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Influence of Replacement Level of Coal-series Kaolin on Hydration of Ordinary Portland Cement by X-ray Diffraction/Rietveld Method 被引量:1
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作者 LIU Yuanyuan LEI Shaomin 《Journal of Wuhan University of Technology(Materials Science)》 SCIE EI CAS 2019年第3期614-621,共8页
The influence of replacement level of calcined coal-series kaolin(CCK) on hydration of ordinary Portland cement(OPC) was studied by X-ray diffraction(XRD)/Rietveld method. X-ray diffraction/Rietveld method was used to... The influence of replacement level of calcined coal-series kaolin(CCK) on hydration of ordinary Portland cement(OPC) was studied by X-ray diffraction(XRD)/Rietveld method. X-ray diffraction/Rietveld method was used to quantify the crystalline phase composition of the hydrated samples. Additionally, the morphology of hydrated samples was observed by scanning electron microscopy(SEM). The results showed that, calcium hydroxide(CH), ettringite(AFt) and amorphous phase content in hydrated samples decreased as the replacement level of CCK increased, while AFm and str?tlingite increased, which was caused by the combination of dilute, physical and pozzolanic effects. The hydration of anhydrous cement phases was accelerated by physical effect but hindered by the retardation effect of CCK. The role of each effects was discussed in detail to analyze the mechanism of OPC hydration with CCK addition. The SEM images showed that the shortening of AFt at 1 day and the denser texture at 28 days was observed with CCK addition, which was caused by the physical and pozzolanic effects, respectively. 展开更多
关键词 CALCINED coal-series KAOLIN x-ray diffraction/rietveld method HYDRATION cement PASTE morphology
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SnO_2-based solid solutions for CH_4 deep oxidation: Quantifying the lattice capacity of SnO_2 using an X-ray diffraction extrapolation method
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作者 孙琪 徐香兰 +5 位作者 彭洪根 方修忠 刘文明 应家伟 余帆 王翔 《Chinese Journal of Catalysis》 SCIE EI CAS CSCD 北大核心 2016年第8期1293-1302,共10页
A series of SnO2‐based catalysts modified by Mn, Zr, Ti and Pb oxides with a Sn/M (M=Mn, Zr, Ti and Pb) molar ratio of 9/1 were prepared by a co‐precipitation method and used for CH4 and CO oxidation. The Mn3+, ... A series of SnO2‐based catalysts modified by Mn, Zr, Ti and Pb oxides with a Sn/M (M=Mn, Zr, Ti and Pb) molar ratio of 9/1 were prepared by a co‐precipitation method and used for CH4 and CO oxidation. The Mn3+, Zr4+, Ti4+and Pb4+cations are incorporated into the lattice of tetragonal rutile SnO2 to form a solid solution structure. As a consequence, the surface area and thermal stability of the catalysts are improved. Moreover, the oxygen species of the modified catalysts become easier to be reduced. Therefore, the oxidation activity over the catalysts was improved, except for the one modified by Pb oxide. Manganese oxide demonstrates the best promotional effects for SnO2. Using an X‐ray diffraction extrapolation method, the lattice capacity of SnO2 for Mn2O3 was 0.135 g Mn2O3/g SnO2, which indicates that to form stable solid solution, only 21%Sn4+cations in the lattice can be maximally replaced by Mn3+. If the amount of Mn3+cations is over the capacity, Mn2O3 will be formed, which is not favorable for the activity of the catalysts. The Sn rich samples with only Sn‐Mn solid solution phase show higher activity than the ones with excess Mn2O3 species. 展开更多
关键词 SnO2-based solid solution x-ray diffraction extrapolation method Lattice capacity Methane deep oxidation Carbon monoxide oxidation
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Rietveld quantification of γ-C_2S conversion rate supported by synchrotron X-ray diffraction images 被引量:4
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作者 Pi-qi ZHAO Xian-ping LIU +1 位作者 Jian-guo WU Pei-ming WANG 《Journal of Zhejiang University-Science A(Applied Physics & Engineering)》 SCIE EI CAS CSCD 2013年第11期815-821,共7页
