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掺杂Mo的LiFePO4正极材料的电化学性能 被引量:30
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作者 陈宇 王忠丽 +2 位作者 于春洋 夏定国 吴自玉 《物理化学学报》 SCIE CAS CSCD 北大核心 2008年第8期1498-1502,共5页
通过固相法以(NH4)6Mo7O24·4H2O为钼源,在氮气气氛下合成出掺杂Mo的LiFePO4正极材料.采用X射线衍射(XRD)、扫描电子显微镜(SEM)、X射线光电子能谱(XPS)、扩展X射线吸收精细结构(EXAFS)和正电子湮没进行结构表征,通过不同放电倍率... 通过固相法以(NH4)6Mo7O24·4H2O为钼源,在氮气气氛下合成出掺杂Mo的LiFePO4正极材料.采用X射线衍射(XRD)、扫描电子显微镜(SEM)、X射线光电子能谱(XPS)、扩展X射线吸收精细结构(EXAFS)和正电子湮没进行结构表征,通过不同放电倍率研究掺Mo的LiFePO4电化学性能.结果表明,掺Mo的LiFePO4呈橄榄石结构,Mo6+同时占据着Fe位及Li位,提高了LiFePO4的电导率,1C放电可逆容量为141mAh·g-1,表现出良好的电化学性能. 展开更多
关键词 磷酸亚铁锂 固相法 离子掺杂 电子电导率
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用密度泛函和XANES计算研究Zn^(2+)在水锰矿表面的吸附和沉淀 被引量:10
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作者 朱孟强 潘纲 +7 位作者 刘涛 李贤良 杨玉环 李薇 李晋 胡天斗 吴自玉 谢亚宁 《物理化学学报》 SCIE CAS CSCD 北大核心 2005年第12期1378-1383,共6页
用密度泛函理论(densityfunctiontheory,DFT)和X射线近边结构(X-rayabsorptionnearedgestructure,XANES)模拟计算了不同酸度(pH=7.0,7.5和8.0)下Zn(II)在水锰矿表面的吸附.优化的几何结构表明,只有双边吸附方式的水解簇既能解释H+释放机... 用密度泛函理论(densityfunctiontheory,DFT)和X射线近边结构(X-rayabsorptionnearedgestructure,XANES)模拟计算了不同酸度(pH=7.0,7.5和8.0)下Zn(II)在水锰矿表面的吸附.优化的几何结构表明,只有双边吸附方式的水解簇既能解释H+释放机制,又能与扩展X射线吸收精细结构(extendedX-rayabsorptionfinestructure,EXAFS)实验键长值相吻合.吸附能计算表明,各种吸附方式的稳定性双边(DE)>双角(DC)>B型单边(SE-B)>A型单边(SE-A);水解能计算表明各种吸附态Zn2+均比溶液中水合锌离子易水解.各种吸附簇模型的XANES计算谱未能与实验谱吻合,即,表面发生的并不是简单的吸附.pH=7.5和pH=8.0吸附样品的XANES实验谱与Zn5(OH)6(CO3)2的实验谱非常接近,因此认为pH=7.5和pH=8.0下Zn(II)在水锰矿表面发生沉淀,Zn(II)是Zn—O八面体和Zn—O四面体的混合,它们按类似Zn5(OH)6(CO3)2结构中的八面体和四面体排列方式排列.pH=7.0时,Zn(II)在水锰矿表面发生的主要是边连接方式的吸附. 展开更多
关键词 密度泛函理论 XANES 表面吸附 沉淀 Zn(Ⅱ) Γ-MNOOH
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铂铋金属间化合物催化剂的氧还原与抗甲醇氧化性能 被引量:6
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作者 张丽娟 夏定国 +2 位作者 王振尧 袁嵘 吴自玉 《物理化学学报》 SCIE CAS CSCD 北大核心 2005年第3期287-290,共4页
采用氩弧熔炼后热处理方法制备了PtBi金属间化合物材料.采用循环伏安法和旋转圆盘电极进行电化学性能测试.通过在0.5mol·L-1H2SO4+0.25mol·L-1CH3OH溶液中对氧还原的起始电位和电流密度大小比较发现,与光滑铂电极相比,PtBi金... 采用氩弧熔炼后热处理方法制备了PtBi金属间化合物材料.采用循环伏安法和旋转圆盘电极进行电化学性能测试.通过在0.5mol·L-1H2SO4+0.25mol·L-1CH3OH溶液中对氧还原的起始电位和电流密度大小比较发现,与光滑铂电极相比,PtBi金属间化合物具有良好的氧还原催化性能和抗甲醇中毒性能.从结构方面分析了PtBi具有抗甲醇中毒性能的原因,认为是PtBi中Pt-Pt的间距大,不利于甲醇的吸附解离.X射线光电子能谱(XPS)结果表明,PtBi材料中Pt的d电子空穴增加,可能是导致PtBi电极表面氧还原电流增大的原因. 展开更多
关键词 电催化 PtBi 金属间化合物
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x光纳米光刻掩模的离子束制备法 被引量:1
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作者 韩勇 彭良强 +3 位作者 巨新 伊福廷 张菊芳 吴自玉 《微纳电子技术》 CAS 2002年第1期44-45,共2页
重离子束轰击聚碳酸酯后,对样品进行陈化和紫外线照射敏化,在优化条件下蚀刻后得到纳米孔径核孔膜。利用电化学沉积技术在核孔膜中制备了最小孔径为30纳米的铜纳米线。获得的铜纳米线/聚碳酸酯可以作为x光纳米光刻的掩模。
关键词 纳米光刻 纳米线 x光掩模 离子束制备法
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同步辐射X射线形貌术在宝石学中的应用 被引量:4
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作者 巫翔 吴自玉 田玉莲 《宝石和宝石学杂志》 CAS 2003年第3期15-18,共4页
简要介绍了X射线衍射形貌术实验技术及北京同步辐射实验室形貌站的实验技术。通过举例,扼要叙述了同步辐射X射线形貌术在宝石级晶体缺陷研究中的应用。
关键词 同步辐射 X射线形貌术 晶体缺陷
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基于ACO-BP神经网络的光伏发电短期功率预测研究
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作者 钟安德 吴自玉 +2 位作者 谢宗效 毛玉明 杨留方 《电子设计工程》 2024年第18期82-86,共5页
光伏发电存在着波动性和不确定性,对光伏发电系统的功率预测是提高光伏发电的利用率和经济效益的重要举措。通过构建蚁群算法(ACO)优化后的BP神经网络预测模型进行短期光伏功率预测研究,引入灰色关联度分析,确定影响光伏发电的主要因素... 光伏发电存在着波动性和不确定性,对光伏发电系统的功率预测是提高光伏发电的利用率和经济效益的重要举措。通过构建蚁群算法(ACO)优化后的BP神经网络预测模型进行短期光伏功率预测研究,引入灰色关联度分析,确定影响光伏发电的主要因素,提高模型的预测准确性。该模型综合了ACO的寻优能力和BP神经网络的自学习、自适应能力。将训练好的模型用于光伏发电短期功率预测研究,对比仿真结果得出ACO-BP神经网络模型在晴天时的预测误差为8.60%,多云时的预测误差为12.53%,雨天时的预测误差为26.27%,其预测精度均优于原BP神经网络模型。 展开更多
关键词 光伏发电 蚁群算法 BP神经网络 参数优化 短期功率预测
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铝掺杂LiFePO_4的表面成分结构及电化学性能研究 被引量:1
