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Alloy gene Gibbs energy partition function and equilibrium holographic network phase diagrams of Au_3Cu-type sublattice system 被引量:3
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作者 谢佑卿 聂耀庄 +2 位作者 李小波 彭红建 刘心笔 《Transactions of Nonferrous Metals Society of China》 SCIE EI CAS CSCD 2015年第1期211-240,共30页
Taking Au3Cu-type sublattice system as an example, three discoveries have been presented. First, the fourth barrier to hinder the progress of metal materials science is that today’s researchers do not understand that... Taking Au3Cu-type sublattice system as an example, three discoveries have been presented. First, the fourth barrier to hinder the progress of metal materials science is that today’s researchers do not understand that the Gibbs energy function of an alloy phase should be derived from Gibbs energy partition function constructed of alloy gene sequence and their Gibbs energy sequence. Second, the six rules for establishing alloy gene Gibbs energy partition function have been discovered, and it has been specially proved that the probabilities of structure units occupied at the Gibbs energy levels in the degeneracy factor for calculating configuration entropy should be degenerated as ones of component atoms occupied at the lattice points. Third, the main characteristics unexpected by today’s researchers are as follows. There exists a single-phase boundary curve without two-phase region coexisting by the ordered and disordered phases. The composition and temperature of the top point on the phase-boundary curve are far away from those of the critical point of the Au3Cu compound; At 0 K, the composition of the lowest point on the composition-dependent Gibbs energy curve is notably deviated from that of the Au3Cu compounds. The theoretical limit composition range of long range ordered Au3Cu-type alloys is determined by the first jumping order degree. 展开更多
关键词 Au3cu compound Au3cu-type sublattice system alloy gene Gibbs energy partition function equilibrium holographic network phase diagrams systematic metal materials science
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Si调控Cu-20Sn-15Ti钎料显微组织与性能的演变行为
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作者 张黎燕 杜全斌 +5 位作者 毛望军 崔冰 李昂 王蕾 纠永涛 梁杰 《金刚石与磨料磨具工程》 CAS 北大核心 2024年第3期309-318,共10页
为通过成分调控改善Cu-Sn-Ti钎料的显微组织及性能,采用扫描电子显微镜、X射线衍射仪及EDS能谱分析等设备,研究了Si对Cu-20Sn-15Ti钎料显微组织与性能的影响规律。结果表明:Cu-20Sn-15Ti钎料的显微组织为大尺寸多边形状CuSn_(3)Ti_(5)... 为通过成分调控改善Cu-Sn-Ti钎料的显微组织及性能,采用扫描电子显微镜、X射线衍射仪及EDS能谱分析等设备,研究了Si对Cu-20Sn-15Ti钎料显微组织与性能的影响规律。结果表明:Cu-20Sn-15Ti钎料的显微组织为大尺寸多边形状CuSn_(3)Ti_(5)相、共晶组织和α-Cu相。添加少量的Si(质量分数≤2.0%)可细化钎料中多边形状CuSn_(3)Ti_(5)相,并生成小尺寸Si_(3)Ti_(5)相,较多的Si(质量分数≥3.0%)会造成多边形状CuSn_(3)Ti_(5)相分化离散、共晶组织粗化减少,Si_(3)Ti_(5)相含量增加且粗化,当Si含量增至5.0%时,钎料不再生成多边形状CuSn_(3)Ti_(5)相和共晶组织,Ti主要用于生成Ti_(5)Si_(3)相,显微组织主要为Ti_(5)Si_(3)相、α-Cu相、Cu41Sn11相和少量条状CuSn_(3)Ti_(5)相;与Cu、Sn相比,Si与Ti具有更强的化学亲和力,Si优先与Ti反应生成Ti_(5)Si_(3)相;Ti_(5)Si_(3)相的三维组织形貌为棱柱状,且呈团聚附生特征,粗条状Ti_(5)Si_(3)相具有中心或侧面孔洞缺陷,孔洞的形成主要与其生长机制有关;随着Si含量的增加,钎料的剪切强度呈“升高-降低-升高”的趋势,断口形貌由准解理断裂和解理断裂的混合形态向解理断裂转变;CuSn_(3)Ti_(5)相易破碎开裂成为起裂源,不同粗大状态CuSn_(3)Ti_(5)相的存在均在一定程度上恶化钎料剪切强度。 展开更多
关键词 cu-Sn-Ti钎料 金刚石 显微组织 cuSn_(3)Ti_(5)相
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PF-LBM耦合模型下Al-Cu合金的枝晶生长和气泡形成
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作者 朱昶胜 雷瑶 +2 位作者 雷鹏 高梓豪 赵博睿 《兰州理工大学学报》 CAS 北大核心 2024年第1期19-26,共8页
