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STUDY ON THE DIFFUSION OF Cu^(2+)-H^+ COUPLE IN A CATION EXCHANGE MEMBRANE——A RAPID METHOD TO DETERMINE SELF-DIFFUSION COEFFICIENTS OF COUNTER-IONS WITH UNEQUAL VALENCE 被引量:1
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作者 徐铜文 何炳林 《Chinese Journal of Chemical Engineering》 SCIE EI CAS CSCD 1997年第2期83-89,共7页
1 INTRODUCTIONKnowledge of the basic transport phenomena of ions in an ion exchange membrane isimportant for the application of such a membrane.Various studies on the developmentof mathematical models for predicting a... 1 INTRODUCTIONKnowledge of the basic transport phenomena of ions in an ion exchange membrane isimportant for the application of such a membrane.Various studies on the developmentof mathematical models for predicting and correlating membrane transport rate havebeen published in recent years.More exact estimation of the diffusion coefficientshas been the subject of chief concern in many of these papers.For a bi-ionic systemwith the same valence,Sato et al.gave a method for estimating diffusion coefficients 展开更多
关键词 ion-exchange membrane diffusion coefficient Donnan dialysis cu^(2+)-H^+ couple
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DETERMINATION OF DIFFUSION COEFFICIENT OF CuCl_2 IN AQUEOUS SOLUTION
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作者 WU Zhichun, Institute of Chemical Metallurgy, Academia Siniea, Beijing, China WU Zhichun, Assistant Professor, Institute of Chemical Metallurgy, Academia Sinica, Beijing 100080, China 《Acta Metallurgica Sinica(English Letters)》 SCIE EI CAS CSCD 1992年第7期21-27,共7页
The diffusion coefficients of CuCl_2 in aqueous solutions of CuCl_2 and CuCl_2-HCl were measured respectively at 298 K with diaphragm cell method. The concentration dependence of CuCl_2 diffusion coefficient in single... The diffusion coefficients of CuCl_2 in aqueous solutions of CuCl_2 and CuCl_2-HCl were measured respectively at 298 K with diaphragm cell method. The concentration dependence of CuCl_2 diffusion coefficient in single CuCl_2 solutions and in mixed CuCl_2 -HCl solutions was discussed on the changes in chemical potential as well as in viscosity. 展开更多
关键词 cuCl_2 diffusion coefficient diaphragm cell
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Determination of Li+ solid diffusion coefficient in LiMn2O4 by CITT
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作者 TANG Xin-cun HUANG Bai-yun HE Yue-hui 《Journal of Central South University of Technology》 2005年第z1期1-4,共4页
The capacity intermittent titration technique (CITT) was developed based on the ratio of potentio-charge capacity to galvano-charge capacity (RPG) method, to continuously determine the solid diffusion coefficient (D) ... The capacity intermittent titration technique (CITT) was developed based on the ratio of potentio-charge capacity to galvano-charge capacity (RPG) method, to continuously determine the solid diffusion coefficient (D) of the intercalary species within insertion-host materials with a small voltage region. The linear equations of D vs the value of ratio of the potentio-charge capacity to the galvano-charge capacity (q) were given. By the CITT technique,the Li+ solid diffusion coefficients within LiMn2 O4 at different voltages were determined. The results show that the values of D varied from 3. 447× 10-9 to 7.60× 10-11 cm2/s in the voltage range of charge from 3.3 to 4.3 V as a function of voltage with "W" shape. 展开更多
关键词 capacity TITRATION TECHNIQUE Li+ SOLID diffusion coefficient LIMN2O4
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Capacity Titration Technique for Determining the Solid Diffusion Coefficient of Intercalary Species within Insertion-host Materials
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作者 Xin Cun TANG Tian Duo LI 《Chinese Chemical Letters》 SCIE CAS CSCD 2005年第8期1077-1080,共4页
In this paper, the capacity titration technique (CT technique) was developed on basis of the RPG (ratio of potentio-charge capacity to galvano-charge capacity) method to continuously determine the solid diffusion ... In this paper, the capacity titration technique (CT technique) was developed on basis of the RPG (ratio of potentio-charge capacity to galvano-charge capacity) method to continuously determine the solid diffusion coefficient D of the intercalary species within insertion-host materials with a small voltage region. The linear equations of D vs. q (value of ratio of the potentio-charge capacity to the galvano-charge capacity) were given in different range of q. By the CT technique,the Li^+ solid diffusion coefficients D within LiMn2O4 at different voltages were determined. The results showed that the values of D varied from 3.447×10^-9 cm^2/s to 7.60×10^-11 cm^2/s in the voltage range of charge from 3.3V to 4.3V as a function of voltage with “W” shape. 展开更多
关键词 Capacity titration technique Li^+ solid diffusion coefficient LiMn2O4.