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作者 尚怀芳 黄伟峰 +2 位作者 储旺盛 夏定国 吴自玉 《电化学》 CAS CSCD 北大核心 2013年第6期558-564,共7页
锂离子电池正极材料掺杂LiFePO4的报道已很多,而涉及掺杂LiFePO4的表面成分及结构的研究仍很少见.本文采用溶剂热法一步制得了表面富Al的LiFePO4正极材料.TEM测试证实LiFePO4的表面形成均匀的无定型包覆层;俄歇电子能谱和软X射线吸收谱... 锂离子电池正极材料掺杂LiFePO4的报道已很多,而涉及掺杂LiFePO4的表面成分及结构的研究仍很少见.本文采用溶剂热法一步制得了表面富Al的LiFePO4正极材料.TEM测试证实LiFePO4的表面形成均匀的无定型包覆层;俄歇电子能谱和软X射线吸收谱均表明其表面的包覆层为部分Al替代Fe的LiFe1-x Alx PO4.表面富Al(x=0.02)的LiFePO4显示了较好的电化学倍率性能和低温性能,-10℃下充放电,电压范围2.2-4.2 V、0.1C倍率,电极的放电比容量为98 mAh·g-1,0.5C倍率放电比容量可达70 mAh·g-1.这归因于Al的加入改变了材料体相及表面的电子结构,增加了体相电子的传导及表面离子的传导. 展开更多
关键词 LIFEPO4 表面包覆 电化学性能
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Experimental research on the feature of an x-ray Talbot–Lau interferometer versus tube accelerating voltage 被引量:3
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作者 王圣浩 Margie P.Olbinado +7 位作者 Atsushi Momose 韩华杰 胡仁芳 王志立 高昆 张凯 朱佩平 吴自玉 《Chinese Physics B》 SCIE EI CAS CSCD 2015年第6期673-678,共6页
X-ray Talbot-Lau interferometer has been used most widely to perform x-ray phase-contrast imaging with a con- ventional low-brilliance x-ray source, and it yields high-sensitivity phase and dark-field images of sample... X-ray Talbot-Lau interferometer has been used most widely to perform x-ray phase-contrast imaging with a con- ventional low-brilliance x-ray source, and it yields high-sensitivity phase and dark-field images of samples producing low absorption contrast, thus beating tremendous potential for future clinical diagnosis. In this work, by changing the accel- erating voltage of the x-ray tube from 35 kV to 45 kV, x-ray phase-contrast imaging of a test sample is performed at each integer value of the accelerating voltage to investigate the characteristic of an x-ray Talbot-Lau interferometer (located in the Institute of Multidisciplinary Research for Advanced Materials, Tohoku University, Japan) versus tube voltage. Ex- perimental results and data analysis show that within a range this x-ray Talbot-Lau interferometer is not sensitive to the accelerating voltage of the tube with a constant fringe visibility of ~ 44%. This x-ray Talbot-Lau interferometer research demonstrates the feasibility of a new dual energy phase-contrast x-ray imaging strategy and the possibility to collect a refraction spectrum. 展开更多
关键词 x-ray Talbot-Lau interferometer x-ray imaging PHASE-CONTRAST tube accelerating voltage x-ray tube
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Penetrating view of nano-structures in Aleochara verna spermatheca and flagellum by hard X-ray microscopy 被引量:2
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作者 张凯 李德娥 +6 位作者 洪友丽 朱佩平 袁清习 黄万霞 高昆 周红章 吴自玉 《Chinese Physics B》 SCIE EI CAS CSCD 2013年第7期410-414,共5页
A penetrating view of the three-dimensional nanostructure of female spermatheca and male flagellum in the species Aleochara verna is obtained with 100-nm resolution using a hard X-ray microscope, which provides a fast... A penetrating view of the three-dimensional nanostructure of female spermatheca and male flagellum in the species Aleochara verna is obtained with 100-nm resolution using a hard X-ray microscope, which provides a fast noninvasive imaging technology for insect morphology. Through introducing Zernike phase contrast and heavy metal staining, images taken at 8 keV displayed sufficient contrast for observing nanoscale fine structures, such as the spermatheca cochleate duct and the subapex of the flagellum, which have some implications for the study of the sperm transfer process and genital evolution in insects. This work shows that both the spatial resolution and the contrast characteristic of hard X-ray microscopy are quite promising for insect morphology studies and, particularly, provide an attractive alternative to the destructive techniques used for investigating internal soft tissues. 展开更多