基于Shan-Chen多相流的格子玻尔兹曼方法模拟复杂多相流系统,探索气泡在液相中的生长和运动.研究了Al-4.0wt.%Cu合金在凝固过程中枝晶与气泡的相互作用,各向异性对凝固组织的影响以及枝晶与气泡共存时溶液密度的变化情况.结果表明:在定... 基于Shan-Chen多相流的格子玻尔兹曼方法模拟复杂多相流系统,探索气泡在液相中的生长和运动.研究了Al-4.0wt.%Cu合金在凝固过程中枝晶与气泡的相互作用,各向异性对凝固组织的影响以及枝晶与气泡共存时溶液密度的变化情况.结果表明:在定向凝固枝晶生长模型中,气泡先在枝晶底部析出,压差导致气泡上升,流动的过程中会与枝晶产生相互作用且会出现气泡合并与消失的情况,在枝晶间密集通道处大气泡会变成蠕虫形状.模拟区域的高长比会影响枝晶和气泡的生长情况,当高长比较小时更容易产生短而小的气泡,高长比较大时更容易产生蠕虫状气泡.在等轴枝晶生长模型中,气泡在枝晶间析出,随着枝晶的生长,气泡同样会发生合并与消失的情况,并且在受到挤压时发生形变. 展开更多
关键词 相场模拟 格子玻尔兹曼方法 气泡 Al-4.0wt.%cu合金
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Dynamics of phase transformation of Cu-Ni-Si alloy with super-high strength and high conductivity during aging 被引量:15
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作者 雷前 李周 +3 位作者 潘志勇 汪明朴 肖柱 陈畅 《Transactions of Nonferrous Metals Society of China》 SCIE EI CAS CSCD 2010年第6期1006-1011,共6页
The precipitation behaviors of the Cu-Ni-Si alloys during aging were studied by analyzing the variations of electric conductivity.The Avrami-equation of phase transformation kinetics and the Avrami-equation of electri... The precipitation behaviors of the Cu-Ni-Si alloys during aging were studied by analyzing the variations of electric conductivity.The Avrami-equation of phase transformation kinetics and the Avrami-equation of electric conductivity during aging were established for Cu-Ni-Si alloys,on the basis of linear relationship between the electric conductivity and the volume fraction of precipitates,and the calculation results coincide well with the experiment ones.The transformation kinetics curves were established to characterize the aging process.The characteristics of precipitates in the supersaturated solid solution alloy aged at 723 K were established,and the results show that the precipitates areβ-Ni3Si andδ-Ni2Si phases. 展开更多
关键词 cu cu-Ni-Si alloy DYNAMICS phase transformation PRECIPITATION electrical conductivity
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Novel cued search strategy based on information gain for phased array radar 被引量:5
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作者 Lu Jianbin Hu Weidong Xiao Hui Yu Wenxian 《Journal of Systems Engineering and Electronics》 SCIE EI CSCD 2008年第2期292-297,共6页
A search strategy based on the maximal information gain principle is presented for the cued search of phased array radars. First, the method for the determination of the cued search region, arrangement of beam positio... A search strategy based on the maximal information gain principle is presented for the cued search of phased array radars. First, the method for the determination of the cued search region, arrangement of beam positions, and the calculation of the prior probability distribution of each beam position is discussed. And then, two search algorithms based on information gain are proposed using Shannon entropy and Kullback-Leibler entropy, respectively. With the proposed strategy, the information gain of each beam position is predicted before the radar detection, and the observation is made in the beam position with the maximal information gain. Compared with the conventional method of sequential search and confirm search, simulation results show that the proposed search strategy can distinctly improve the search performance and save radar time resources with the same given detection probability. 展开更多
关键词 phased array radar search strategy cued search beam position information gain.