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Characteristics and pathological mechanism on magnetic resonance diffusion-weighted imaging after chemoembolization in rabbit liver VX-2 tumor model 被引量:14
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作者 You-Hong Yuan En-Hua Xiao +6 位作者 Jian-Bin Liu Zhong He Ke Jin Cong Ma Jun Xiang Jian-Hua Xiao Wei-Jian Chen 《World Journal of Gastroenterology》 SCIE CAS CSCD 2007年第43期5699-5706,共8页
AIM: To investigate dynamic characteristics and pathological mechanism of signal in rabbit VX-2 tumor model on diffusion-weighted imaging (DWI) after chemoembolization. METHODS: Forty New Zealand rabbits were included... AIM: To investigate dynamic characteristics and pathological mechanism of signal in rabbit VX-2 tumor model on diffusion-weighted imaging (DWI) after chemoembolization. METHODS: Forty New Zealand rabbits were included in the study and forty-seven rabbit VX-2 tumor models were raised by implanting directly and intrahepatically after abdominal cavity opened. Forty VX-2 tumor models from them were divided into four groups. DWI was performed periodically and respectively for each group after chemoembolization. All VX-2 tumor samples of each group were studied by pathology. The distinction of VX-2 tumors on DWI was assessed by their apparent diffusion coefficient (ADC) values. The statistical significance between different time groups, different area groups or different b-value groups was calculated by using SPSS12.0 software. RESULTS: Under b-value of 100 s/mm2, ADC values were lowest at 16 h after chemoembolization in area of VX-2 tumor periphery, central, and normal liver parenchyma around tumor, but turned to increase with further elongation of chemoembolization treatment. The distinction of ADC between different time groups was significant respectively (F = 7.325, P < 0.001; F = 2.496, P < 0.048; F = 6.856, P < 0.001). Cellular edema in the area of VX-2 tumor periphery or normal liver parenchyma around tumor, increased quickly in sixteen h after chemoembolization but, from the 16th h to the 48th h, cellular edema in the area of normal liver parenchyma around tumor decreased gradually and that in the area of VX-2 tumor periphery decreased lightly at, and then increased continually. After chemoembolization, Cellular necrosis in the area of VX-2 tumor periphery was more significantly high than that before chemoembolization. The areas of dead cells in VX-2 tumors manifested low signal and high ADC value, while the areas of viable cells manifested high signal and low ADC value. CONCLUSION: DWI is able to detect and differentiate tumor necrotic areas from viable cellular areas before and after chemoembolization. ADC of normal liver parenchyma and VX-2 tumor are influenced by intracellular edema, tissue cellular death and microcirculation disturbance after chemoembolization. 展开更多