The pure γ-Ca2SiO4 (]t-C2S) phase was prepared at 1623 K of calcining temperature, 10 h of holding time and furnace cooling. The 13-C2S phase was obtained through γ-C2S conversion with the following calcination sy... The pure γ-Ca2SiO4 (]t-C2S) phase was prepared at 1623 K of calcining temperature, 10 h of holding time and furnace cooling. The 13-C2S phase was obtained through γ-C2S conversion with the following calcination system which was adopted at 1473 K of calcining temperature, 1 h of holding time and then water-cooling. The conversion rate of γ-C2S was studied by the Rietveld quantitative laboratory X-ray powder diffraction supported by synchrotron X-ray diffraction images. The refinement results show that the final conversion rate of γ-C2S is higher than 92%. The absolute error of the γ-C2S conversion rate between two Rietveld refinements (sample with or without α-Al2O3) is 3.6%, which shows that the Rietveld quantitative X-ray diffraction analysis is an appropriate and accurate method to quantify the γ-C2S conversion rate. 展开更多
关键词 β-C28 γ-C28 rietveld quantification Synchrotron x-ray diffraction image
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Rietveld refinement of powder X-ray diffraction,microstructural and mechanical studies of magnesium matrix composites processed by high energy ball milling 被引量:2
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作者 T.Ramkumar M.Selvakumar +3 位作者 R.Vasanthsankar A.S.Sathishkumar P.Narayanasamy G.Girija 《Journal of Magnesium and Alloys》 SCIE EI CAS 2018年第4期390-398,共9页
This research reports the processing of magnesium matrix composites reinforced with silicon carbide(SiC)and aluminium oxide(Al_(2)O_(3))using powder metallurgy technique through high energy milling.Samples of Mg-SiC a... This research reports the processing of magnesium matrix composites reinforced with silicon carbide(SiC)and aluminium oxide(Al_(2)O_(3))using powder metallurgy technique through high energy milling.Samples of Mg-SiC and Mg-Al_(2)O_(3)composites subjected to high energy ball milling for different vol%of secondary particles 20,30 and 40%of SiC and Al_(2)O_(3)are studied by X-Ray diffraction technique.The rietveld method as implemented in the Fullprof program is applied in order to determine the quantities of the resulting crystalline phases and amorphous phases at each stage of the mechanical treatment.Microstructural examination is carried out using Scanning Electron Microscope(SEM).In addition,crystal structural analysis using appropriate size and strain models is performed in order to handle the distinctive anistrophy that is observed in convinced crystallographic directions for the magnesium composite.The results are furnished in terms of crystalline domains size enlargement of the magnesium composites phases upon prolonged milling duration and discussed in the light of up to date views and theories on crystal growth of nanocrystaline materials.The hardness of the composite samples is calculated by Vickers’s Hardness tester.Further,dry sling wear test and corrosion test are performed for the fabricated composites.Composite with 30%secondary particles incorporated magnesium composites exhibits better wear and corrosion resistance than the other composites. 展开更多
关键词 rietveld refinement x-ray diffraction Crystal structure Micro structure Wear and corrosion
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Correlation between crystal structure and mechanical performance of Cr-implanted 300M high-strength steel using X-ray diffraction method 被引量:1
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作者 Xiao-hu Chen Ping-ze Zhang +5 位作者 Dong-bo Wei Xiao Huang Feng Ding Feng-kun Li Xian-jun Dai Zhang-zhong Wang 《Journal of Iron and Steel Research International》 SCIE EI CAS CSCD 2019年第10期1106-1116,共11页
In order to study the influence of crystal structure change due to implantation dose on the hardness and wear performance of 300M high-strength steel,samples were surface modified by Cr implantation with dosages of 5.... In order to study the influence of crystal structure change due to implantation dose on the hardness and wear performance of 300M high-strength steel,samples were surface modified by Cr implantation with dosages of 5.0 × 10^16,1.5 × 10^17 and 3.0 × 10^17 ions/cm^2.X-ray diffraction method,which was already applied in studies on the microstructure of deformed and heat-treated materials,was used to study the crystal structure of the implanted steel,and the results were corrected with the hardness and wear performance.The solid solution strengthening effect and microstructure vary with increase in implantation dose.Owing to strong solid solution hardening of Cr,small average crystallite size and high dislocation density,the hardness and wear resistance of implanted steel with dose of 5.0 × 10^16 ions/cm^2 were found to be the highest compared with other samples.Moreover,although the crystal lite size of the implanted sample with dose of 3 × 10^17 ions/cm^2 was similar to that of substrate and the dislocation density was lower than that of the substrate,its higher hardness and lower specific wear rate were due to the solid solution hardening and perhaps Cr clusters reinforcement. 展开更多