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Experimental Study of the Distribution of Au and Cu in Aqueous Vapor Phase at High Temperatures and Its Role on Ore-forming Transportation 被引量:3
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作者 ZHANG Ronghua HU Shumin ZHANG Xuetong 《Acta Geologica Sinica(English Edition)》 SCIE CAS CSCD 2008年第4期875-883,共9页
This study focuses on experiments of Au and Cu dissolved in vapor phase in hydrothermal fluids. Experiments prove that Au and Cu can re-distribute in vapor phase and liquid phase during separation of Au- and Cu-bearin... This study focuses on experiments of Au and Cu dissolved in vapor phase in hydrothermal fluids. Experiments prove that Au and Cu can re-distribute in vapor phase and liquid phase during separation of Au- and Cu-bearing supercritical fluids to vapor and liquid phases. These experimental results can illustrate some ore geneses, where boiling phenomena of ore fluids were found. Au- and Cubearing NaHCO3-HCl solutions were heated up to more than 350℃ in the main vessel, and then passed through a phase separator in a temperature range from 250℃ to 300℃, separated into vapor and liquid phases. We collected and analyzed the liquid and vapor samples separately, and found that Au and Cu dissolved and distributed in vapor phase. In some cases, the concentrations of Au and Cu in vapor are higher than those in liquid phase. Those experiments are used to interpret field observations of fluid inclusion data of some Au and Cu deposits, and demonstrate that some Au and Cu ore deposits are derived from metals transportation in vapor phase. 展开更多
关键词 Au and cu in vapor phase ore genesis boiling phenomena liquid and vapor phase separation metal transportation in gases
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Cued search algorithm with uncertain detection performance for phased array radars 被引量:2
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作者 Jianbin Lu Hui Xiao +1 位作者 Zemin Xi Mingmin Zhang 《Journal of Systems Engineering and Electronics》 SCIE EI CSCD 2013年第6期938-945,共8页
A cued search algorithm with uncertain detection performance is proposed for phased array radars. Firstly, a target search model based on the information gain criterion is presented with known detection performance, a... A cued search algorithm with uncertain detection performance is proposed for phased array radars. Firstly, a target search model based on the information gain criterion is presented with known detection performance, and the statistical characteristic of the detection probability is calculated by using the fluctuant model of the target radar cross section (RCS). Secondly, when the detection probability is completely unknown, its probability density function is modeled with a beta distribution, and its posterior probability distribution with the radar observation is derived based on the Bayesian theory. Finally simulation results show that the cued search algorithm with a known RCS fluctuant model can achieve the best performance, and the algorithm with the detection probability modeled as a beta distribution is better than that with a random selected detection probability because the model parameters can be updated by the radar observation to approach to the real value of the detection probability. 展开更多
关键词 phased array radar detection performance cued search information gain beta distribution
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Effects of high-pressure heat treatment on the solid-state phase transformation and microstructures of Cu_(61.13)Zn_(33.94)Al_(4.93) alloys 被引量:7
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作者 王海燕 刘建华 +1 位作者 彭桂荣 王文魁 《Chinese Physics B》 SCIE EI CAS CSCD 2010年第9期469-474,共6页