关键词 LIVER VX-2 tumor diffusion-weighted imaging Apparent diffusion coefficient CHEMOEMBOLIZATION
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Characteristics of liver on magnetic resonance diffusion-weighted imaging:Dynamic and image pathological investigation in rabbit liver VX-2 tumor model 被引量:10
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作者 You-Hong Yuan En-Hua Xiao +6 位作者 Jian-Bin Liu Zhong He Ke Jin Cong Ma Jun Xiang Jian-Hua Xiao Wei-Jian Chen 《World Journal of Gastroenterology》 SCIE CAS CSCD 2008年第25期3997-4004,共8页
AIM: To investigate dynamical and image pathological characteristics of the liver on magnetic resonance (MR) diffusion-weighted imaging (DWI) in the rabbit VX-2 tumor model. METHODS: Forty New Zealand rabbits we... AIM: To investigate dynamical and image pathological characteristics of the liver on magnetic resonance (MR) diffusion-weighted imaging (DWI) in the rabbit VX-2 tumor model. METHODS: Forty New Zealand rabbits were included in the study and VX-2 tumor piece was implanted intrahepatically. Fifteen animals received two intrahepatic implantations while 25 had one intrahepatical implantation. DWI, T1- and T2-weighted of magnetic resonance imaging (MRI) were carried out on the 7th and the 14th d after implantation and DWI was conducted, respectively on the 21th d. Ten VX-2 tumor samples were studied pathologically. RESULTS: The rate of lump detected by DWI, TlWI and T2WI was 78.7%, 10.7% and 53.5% (X^2 =32.61, P 〈 0.001) on the 7th d after implantation and 95.8%, 54.3% and 82.9% (X^2 = 21.50, P 〈 0.001) on the 14th d. The signal of most VX-2 tumors on DWI was uniform and it was equal diffusion coefficient (ADC). did not decrease on the 7th on the map of apparent The signal of VX tumors d after implantation, most of them slowly growing during the week following implantation without significant cell dying within the tumor. VX-2 tumors grew increasingly within 14 d after implantation but the signal of most VX-2 tumors on DWI or on the map of ADC was uniform or uneven and ADC of VX tumors decreased obscurely or slightly because tumor necrosis was still not obvious. On the 21th d after implantation, the signal of most VX-2 tumors on DWI or on the map of ADC was uneven because tumor necrosis was evident and ADC of VX-2 