditional bus-based system-on-chips(So C) meets several design difficulties(such as low scalability, high power consumption,packet latency and clock tree problem). As a promising solution, network-on-chips(No C) has been proposed and widely studied. In this work, a novel algorithm for No C topology synthesis, which is decomposing and cluster refinement(DCR) algorithm, has been proposed to minimize the total power consumption of application-specific No C. This algorithm is composed of two stages: decomposing with cluster generation, and cluster refinement.For partitioning and cluster generation, an initial low-power solution for No C topology is generated. For cluster refinement, the clustering is optimized by performing floorplan to further reduce power consumption. Meanwhile,a good tradeoff between power consumption and CPU time can be achieved. Experimental results show that the proposed method outperforms the existing work.
文摘The Discrete Variational Xα Method DV-Xα with an embeded cluster scheme was used to investigate electronic structure, energy levels, charge distribution and chemical bonding in p-type thermoelectric ceramics :Sb2Te3-Bi2Te3-Sb2Se3. The results obtained are in agreement with experiment ones, which are instructive to material design.
基金supported by National Basic Research Program of China(No.2010CB731800)National Natural Science Foundation of China(Nos.61203104,61221003,61174127,61104033 and 61172095)+2 种基金Natural Science Foundation of Hebei Province(Nos.F2012203126 and F2012203109)Research Foundation for the Doctoral Program of Higher Education(Nos.20121333120012,20110073130005,and20110073120025)Program for Doctor Foundation of Yanshan University(No.B632)
文摘Inter-femtocell interference becomes serious when femtocells are densely deployed. To mitigate the inter-femtocell interference, this paper proposes a cluster-based bandwidth allocation algorithm. We create femtocell clusters by constructing a weighted interference graph and allocate bandwidth to each cluster based on a Nash bargaining solution(NBS). Simulation results show that the cluster-based bandwidth allocation algorithm can reduce the inter-femtocell interference and meet the minimum rate constraint of each cluster.