关键词 X-ray microscopy computed tomography synchrotron radiation source morphology
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Comparative analysis of phase extraction methods based on phase-stepping and shifting curve in grating interferometry 被引量:2
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作者 刘小松 李恩荣 +8 位作者 朱佩平 刘宜晋 张凯 王志立 洪友丽 张慧滔 袁清习 黄万霞 吴自玉 《Chinese Physics B》 SCIE EI CAS CSCD 2010年第4期173-179,共7页
Two phase extraction methods which are based separately on phase-stepping and shifting curve are mainly used in phase-sensitive imaging in gating interferometry to determine the x-ray phase shift induced by an object ... Two phase extraction methods which are based separately on phase-stepping and shifting curve are mainly used in phase-sensitive imaging in gating interferometry to determine the x-ray phase shift induced by an object in the beam. In this paper, the authors perform a full comparative analysis and present the main virtues and limitations of these two methods according to the theoretical analysis of the grating interferometry. 展开更多
关键词 x-ray phase sensitive imaging grating interferometer phase-stepping shifting curve
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A new method for information retrieval in two-dimensional grating-based X-ray phase contrast imaging 被引量:1
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作者 王志立 高昆 +4 位作者 陈健 葛昕 朱佩平 田扬超 吴自玉 《Chinese Physics B》 SCIE EI CAS CSCD 2012年第11期547-553,共7页
Grating-based X-ray phase contrast imaging has been demonstrated to he an extremely powerful phase-sensitive imaging technique. By using two-dimensional (2D) gratings, the observable contrast is extended to two refr... Grating-based X-ray phase contrast imaging has been demonstrated to he an extremely powerful phase-sensitive imaging technique. By using two-dimensional (2D) gratings, the observable contrast is extended to two refraction directions. Recently, we have developed a novel reverse-projection (RP) method, which is capable of retrieving the object information efficiently with one-dimensional (1D) grating-based phase contrast imaging. In this contribution, we present its extension to the 2D grating-based X-ray phase contrast imaging, named the two-dimensional reverse- projection (2D-RP) method, for information retrieval. The method takes into account the nonlinear contributions of two refraction directions and allows the retrieval of the absorption, the horizontal and the vertical refraction images. The obtained information can be used for the reconstruction of the three-dimensionak phase gradient field, and for an improved phase map retrieval and reconstruction. Numerical experiments are carried out, and the results confirm the validity of the 2D-RP method. 展开更多
关键词 X-ray imaging phase contrast information retrieval shifting curve
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Investigation of noise properties in grating-based x-ray phase tomography with reverse projection method
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作者 鲍园 王研 +3 位作者 高昆 王志立 朱佩平 吴自玉 《Chinese Physics B》 SCIE EI CAS CSCD 2015年第10期622-628,共7页