tumor necrotic areas decreased. The areas of viable cells in VX-2 tumors manifested a high signal on DWI and a low signal on the map of ADC. The areas of dead cells or necrosis in VX-2 tumors manifested low signals on DWI and low, equal or high signals on the map of ADC but they manifested high signals on DWI and on the map of ADC at the same time when the areas of necrotic tumor became liquefied or cystic. The border of tumors on DWI appeared gradually distinct and internal signals of tumor became progressively uneven. CONCLUSION: The manifestations of viable, necrotic and liquefied or cystic areas in VX-2 tumors on DWI are typical and DWI is of significant and potential values in clinical application in both the early detection and diagnosis of liver tumors. 展开更多
关键词 LIVER VX-2 tumor diffusion-weightedimaging Apparent diffusion coefficient RABBIT
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Quantum tunneling in the surface diffusion of single hydrogen atoms on Cu(001)
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作者 于小凡 童洋武 杨勇 《Chinese Physics B》 SCIE EI CAS CSCD 2023年第8期361-367,共7页
The adsorption and diffusion of hydrogen atoms on Cu(001)are studied using first-principles calculations.By taking into account the contribution of zero-point energy(ZPE),the originally identical barriers are shown to... The adsorption and diffusion of hydrogen atoms on Cu(001)are studied using first-principles calculations.By taking into account the contribution of zero-point energy(ZPE),the originally identical barriers are shown to be different for H and D,which are respectively calculated to be~158 me V and~139 me V in height.Using the transfer matrix method(TMM),we are able to calculate the accurate probability of transmission across the barriers.The crucial role of quantum tunneling is clearly demonstrated at low-temperature region.By introducing a temperature-dependent attempting frequency prefactor,the rate constants and diffusion coefficients are calculated.The results are in agreement with the experimental measurements at temperatures from~50 K to 80 K. 展开更多
关键词 H/cu(001) first-principles calculations quantum tunneling diffusion coefficients
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Effect of Cu additions on interdiffusion behavior in the Al-Zn solid solution
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作者 任玉平 郝士明 《材料与冶金学报》 CAS 2005年第2期163-166,共4页