The phase transformation activation energy of the Cu61.13Zn33.94A14.93 alloys, which were treated at 4 GPa and 700 ℃ for 15 minutes, was calculated by means of differential scanning calorimetry curves obtained at var... The phase transformation activation energy of the Cu61.13Zn33.94A14.93 alloys, which were treated at 4 GPa and 700 ℃ for 15 minutes, was calculated by means of differential scanning calorimetry curves obtained at various heating and cooling rates. Then, the effects of high-pressure heat treatments on the solid-state phase transformation and the microstructures of Cu61.13Zn33.94A14.93 alloys were investigated. The results show that high-pressure heat treatments can refine the grains and can change the preferred orientation from (111) to (200) of α phase. Compared with the as-cast alloy, the sample with high-pressure heat treatment has finer grains, lower β'→β and/β→β' transformation temperature and activation energy. Furthermore, we found that high cooling rate favours the formation of fine needle-like α phase in the range of 5-20℃/min. 展开更多
关键词 cu61.13Zn33.94A14.93 alloy high-pressure heat treatment solid-state phase transformation MICROSTRUCTURES
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Effects of Ni addition on liquid phase separation and giant magnetoresistance of Cu-Co alloys 被引量:2
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作者 孙占波 宋晓平 +4 位作者 胡柱东 祝要民 刘剑 杨森 李晓园 《中国有色金属学会会刊:英文版》 CSCD 2001年第5期655-658,共4页
The effects of Ni addition on the liquid phase separation and giant magnetoresi stance (GMR) of Cu Co alloys were discussed. The results reveal that Ni additio n can partially restrain the liquid phase separation of C... The effects of Ni addition on the liquid phase separation and giant magnetoresi stance (GMR) of Cu Co alloys were discussed. The results reveal that Ni additio n can partially restrain the liquid phase separation of Cu Co alloys, resultin g in a decrease of volume fraction for the Co rich particles separated from the liquid phase and in refined microstructures. The composition analyses indicate t hat Ni is dissolved in both the Co rich and the Cu rich phases, but Ni content in the Co rich phase is much higher than that in the Cu matrix. At the same ti me, Ni addition enhance the solubility between Cu and Co, especially Cu in Co s olid solution. Ni alloying into Cu Co alloys can fully prevent the liquid phase separation during melt spinning, which is very beneficial to improve GMR of Cu Co alloys. 展开更多
关键词 cu Co Ni alloys SUPERCOOLING melt spun liquid phase separation microstruc ture GMR
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A High-Temperature β-Phase NaMnO2 Stabilized by Cu Doping and Its Na Storage Properties 被引量:3
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作者 Li-Wei Jiang Ya-Xiang Lu +5 位作者 Yue-Sheng Wang Li-Lu Liu Xing-Guo Qi Cheng-Long Zhao Li-Quan Chen Yong-Sheng Hu 《Chinese Physics Letters》 SCIE CAS CSCD 2018年第4期132-135,共4页
The high-temperature β-phase NaMnO2 is a promising material for Na-ion batteries(NIBs) due to its high capacity and abundant resources. However, the synthesis of phase-pure -NaMnO2 is burdensome and costineffective... The high-temperature β-phase NaMnO2 is a promising material for Na-ion batteries(NIBs) due to its high capacity and abundant resources. However, the synthesis of phase-pure -NaMnO2 is burdensome and costineffective because it needs to be sintered under oxygen atmosphere at high temperature and followed by a quenching procedure. Here we first report that the pure β phase can be stabilized by Cu-doping and easily synthesized by replacing a proportion of Mn with Cu via a simplified process including sintering in air and cooling to room temperature naturally. Based on the first-principle calculations, the band gap decreases from 0.7 eV to 0.3 eV, which indicates that the electronic conductivity can be improved by Cu-doping. The designed -NaCu(0.1)Mn(0.9)O2 is applied as cathode in NIBs, exhibiting an energy density of 419 Wh/kg and better performance in terms of rate capability and cycling stability than those in the undoped case. 展开更多