关键词 x-ray diffraction method Ion IMPLANTATION DISLOCATION density HARDNESS Wear Crystal structure
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X-ray Powder Diffraction Data and Rietveld Refinement for NdCoGe_3
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作者 严嘉琳 覃文 +2 位作者 区向丽 曾令民 郝建民 《Rare Metals》 SCIE EI CAS CSCD 1998年第2期30-35,共6页
オ-ray powder diffraction data and crystal structure of RE compound NdCoGe3 were studied by using X-ray powder diffraction and refined by the Rietveld profile fitting method. The compound has the tetragonal BaNiSn3typ... オ-ray powder diffraction data and crystal structure of RE compound NdCoGe3 were studied by using X-ray powder diffraction and refined by the Rietveld profile fitting method. The compound has the tetragonal BaNiSn3type structure, space group I4mm (No.107) a=0.42961(2) nm, c=098147(4) nm, V=0.018114 nm3, Z=2 and Dx=7.717 g·cm-3. The figure of merit FN for the powder data is F30=623 (0.0107, 45). Structure refinement was performed with 110 reflections and led to Rp=11.78% and Rwp=16.56%. 展开更多
关键词 NdCoGe3 x-ray powder diffraction rietveld structure refinement
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Microfibril angle variability in Masson Pine (Pinus massoniana Lamb.) using X-ray diffraction 被引量:1
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作者 Zhang Bo Fei Ben-hua +1 位作者 Yu Yan Zhao Rong-jun 《Forestry Studies in China》 CAS 2007年第1期33-38,共6页
The microfibril angle of fiber walls is an ultra-mieroscopic feature affecting the performance of wood products. It is therefore essential to get more definitive information to improve selection and utilization. X-ray... The microfibril angle of fiber walls is an ultra-mieroscopic feature affecting the performance of wood products. It is therefore essential to get more definitive information to improve selection and utilization. X-ray diffraction is a rapid method for measuring microfibril angles. In this paper, the variability of microfibril angle in plantation-grown Masson pine was investigated by peak-fitting method. This method was compared with the traditional hand-drawn method, 40% peak height method and half peak height method. X-ray diffraction measurements indicated that the microfibril angle changed as a function of the position in the tree. The mean microfibril angle decreased more gradually as the distance increased from the pith and reached the same level in mature wood. The microfibril angle also seemed to decrease clearly from the base upward. Differences of angle-intensity curves between heartwood and sapwood were also examined. 展开更多
关键词 x-ray diffraction microfibril angle peak-fitting method half peak height method Masson pine
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X-Ray and Neutron Diffraction Studies on Thermal Parameters of Thalous Bromide
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作者 J.Bashir R.T.A.Khan +1 位作者 T.Ikeda KenichiOhshima 《Journal of Materials Science & Technology》 SCIE EI CAS CSCD 2003年第2期189-190,共2页
Thermal parameters of TIBr were determined using both X-ray and neutron diffraction techniques. The data was analysed by Rietveld profile refinement procedure. From the neutron diffraction data, due to weak odd-order ... Thermal parameters of TIBr were determined using both X-ray and neutron diffraction techniques. The data was analysed by Rietveld profile refinement procedure. From the neutron diffraction data, due to weak odd-order reflections, it was not possible to determine the individual thermal parameters. TheX-ray diffraction measurements yielded BT1=0.296(5) nm2 and BBr=0.162(5) nm2. The overall isotropic value, B was 0.252(7) nm2 which is in good agreement with B=0.230(8) nm2 obtained from present neutron diffraction measurements. The present values are also in good agreement with theoretical estimates obtained from the shell models. 展开更多
关键词 Thallium bromide Temperature factors Debye temperature rietveld refinement Neutron diffraction x-ray diffraction
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X-Ray Powder Diffraction: Why Not Use CuKβ Radiation?