After diffusion couples were annealed at 260-360 ℃, the concentration profiles of Zn element were measured by EPMA. It has been first quantitatively determined by Matano method that the interdiffusion coefficient in ... After diffusion couples were annealed at 260-360 ℃, the concentration profiles of Zn element were measured by EPMA. It has been first quantitatively determined by Matano method that the interdiffusion coefficient in A1-Zn fee solid solution containing high Zn contents is remarkably decreased due to the small addition of Cu. Also, the interdiffusion coefficient in A1-Zn fee solid solution clearly increases with the increasing of Zn concentration. The interdiffusion activity energy remarkably decreases with the increasing of Zn contents. On the other hand, the interdiffusion activity energy markedly increases due to the small addition of Cu in the A1 Zn fcc solid solution containing high Zn contents. 展开更多
关键词 cu A1-Zn固溶体 扩散行为 活化能
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Al-2%Cu二元合金微观组织模拟中液相扩散系数的计算 被引量:3
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作者 卜晓兵 李落星 +3 位作者 张立强 朱必武 徐戎 王水平 《中国有色金属学报》 EI CAS CSCD 北大核心 2013年第5期1189-1194,共6页
采用改进的Miedema模型和Eyring模型,对Al-2%Cu合金的液相扩散系数进行理论计算,建立了二元合金液相扩散系数的理论计算模型,解决实验难以测量液相扩散系数导致数据匮乏的难题。在Eyring模型中,引入液态合金黏度—时间的变化曲线,替代... 采用改进的Miedema模型和Eyring模型,对Al-2%Cu合金的液相扩散系数进行理论计算,建立了二元合金液相扩散系数的理论计算模型,解决实验难以测量液相扩散系数导致数据匮乏的难题。在Eyring模型中,引入液态合金黏度—时间的变化曲线,替代原模型中的溶剂黏度数值,以进一步提高计算结果的准确性。在微观组织模拟中,基于常规恒定液相扩散系数模拟结果的柱状晶比例为20.1%,而基于本研究计算所得的液相扩散系数曲线模拟结果的柱状晶比例为64.8%,更接近实验测得的柱状晶比例58.1%,很好地验证了液相扩散系数理论计算模型的可行性和准确性。 展开更多
关键词 AL-cu合金 MIEDEMA模型 Eyring模型 扩散系数 微观组织
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TiW合金阻挡层对Cu/Cu^2+扩散的阻挡能力研究 被引量:1
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作者 唐昭焕 梁涛 +2 位作者 刘勇 谭开洲 王飞 《微电子学》 CAS CSCD 北大核心 2009年第4期567-570,共4页
通过对Cu/Cu2+在TiW及硅中的扩散理论分析,从理论上预测了薄TiW合金阻挡层存在的潜在可靠性问题。对一个发射结结深为0.38μm的PNP管β值的研究表明,80 nm以上厚度的TiW合金层可以在AlCu/TiW/Si系统中作为Cu/Cu2+的扩散阻挡层。
关键词 半导体工艺 TiW 扩散阻挡层 Alcu/TiW/Si系统 PNP晶体管 cu/cu2+
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高温高压对铸态Cu-38.13Zn-0.21Al合金热扩散系数及电阻率的影响 被引量:1
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作者 马玉泉 刘荣昌 张丽红 《材料热处理学报》 EI CAS CSCD 北大核心 2014年第S2期24-28,共5页
对铸态Cu-38.13Zn-0.21Al合金进行1~5 GPa,720℃保温20 min的高温高压处理,采用热常数测试仪和赛贝克电阻率测试仪测试了高温高压处理前后Cu-38.13Zn-0.21Al合金的热扩散系数及电阻率,用光学显微镜和透射电子显微镜对其微观组织进行观察... 对铸态Cu-38.13Zn-0.21Al合金进行1~5 GPa,720℃保温20 min的高温高压处理,采用热常数测试仪和赛贝克电阻率测试仪测试了高温高压处理前后Cu-38.13Zn-0.21Al合金的热扩散系数及电阻率,用光学显微镜和透射电子显微镜对其微观组织进行观察,并根据实验结果探讨了高温高压处理对Cu-38.13Zn-0.21Al合金热扩散系数及电阻率的影响。结果表明:高温高压处理能细化合金组织及增大组织内位错密度,使其热扩散系数降低和电阻率升高,在1~5 GPa范围内,压力为3 GPa时,热扩散系数达到最低值,为0.3024 cm2·s-1,较铸态样品的值降低了14.79%,而电阻率达到最高值,为7.657×10-8Ω·m-1,较铸态样品的值增大了7.48%。 展开更多
关键词 铸态cu-38.13Zn-0.21Al合金 高温高压处理 热扩散系数 电阻率