关键词 NA A High-Temperature phase NaMnO2 Stabilized by cu Doping and Its Na Storage Properties Mn cu
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High temperature oxidation of powder metallurgy two phase Cu Cr alloys under low oxygen pressure 被引量:1
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作者 付广艳 牛焱 吴维 《中国有色金属学会会刊:英文版》 CSCD 2000年第3期353-357,共5页
The oxidation of two phase Cu Cr alloys containing 25% and 50% Cr prepared by powder metallurgy (PM) with a rather uniform two phase microstructure has been studied at 700~900 ℃ under oxygen pressure below the stabi... The oxidation of two phase Cu Cr alloys containing 25% and 50% Cr prepared by powder metallurgy (PM) with a rather uniform two phase microstructure has been studied at 700~900 ℃ under oxygen pressure below the stability of the copper oxides. The two PM alloys oxidized very slowly and formed only external Cr 2O 3 scales rather than undergoing an internal oxidation of chromium. This result is attributed mainly to a supply of chromium from the small Cr rich particles dispersed within the Cu rich phase. The oxidation kinetics of the two PM Cu Cr alloys approximately followed the parabolic rate law. The scaling rates are of the same order as those measured for pure chromium under the same oxygen pressure, but smaller than those for the alloys of similar composition prepared by normal arc melting techniques, whose compositions were largely non uniform. The results are interpreted in terms of the two phase nature of these alloys. 展开更多
关键词 TWO phase cu CR ALLOYS oxidation low oxygen PRESSURE
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Study of Cu-rich phase precipitation in austenitic antibacterial stainless steel 被引量:1
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作者 REN Ling and YANG Ke Institute of Metal Research,Chinese Academy of Sciences,Shenyang 110016,Liaoning,China 《Baosteel Technical Research》 CAS 2010年第S1期76-,共1页
Cu precipitation behaviors in two Cu-bearing austenitic antibacterial stainless steels,type 304 and type 317L,were systematically studied by using relatively simple methods for materials analysis,including micro-hardn... Cu precipitation behaviors in two Cu-bearing austenitic antibacterial stainless steels,type 304 and type 317L,were systematically studied by using relatively simple methods for materials analysis,including micro-hardness,electrical resistivity,electrochemical impedance spectroscopy,X-ray diffraction and differential scanning calorimetry.The results indicated that after aging at elevated temperature,the micro-hardness, electrical resistivity,electrochemical impedance and lattice constant of the steel were all varied at different degrees due to the precipitation and growth of Cu-rich phases.The results also showed that the heat evolution during the process of Cu precipitation could be sensitively detected by means of differential scanning calorimetry,obtainning the starting temperature,peak temperature,peak area of the Cu-rich precipitation,and even the activation energy by calculation.The results confirmed that the Cu-rich phased precipitation in the Cu-bearing austenitic antibacterial stainless steel should be a thermal activation process controlled by Cu diffusion.All the materials analysis methods used in this study can be more simple and effective for application in R & D of the Cu-bearing antibacterial stainless steels. 展开更多
关键词 antibacterial stainless steel cu-rich phases AGING cu precipitation.