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作者 Hans Hermann Otto 《Journal of Analytical Sciences, Methods and Instrumentation》 2018年第3期37-47,共11页
CuKβ radiation with a wavelength of λ = 1.3923 ? is recommended for crystal structure determination from X-ray powder diffraction using the Rietfeld method. A highly sensitive image plate detector is able to collect... CuKβ radiation with a wavelength of λ = 1.3923 ? is recommended for crystal structure determination from X-ray powder diffraction using the Rietfeld method. A highly sensitive image plate detector is able to collect enough intensity to record a brilliant X-ray powder pattern in a reasonable time, compared to CuKα1 radiation used today. Especially atomic displacement coefficients could be determined more precisely with the much greater number of reflections recorded. A double-radius Guinier camera attached to a micro-focus rotating anode tube ensures increased brilliance besides high resolution. A simple construction specification is presented to make smart cylindrically bent Ge(111) or Si(111) X-ray monochromators that deliver focused CuKβ radiation. The highly linear response of image plate detectors allows removing of fluorescence radiation simply as background of the pattern. The proposed equipment is a cost-efficient alternative to a liquid gallium-metal-jet X-ray source with maximum power load and a similar wavelength of λ(GaKα1) = 1.34013 ?. 展开更多
关键词 x-ray diffraction Rietfeld Analysis CuKβ RADIATION Guinier method FOCUSING MONOCHROMATORS x-ray diffraction Equipment Construction
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Analytical solution of crystal diffraction intensity
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作者 Wan-Li Shang Ao Sun +13 位作者 Hua-Bin Du Guo-Hong Yang Min-Xi Wei Xu-Fei Xie Xing-Sen Che Li-Fei Hou Wen-Hai Zhang Miao Li Jun Shi Feng Wang Hai-En He Jia-Min Yang Shao-En Jiang Bao-Han Zhang 《Chinese Physics B》 SCIE EI CAS CSCD 2021年第11期430-433,共4页
Plasma density and temperature can be diagnosed by x-ray line emission measurement with crystal,and bent crystals such as von Hamos and Hall structures are proposed to improve the diffraction brightness.In this study,... Plasma density and temperature can be diagnosed by x-ray line emission measurement with crystal,and bent crystals such as von Hamos and Hall structures are proposed to improve the diffraction brightness.In this study,a straightforward solution for the focusing schemes of flat and bent crystals is provided.Simulations with XOP code are performed to validate the analytical model,and good agreements are achieved.The von Hamos or multi-cone crystal can lead to several hundred times intensity enhancements for a 200μm plasma source.This model benefits the applications of the focusing bent crystals. 展开更多
关键词 crystal diffraction analytic method x-ray diffraction
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X-RAY RIETVELD STRUCTURE REFINEMENT OF ErNiSb
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作者 Zeng Lingmin Yan Jialin +2 位作者 Ou Xiangli He Wei Zhuang Yinghong 《中国有色金属学会会刊:英文版》 CSCD 1998年第1期19-20,共2页
The crystal structure of compound ErNiSb has been refined by the Rietveld wholepatternfitting method from X-ray powder diffraction data.The compound ErNiSb is cubic, space group F43m and the structure parameters and r... The crystal structure of compound ErNiSb has been refined by the Rietveld wholepatternfitting method from X-ray powder diffraction data.The compound ErNiSb is cubic, space group F43m and the structure parameters and reliability factors were refined to be a=6.268 3(1), V=246.29^(3), Z=4, D_(x)=9.377 g/cm^3, R_(B)=3.57%, R_(F)=3.64%, R_(p)=6.63%, R_(WP)=8.80%. 展开更多