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Z-扫描技术对Cu(mpo)_2非线性系数的测定
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作者 钱超义 《无锡职业技术学院学报》 2008年第6期49-51,共3页
描述了一种重要的利用光束的横向分布测量光学非线性的单光束Z-扫描测试技术,待测样品放置于汇聚高斯光束的光轴(Z轴)上,逐渐向焦点处移动,在远处放置带有小孔的屏,可测得样品的透过率并通过理论分析得出它的非线性系数。
关键词 Z-扫描 非线性系数 cu(mpo)2材料
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服役参数对C_(f)-Al_(2)O_(3)/Cu复合材料摩擦磨损性能的影响 被引量:2
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作者 贾超凡 苏娟华 +5 位作者 李韶林 国秀花 宋克兴 冯孟奇 米绪军 李周 《材料热处理学报》 CAS CSCD 北大核心 2022年第8期27-36,共10页
为探究不同服役条件下C_(f)-Al_(2)O_(3)/Cu复合材料的摩擦磨损性能,采用QG-700型摩擦磨损试验机对其进行了在不同载荷和线速度条件下的摩擦磨损实验,分析了C_(f)-Al_(2)O_(3)/Cu复合材料的摩擦磨损性能和磨损机理。结果表明:载荷和线... 为探究不同服役条件下C_(f)-Al_(2)O_(3)/Cu复合材料的摩擦磨损性能,采用QG-700型摩擦磨损试验机对其进行了在不同载荷和线速度条件下的摩擦磨损实验,分析了C_(f)-Al_(2)O_(3)/Cu复合材料的摩擦磨损性能和磨损机理。结果表明:载荷和线速度对C_(f)-Al_(2)O_(3)/Cu复合材料的摩擦磨损特性有显著影响,在实验范围内,在载荷为10 N及线速度为0.59 m/s条件下,5C_(f)-Al_(2)O_(3)/Cu复合材料的摩擦磨损性能最佳,其摩擦系数和磨损率分别为0.45和1.488×10^(-5)mg/m。摩擦过程中在复合材料摩擦表面产生的机械混合层有利于摩擦副之间的润滑。随着载荷增大,机械混合层减少,C_(f)-Al_(2)O_(3)/Cu复合材料的磨损加剧,基体塑性变形程度增大;随着线速度的增大,机械混合层厚度增加,润滑状况得以改善,C_(f)-Al_(2)O_(3)/Cu复合材料的摩擦系数减小。 展开更多
关键词 C_(f)-Al_(2)O_(3)/cu复合材料 载荷 线速度 摩擦系数 磨损率
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扩散吸附作用下CO_(2)非混相驱微观渗流特征模拟
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作者 崔传智 李静 吴忠维 《岩性油气藏》 CAS CSCD 北大核心 2024年第6期181-188,共8页
利用数值模拟方法建立CO_(2)非混相驱数值模型,使用水平集法模拟扩散吸附作用下CO_(2)非混相驱和近混相驱的微观渗流规律,并对CO_(2)在孔隙中的微观渗流特征及扩散吸附特征进行研究,选取注入速度、扩散系数、吸附反应速率常数等参数研... 利用数值模拟方法建立CO_(2)非混相驱数值模型,使用水平集法模拟扩散吸附作用下CO_(2)非混相驱和近混相驱的微观渗流规律,并对CO_(2)在孔隙中的微观渗流特征及扩散吸附特征进行研究,选取注入速度、扩散系数、吸附反应速率常数等参数研究近混相驱微观渗流特征的影响因素。研究结果表明:①相场法CO_(2)驱数值模拟采出程度为51.29%,水平集法CO_(2)驱数值模拟采出程度为53.60%,因此水平集法更适用于CO_(2)非混相驱的渗流过程模拟。②非混相驱条件下,CO_(2)优先向大孔隙扩散,采收率为87.7%,出口气体体积分数为71.60%,CO_(2)最大表面吸附浓度为3.16×10-4mol/m^(2);近混相驱条件下,CO_(2)更易向小孔隙扩散,采收率为91.1%,出口含气率为97.01%,CO_(2)最大表面吸附浓度为5.81×10-4mol/m^(2)。③近混相驱微观渗流特征受注入速度、扩散系数、吸附反应速率常数等因素影响。注入速度增大,出口含气率和采收率均提高;扩散系数和吸附反应速率常数增大,会使采收率提高,出口含气率下降。 展开更多
关键词 CO_(2)非混相驱 微观渗流特征 注入速度 扩散系数 吸附反应速率常数 采收率 数值模拟
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基于MRI T_(2)WI与ADC图像的纹理分析鉴别直肠癌T_(3)亚分期的价值
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作者 程世德 陆超 +2 位作者 姚鸿欢 倪小云 陆志华 《浙江医学》 CAS 2024年第11期1163-1167,共5页
目的探讨基于MRI T2WI和表观扩散系数(ADC)图像的纹理分析鉴别直肠癌T3亚分期的价值。方法回顾性选取2016年7月至2020年9月经手术病理检查证实为T3期直肠癌的109例患者为研究对象,包括黄山首康医院20例和常熟市第一人民医院89例。所有... 目的探讨基于MRI T2WI和表观扩散系数(ADC)图像的纹理分析鉴别直肠癌T3亚分期的价值。方法回顾性选取2016年7月至2020年9月经手术病理检查证实为T3期直肠癌的109例患者为研究对象,包括黄山首康医院20例和常熟市第一人民医院89例。所有患者行MRI检查,分别在T2WI和ADC图像上勾画整个肿瘤体积,并提取一阶纹理参数(平均值、标准差、P5、P10、P90、偏度、峰度、均匀性)和二阶纹理参数(能量、熵、惯性、相关)。比较T_(3a)期和T_(3b-c)期直肠癌患者各纹理参数的差异,并绘制ROC曲线分析各纹理参数对T_(3a)期与T_(3b-c)期直肠癌的诊断效能。结果T_(3a)期53例,T_(3b)期42例,T_(3c)期14例。在T2WI图像纹理参数中,T_(3a)期直肠癌患者峰度明显低于T_(3b-c)期患者,而均匀性、能量均明显高于T_(3b-c)期患者,差异均有统计学意义(均P<0.05);峰度、均匀性、能量鉴别T_(3a)与T_(3b-c)期直肠癌的AUC分别为0.668、0.638、0.806。在ADC图像纹理参数中,T_(3a)期直肠癌患者偏度、熵均明显低于T_(3b-c)期患者(均P<0.05);偏度、熵鉴别T_(3a)与T_(3b-c)期直肠癌的AUC分别为0.626、0.731。结论基于MRI T2WI和ADC图像的纹理分析鉴别T_(3a)与T_(3b-c)期直肠癌具有一定的临床价值,其中T2WI图像纹理参数能量的诊断效能最高。 展开更多