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Cu含量对Al-Cu-Li合金淬火敏感性的影响 被引量:1
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作者 刘锦勋 李红英 +2 位作者 杨惠钧 林海涛 郑子樵 《中国有色金属学报》 EI CAS CSCD 北大核心 2024年第5期1506-1518,共13页
采用薄板叠层末端淬火的方法,通过强度测试、连续冷却转变(CCT)和时间-温度-转化率(TTT)曲线计算及X射线衍射、扫描电镜、透射电镜等微观组织表征方法,研究了Cu含量(3.15%、3.63%和3.88%)对Al-Cu-Li合金淬火敏感性的影响,结合理论分析,... 采用薄板叠层末端淬火的方法,通过强度测试、连续冷却转变(CCT)和时间-温度-转化率(TTT)曲线计算及X射线衍射、扫描电镜、透射电镜等微观组织表征方法,研究了Cu含量(3.15%、3.63%和3.88%)对Al-Cu-Li合金淬火敏感性的影响,结合理论分析,从析出驱动力和形核位点的角度分析了Cu含量影响淬火敏感性的机理。结果表明:随着Cu含量的增加,晶格畸变能增加,Li的溶解度降低,淬火态合金中位错和残留第二相增多,含Li相的析出驱动力和非均匀形核位点增加,淬火沉淀相增多;随着临界冷却速率的增大,鼻尖温度孕育期缩短,强度残存率减小,Al-Cu-Li合金淬火敏感性提高。T8态合金强度受Cu含量和淬火速率共同作用,淬火速率较高时,主要受Cu含量的影响;淬火速率较低时,Cu含量的影响减小。 展开更多
关键词 AL-cu-LI合金 cu含量 淬火敏感性 强度 淬火沉淀相
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Microstructure,phase transformation and mechanical properties of NiMnGa particles/Cu composites fabricated by SPS 被引量:1
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作者 Ping GAO Zhao-xin LIU +3 位作者 Bing TIAN Yun-xiang TONG Feng CHEN Li LI 《Transactions of Nonferrous Metals Society of China》 SCIE EI CAS CSCD 2022年第10期3291-3300,共10页
Microstructure,phase transformation and mechanical properties of NiMnGa particles/Cu composites prepared by spark plasma sintering method were investigated by SEM,EDS,XRD,susceptibility measurements and mechanical tes... Microstructure,phase transformation and mechanical properties of NiMnGa particles/Cu composites prepared by spark plasma sintering method were investigated by SEM,EDS,XRD,susceptibility measurements and mechanical tests.The NiMnGa particles were found to react with Cu matrix and the composites exhibited a similar crystal structure to the Cu matrix.The martensitic transformation and Curie transition of the composites were weakened due to the composition change of NiMnGa particles caused by reactions.With increasing NiMnGa particles content,the martensitic transformation and Curie transition of the composites were enhanced to some extent.However,the martensitic transformation temperature and Curie transition temperature were decreased by~50 K as compared to those of the original NiMnGa particles.The compressive strength of the composites increased with the increase of NiMnGa particles content,whereas the compressive strain was decreased gradually. 展开更多
关键词 NiMnGa alloys cu composites spark plasma sintering MICROSTRUCTURE phase transformation mechanical properties
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双尺度Fe_(3)Si相调控对Cu-2.5Fe-0.2Si合金组织和性能的影响 被引量:1
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作者 于翔宇 邱文婷 +3 位作者 郑良玉 王永如 项燕龙 龚深 《中国有色金属学报》 EI CAS CSCD 北大核心 2024年第1期100-110,共11页
通过在铜铁合金中添加微量Si元素,并利用组合形变热处理工艺对亚微米级Fe_(3)Si相和纳米级Fe_(3)Si相的析出行为进行调控。结果表明:处理后的Cu-2.5Fe-0.2Si合金中形成了大量细小的再结晶晶粒,其抗拉强度、电导率和伸长率分别为401MPa、... 通过在铜铁合金中添加微量Si元素,并利用组合形变热处理工艺对亚微米级Fe_(3)Si相和纳米级Fe_(3)Si相的析出行为进行调控。结果表明:处理后的Cu-2.5Fe-0.2Si合金中形成了大量细小的再结晶晶粒,其抗拉强度、电导率和伸长率分别为401MPa、69.25%IACS和12.50%。合金中纳米级Fe_(3)Si析出相与铜基体的位向关系为[011ˉ]Cu//[11ˉ1]Fe_(3)Si。双尺度Fe_(3)Si相对合金屈服强度的提高均有贡献。其中,纳米级析出相对屈服强度的贡献值更大,约为亚微米级第二相的6倍。相比于Cu-2.5Fe合金,Si的添加促进了合金基体中铁相的析出及细化,降低了动态再结晶温度,进而实现了合金强度、电导率和塑性的协同提高。 展开更多
关键词 cu-Fe-Si合金 力学性能 电导率 Fe_(3)Si相 双尺度相
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Phase Transformation and Enhancing Electron Field Emission Properties in Microcrystalline Diamond Films Induced by Cu Ion Implantation and Rapid Annealing 被引量:1
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作者 申艳艳 张一新 +5 位作者 祁婷 乔瑜 贾钰欣 黑鸿君 贺志勇 于盛旺 《Chinese Physics Letters》 SCIE CAS CSCD 2016年第8期123-126,共4页