The relationship between noise variance and spatial resolution in grating-based x-ray phase computed tomography(PCT) imaging is investigated with reverse projection extraction method, and the noise variances of the ... The relationship between noise variance and spatial resolution in grating-based x-ray phase computed tomography(PCT) imaging is investigated with reverse projection extraction method, and the noise variances of the reconstructed absorption coefficient and refractive index decrement are compared. For the differential phase contrast method, the noise variance in the differential projection images follows the same inverse-square law with spatial resolution as in conventional absorption-based x-ray imaging projections. However, both theoretical analysis and simulations demonstrate that in PCT the noise variance of the reconstructed refractive index decrement scales with spatial resolution follows an inverse linear relationship at fixed slice thickness, while the noise variance of the reconstructed absorption coefficient conforms with the inverse cubic law. The results indicate that, for the same noise variance level, PCT imaging may enable higher spatial resolution than conventional absorption computed tomography(ACT), while ACT benefits more from degraded spatial resolution. This could be a useful guidance in imaging the inner structure of the sample in higher spatial resolution. 展开更多
关键词 x-ray imaging noise variance spatial resolution computed tomography (CT)
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Cosine fitting radiography and computed tomography
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作者 李盼云 张凯 +5 位作者 黄万霞 袁清习 王研 鞠在强 吴自玉 朱佩平 《Chinese Physics B》 SCIE EI CAS CSCD 2015年第6期679-686,共8页
A new method in diffraction-enhanced imaging computed tomography (DEI-CT) that follows the idea developed by Chapman et al. [Chapman D, Thomlinson W, Johnston R E, Washburn D, Pisano E, Gmur N, Zhong Z, Menk R, Arfe... A new method in diffraction-enhanced imaging computed tomography (DEI-CT) that follows the idea developed by Chapman et al. [Chapman D, Thomlinson W, Johnston R E, Washburn D, Pisano E, Gmur N, Zhong Z, Menk R, Arfelli F and Sayers D 1997 Phys. Med. BioL 42 2015] in 1997 is proposed in this paper. Merged with a "reverse projections" algorithm, only two sets of projection datasets at two defined orientations of the analyzer crystal are needed to reconstruct the linear absorption coefficient, the decrement of the real part of the refractive index and the linear scattering coefficient of the sample. Not only does this method reduce the delivered dose to the sample without degrading the image quality, but, compared with the existing DEI-CT approaches, it simplifies data-acquisition procedures. Experimental results confirm the reliability of this new method for DEI-CT applications. 展开更多
关键词 x-ray imaging diffraction-enhanced imaging phase contrast computed tomography
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Structured dark-field imaging for single nano-particles
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作者 陈健 高昆 +2 位作者 王志立 云文兵 吴自玉 《Chinese Physics B》 SCIE EI CAS CSCD 2015年第8期497-500,共4页