关键词 直肠癌 磁共振成像 纹理分析 T2加权成像 表观扩散系数
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Effects of cryogenic treatment on the thermal physical properties of Cu_(76.12) Al_(23.88) alloy 被引量:13
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作者 WANG Ping LU Wei +2 位作者 WANG Yuehui LIU Jianhua ZHANG Ruijun 《Rare Metals》 SCIE EI CAS CSCD 2011年第6期644-649,共6页
The thermal diffusion coefficient, heat capacity, thermal conductivity, and thermal expansion coefficient of Cu76.12Al23.88 alloy before and after cryogenic treatment in the heating temperature range of 25℃ to 600℃ ... The thermal diffusion coefficient, heat capacity, thermal conductivity, and thermal expansion coefficient of Cu76.12Al23.88 alloy before and after cryogenic treatment in the heating temperature range of 25℃ to 600℃ were measured by thermal constant tester and thermal expansion instrument. The effects of cryogenic treatment on the thermal physical properties of CU76,12A123,88 alloy were investigated by comparing the variation of the thermal parameters before and after cryogenic treatment. The results show that the variation trend of the thermal diffusion coefficient, heat capacity, thermal conductivity, and thermal expansion coefficient of CU76.12Al23.88 alloy after cryogenic treatment was the same as before. The cryogenic treatment can increase the thermal diffusion coefficient, thermal conductivity, and thermal expansion coeffi- cient of Cu76.12Al23.88 alloy and decrease its heat capacity. The maximum difference in the thermal diffusion coefficient between the before and after cryogenic treatment appeared at 400℃. Similarly, thermal conductivity was observed at 200℃. 展开更多
关键词 cu76.12Al23 88 alloy cryogenic treatment thermal diffusion coefficient thermal expansion coefficient
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分子动力学分析Cu/Al_(2)Cu/Al体系的扩散过程
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作者 崔云峰 王文焱 +3 位作者 谢敬佩 王爱琴 毛志平 高铭 《材料热处理学报》 CAS CSCD 北大核心 2023年第11期167-175,共9页