Cu ion implantation and subsequent rapid annealing at 500℃ in N2 result in low surface resistivity of 1.611 ohm/sq with high mobility of 290 cm2 V-1S-1 for microcrystalline diamond (MCD) films. Its electrical field... Cu ion implantation and subsequent rapid annealing at 500℃ in N2 result in low surface resistivity of 1.611 ohm/sq with high mobility of 290 cm2 V-1S-1 for microcrystalline diamond (MCD) films. Its electrical field emission behavior can be turned on at Eo = 2.6 V/μm, attaining a current density of 19.5μA/cm2 at an applied field of 3.5 V/#m. Field emission scanning electron microscopy combined with Raman and x-ray photoelectron mi- croscopy reveal that the formation of Cu nanoparticles in MCD films can catalytically convert the less conducting disorder/a-C phases into graphitic phases and can provoke the formation of nanographite in the films, forming conduction channels for electron transportation. 展开更多
关键词 cu of MCD phase Transformation and Enhancing Electron Field Emission Properties in Microcrystalline Diamond Films Induced by cu Ion Implantation and Rapid Annealing in by
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Unraveling the catalytically active phase of carbon dioxide hydrogenation to methanol on Zn/Cu alloy: Single atom versus small cluster 被引量:1
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作者 Xiao-Kuan Wu Hui-Min Yan +3 位作者 Wei Zhang Jie Zhang Guang-Jie Xia Yang-Gang Wang 《Journal of Energy Chemistry》 SCIE EI CAS CSCD 2021年第10期582-593,I0015,共13页
Methanol synthesis from CO_(2)hydrogenation catalyzed by Zn/Cu alloy has been widely studied,but there is still debate on its catalytic active phase and whether the Zn can be oxidized during the reaction process.What ... Methanol synthesis from CO_(2)hydrogenation catalyzed by Zn/Cu alloy has been widely studied,but there is still debate on its catalytic active phase and whether the Zn can be oxidized during the reaction process.What is more,as Zn atoms could locate on Zn/Cu alloy surface in forms of both single atom and cluster,how Zn surface distribution affects catalytic activity is still not clear.In this work,we performed a systematic theoretical study to compare the mechanistic natures and catalytic pathways between Zn single atom and small cluster on catalyst surface,where the surface oxidation was shown to play the critical role.Before surface oxidation,the Zn single atom/Cu is more active than the Zn small cluster/Cu,but its surface oxidation is difficult to take place.Instead,after the easy surface oxidation by CO_(2)decomposition,the oxidized Zn small cluster/Cu becomes much more active,which even exceeds the hardlyoxidized Zn single atom/Cu to become the active phase.Further analyses show this dramatic promotion of surface oxidation can be ascribed to the following factors:i)The O from surface oxidation could preferably occupy the strongest binding sites on the center of Zn cluster.That makes the O intermediates bind at the Zn/Cu interface,preventing their too tight binding for further hydrogenation;ii)The higher positive charge and work function on the oxidized surface could also promote the hydrogenation of O intermediates.This work provided one more example that under certain condition,the metal cluster can be more active than the single atom in heterogeneous catalysis. 展开更多
关键词 CO_(2)hydrogenation Surface oxidation Zn/cu alloy Catalytically active phase
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Phase-field simulations of solidification of Al-Cu binary alloys 被引量:9
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作者 龙文元 蔡启舟 +1 位作者 陈立亮 魏伯康 《中国有色金属学会会刊:英文版》 CSCD 2004年第2期291-296,共6页