In this work, we extensively describe and demonstrate the structured dark-field imaging(SDFI). SDFI is a newly proposed x-ray microscopy designed for revealing the fine features below Rayleigh resolution, in which dif... In this work, we extensively describe and demonstrate the structured dark-field imaging(SDFI). SDFI is a newly proposed x-ray microscopy designed for revealing the fine features below Rayleigh resolution, in which different orders of scattered x-ray photons are collected by changing the numerical aperture of the condenser. Here, the samples of single particles are discussed to extend the scope of the SDFI technique reported in a previous work(Chen J, Gao K, Ge X, et al.2013 Opt. Lett. 38 2068). In addition, the details of the newly invented algorithm are explained, which is able to calculate the intensity of any pixel on the image plane rapidly and reliably. 展开更多
关键词 x-ray microscopy Rayleigh resolution fast algorithm
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Determination of the sites of Fe atoms in Fe-substituted Mn12
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作者 曹慧波 陈栋梁 +4 位作者 何伦华 张俊荣 王芳卫 吴自玉 严启伟 《Chinese Physics B》 SCIE EI CAS CSCD 2007年第3期784-787,共4页
In this paper neutron diffraction experiments were performed for Fe-substituted Mn12 in order to determine the sites of Fe atoms. The results of structure refinements for the sample with our accessed highest Fe conten... In this paper neutron diffraction experiments were performed for Fe-substituted Mn12 in order to determine the sites of Fe atoms. The results of structure refinements for the sample with our accessed highest Fe content showed that all Fe atoms occupied Mn(3) sites in the Mn12 skeleton. The x-ray absorption fine structure experiments as well as multiple scattering simulations gave the same result. Thus we concluded that Fe atoms only occupied Mn(3) sites. This conclusion also means that Fe-substituted Mn12 series only includes the four single-molecule magnets of [Mn12-xFexO12(CH3COO)16(H2O)4]·2CH3COOH·4H2O (x = 1, 2, 3, and 4), denoted by Mn11Fe1, Mn10Fe2, MngFe3, and Mn8Fe4, respectively. 展开更多
关键词 single-molecule magnets neutron diffraction x-ray absorption fine structure
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Reconstructing a complex field from a series of its near-field diffraction patterns
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作者 洪友丽 张凯 +6 位作者 王志立 朱中柱 赵雪娇 黄万霞 袁清习 朱佩平 吴自玉 《Chinese Physics B》 SCIE EI CAS CSCD 2012年第10期260-264,共5页
We propose a method for reconstructing a complex field from a series of its near-field diffraction patterns.This method is based on the paraxial Fresnel diffraction equation without making further approximations.Numer... We propose a method for reconstructing a complex field from a series of its near-field diffraction patterns.This method is based on the paraxial Fresnel diffraction equation without making further approximations.Numerical simulations are presented showing that a complex field can even be reconstructed with moderate qualities from its two near-field diffraction patterns and almost exact reconstructions can be obtained when three or more diffraction patterns are used.We also show by numerical simulation that the correct diffraction distances can be recovered in case only coarsely measured values are available.This method may be applied to phase imaging of weak-absorption objects. 展开更多
关键词 phase imaging near field phase retrieval
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Compressibility of Epidote up to 20 GPa at 298K
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作者 秦善 巫翔 +4 位作者 刘珺 刘景 吴自玉 李晓东 鲁安怀 《Chinese Physics Letters》 SCIE CAS CSCD 2003年第7期1172-1174,共3页
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