基于分子动力学方法,对Cu/Al_(2)Cu/Al体系界面扩散过程进行了模拟研究。探讨了不同保温温度对Cu/Al_(2)Cu界面及Al/Al_(2)Cu界面扩散的影响,通过原子的均方位移和扩散系数对界面处原子的扩散行为进行分析,并通过径向分布函数和原子沿Z... 基于分子动力学方法,对Cu/Al_(2)Cu/Al体系界面扩散过程进行了模拟研究。探讨了不同保温温度对Cu/Al_(2)Cu界面及Al/Al_(2)Cu界面扩散的影响,通过原子的均方位移和扩散系数对界面处原子的扩散行为进行分析,并通过径向分布函数和原子沿Z轴浓度分布对界面演变进行分析。结果表明:在Cu/Al_(2)Cu界面处,Cu原子能够深入扩散到Al_(2)Cu内部,而Al_(2)Cu在933 K及以上时才能在界面附近向Cu侧扩散。界面处过渡层的厚度随着保温温度的升高而增加,且过渡层逐渐向两侧扩展。在Al/Al_(2)Cu界面处,Al原子与Al_(2)Cu相互扩散的现象非常明显,Al层在扩散过程中有序结构被破坏,呈现出混乱的状态;Cu层能够保持较高的有序性,但在933 K及以上时,Cu层结构有序性逐渐被破坏,且界面附近Cu层原子的结构相较于纯Cu层更为混乱。 展开更多
关键词 分子动力学 cu AL Al_(2)cu 界面扩散
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含Cu^(2+)电解质溶液活度系数预测
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作者 郑世杰 徐晨晨 陶东平 《有色金属工程》 CAS 北大核心 2023年第2期59-68,共10页
采用电解质分子相互作用体积模型eMIVM(Electrolyte Molecular Interaction Volume Model)与它的能量项eMIVM-ET(Energy term of eMIVM)分别对含Cu^(2+)的20个单电解质溶液的活度系数进行拟合,并对含Cu^(2+)的5个两电解质溶液的所有组... 采用电解质分子相互作用体积模型eMIVM(Electrolyte Molecular Interaction Volume Model)与它的能量项eMIVM-ET(Energy term of eMIVM)分别对含Cu^(2+)的20个单电解质溶液的活度系数进行拟合,并对含Cu^(2+)的5个两电解质溶液的所有组分活度系数进行预测。结果表明:两个模型对含Cu^(2+)单电解质溶液活度系数的拟合效果均较好,eMIVM模型预测的拟合平均偏差和平均相对误差分别为0.0598和6.4%,eMIVM-ET模型预测的分别为0.0163和3.0%;对含Cu^(2+)的两电解质溶液的所有组分活度系数预测时,eMIVM-ET模型的预测效果要比eMIVM模型的好,eMIVM-ET模型预测时的平均偏差和平均相对误差分别为0.0844和18.2%;在含Cu^(2+)电解质溶液的热力学计算中,与eMIVM模型相比,eMIVM-ET模型更适合作为一个可供选择的预测模型。 展开更多
关键词 cu^(2+)电解质溶液 活度系数预测 eMIVM-ET eMIVM
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ELECTROREDUCTION OF Zn2+ AND Ni2+ AND Cu2+ IN UREA-CHLORIDES MELT
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《中国有色金属学会会刊:英文版》 CSCD 1996年第2期41-44,52,共5页
ELECTROREDUCTIONOFZn<sup>2+</sup>ANDNi<sup>2+</sup>ANDCu<sup>2+</sup>INUREA-CHLORIDESMELTLiuPeng;YangQiqin... ELECTROREDUCTIONOFZn<sup>2+</sup>ANDNi<sup>2+</sup>ANDCu<sup>2+</sup>INUREA-CHLORIDESMELTLiuPeng;YangQiqin;LiuGuankun(DepartmentofChemistry,ZhongshanU?.. 展开更多
关键词 urea-chlorides melt ELECTROREDUCTION of Zn ̄(2+) Ni ̄(2+) and cu ̄(2+) diffusion coefficient transfer coefficient
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SrCl_(2)-KCl-MgCl_(2)熔体中氯化镁的电化学行为和镁锶共沉积机理
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作者 赵佳 闫艺航 +3 位作者 张皓 高华阳 张烨 路贵民 《Transactions of Nonferrous Metals Society of China》 SCIE EI CAS CSCD 2024年第7期2381-2392,共12页
采用循环伏安法、方波伏安法、开路电位等电化学手段评估SrCl_(2)-KCl共晶体系中MgCl_(2)的电化学行为和Mg、Sr共沉积机理。在SrCl_(2)-KCl体系中,Mg(Ⅱ)在钨电极的还原属于一步两电子的准可逆过程;Mg、Sr的电化学共沉积过程形成两种Mg... 采用循环伏安法、方波伏安法、开路电位等电化学手段评估SrCl_(2)-KCl共晶体系中MgCl_(2)的电化学行为和Mg、Sr共沉积机理。在SrCl_(2)-KCl体系中,Mg(Ⅱ)在钨电极的还原属于一步两电子的准可逆过程;Mg、Sr的电化学共沉积过程形成两种Mg-Sr金属间化合物。基于计时电流法探索共沉积过程的成核类型随过电位的演变关系,结果显示,电极表面的成核模式依赖于基体材料和电极反应产物。所有过电位下对应的前期成核归因于Mg(Ⅱ)的还原。当Mg和Sr共同沉积时,首先是Mg(Ⅱ)在电极表面还原,形成Mg核,随后同时进行Sr(Ⅱ)在Mg表面欠电位沉积和Mg的沉积。此外,随着SrCl_(2)-KCl体系中MgCl_(2)浓度的增加,Mg-Sr共沉积过程中的电流密度相应增加。 展开更多
关键词 氯化镁 电化学行为 扩散系数 成核机理 共沉积
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