The dendrite growth process during the solidification of the Al-4.5%Cu binary alloy was simulated using the phase-field model, proposed by Kim et al. Solute diffusion equation and heat transfer equation were solved si... The dendrite growth process during the solidification of the Al-4.5%Cu binary alloy was simulated using the phase-field model, proposed by Kim et al. Solute diffusion equation and heat transfer equation were solved simultaneously. The effects of the noise on the dendrite growth, solute and temperature profile in the undercooled alloy melt were investigated. The results indicate that the noise can trigger the growth of the secondary arms, and increase the highest temperature and solute concentration, but not influence the tip operating state. The solute and temperature gradients in the tip are the highest. 展开更多
关键词 AL-cu合金 铝合金 二元合金 铸造 凝固 数值模拟 温度场
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Liquid phase separation of Cu-Cr alloys during rapid cooling 被引量:5
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作者 孙占波 王宥宏 郭娟 《中国有色金属学会会刊:英文版》 EI CSCD 2006年第5期998-1002,共5页
The ribbons of Cu-Cr alloys with high Cr content (15%- 35%, mass fraction) were prepared by rapid solidification. The microstructures of solidified samples were analyzed by scanning electron microscopy and transmissio... The ribbons of Cu-Cr alloys with high Cr content (15%- 35%, mass fraction) were prepared by rapid solidification. The microstructures of solidified samples were analyzed by scanning electron microscopy and transmission electron microscopy. The results reveal that a representative liquid phase separation microstructures are observed in Cu75Cr25 ribbons solidified at a cooling rate of about 104K/s. The liquid phase separation is not restrained when the cooling rate is enhanced to about 107K/s. However, the size of Cr particles solidified from Cr-rich liquid or Cr-rich regions in alloy melts could be refined by increasing the cooling rates. The size of Cr particles increases with increasing Cr contents when the ribbons contain 15% to 35%Cr. 展开更多
关键词 cu-CR 铜合金 液相分离 快速冷却 凝固
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Kinetic characteristics of liquid phase sintering of mechanically activated W-15wt%Cu powder 被引量:7
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作者 Zhigang Li Chengchang Jia Yuntao He Liliang Chen 《Journal of University of Science and Technology Beijing》 CSCD 2006年第4期338-345,共8页
The kinetic characteristics of W grain growth operated by diffusion controlled Oswald ripening (DOR) during liquid phase sintering were studied. A liquid phase sintering of W-15wt%Cu was carried out by pushing compa... The kinetic characteristics of W grain growth operated by diffusion controlled Oswald ripening (DOR) during liquid phase sintering were studied. A liquid phase sintering of W-15wt%Cu was carried out by pushing compacts into a furnace at the moment when the temperature increased to 1340℃ for different sintering times. The results show that liquid phase sintering produces the compacts with considerably low relative density and inversely, rather high homogeneity. On the basis of the data extracted from the SEM images, the kinetic equation of W grain growth, G^n = G0^n + kt, is determined in which the grain growth exponent n is 3 and the grain growth rate constant k is 0.15 μm^3/s. The cumulative normalized grain size distributions produced by different sintering times show self-similar. The cumulative distribution function is extracted from the curves by non-linear fitting. In addition, the sintering kinetic characteristics of W-15wt%Cu compacts were also investigated. 展开更多
关键词 liquid phase sintering mechanical alloying grain growth kinetics W-cu alloy
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