关键词 x-ray powder diffraction rietveld analysis structure refinement
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Comparative Study on the Defects of Kaolinite from America,Brazil and China Applied for Paper Coating:XRD and Refinement by Rietveld Method
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作者 朱小燕 ZHU Zhichao +2 位作者 LEI Xinrong YAN Chunjie CHEN Jieyu 《Journal of Wuhan University of Technology(Materials Science)》 SCIE EI CAS 2017年第2期373-377,共5页
Three kaolinite samples applied for paper coating were collected from America(KA),Brazil(KB),and China(KC),respectively.Parameters such as average bond length of Si-O and Al-O(1(Si-O) and1((Al-O))),tetra... Three kaolinite samples applied for paper coating were collected from America(KA),Brazil(KB),and China(KC),respectively.Parameters such as average bond length of Si-O and Al-O(1(Si-O) and1((Al-O))),tetrahedral rotation angles(α),changes of tetrahedral flattemng angles(τ) and octahedral flattemng angles(ψ) comparative to ideal angle,particle layer thickness(T) and basal z corrugation(Δz) were analyzed by XRD and Rietveld method.The experimental results indicated that △z(KA)〉△z(KC)〉△z(KB).KB has a regular structure and KA has a disorder structure,α(KA)〉α(KC)〉α(KB),△τ(KA)〉△τ(KC)〉△τ(KB),and △ψ(KA)〉△ψ(KB)〉△ψ(KC).KA has unstable tetrahedron and octahedron.KB and KC have stable tetrahedron and octahedron,respectively.In the process of manufacture,kaolinite structure may be broken from places with unstable tetrahedron and octahedron.l(Si-O)(KA) 〉l(Si-O)(KB)〉l(Si-O)(KC) and 1(A1-O)KA〉1(A1-O)(KC)〉1(A1-O)(KB).What only considered is the effect of bond length,KA may be most easily broken in the manufacture.Compared with bond lengths of KA and KB,Si-O,and Al-O of KB and KC may be easily broken,respectively.T(KA) 展开更多
关键词 x-ray diffraction rietveld method defects distortion
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基于Rietveld精修法的水泥熟料物相定量分析 被引量:16
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作者 王培铭 赵丕琪 刘贤萍 《建筑材料学报》 EI CAS CSCD 北大核心 2015年第4期692-698,共7页
基于Rietveld精修法,通过Topas软件对水泥熟料的实验室X射线衍射(XRD)图谱进行拟合,分别研究晶体结构模型组合、精修区间和XRD扫描设定对熟料定量精修结果的影响.结果表明:多晶型晶体结构模型组合参与Rietveld定量精修可获得更为准确的... 基于Rietveld精修法,通过Topas软件对水泥熟料的实验室X射线衍射(XRD)图谱进行拟合,分别研究晶体结构模型组合、精修区间和XRD扫描设定对熟料定量精修结果的影响.结果表明:多晶型晶体结构模型组合参与Rietveld定量精修可获得更为准确的矿物组成结果.对于实验室XRD图谱,选取2θ=(25°,70°)的精修区间即可满足定量精修的准确度.对于XRD扫描设定的研究表明,图谱的信噪比(有效counts值)较分辨率对Rietveld定量精修结果的影响更大;随着连续扫描速度的提高,Rietveld定量精修结果的误差逐渐增大,为保证定量精修结果的准确性和精确性,连续扫描的临界速度取2(°)/min. 展开更多
关键词 rietveld X射线衍射 水泥熟料 Topas
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基于Rietveld法硅酸盐水泥熟料定量结果的准确性分析 被引量:6
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作者 赵丕琪 王培铭 刘贤萍 《功能材料》 EI CAS CSCD 北大核心 2015年第5期5095-5100,共6页
通过固相反应所制备的熟料单矿物用于人工配制不同硅酸盐水泥熟料体系,利用Topas软件对其X射线衍射图谱进行拟合分析,研究Rietveld定量结果的准确性.结果表明,所制备的4种单矿物精修后的相关系数fc 均为1±0.07,说明不存在显著的无... 通过固相反应所制备的熟料单矿物用于人工配制不同硅酸盐水泥熟料体系,利用Topas软件对其X射线衍射图谱进行拟合分析,研究Rietveld定量结果的准确性.结果表明,所制备的4种单矿物精修后的相关系数fc 均为1±0.07,说明不存在显著的无定型相等样品误差以及Rietveld精修的计算误差.Rietveld法定量分析所配制的不同熟料体系,各相绝对误差加和(SAE)约为5%.同一熟料体系中相对含量高的矿物(〉25%),其定量结果的相对误差约为5%;相对含量低的矿物(〈20%),其定量结果的相对误差介于8.3%-16.8%之间.比较不同扫描方式的Rietveld定量结果,虽然从相对误差分析显示步进扫描(5s/step)的准确度高于连续扫描(2°/min),尤其是C3S和C2S两种矿物的相对误差和(SRE)较2°/min的连续扫描低约4%,但两种扫描方式的SAE并无明显差异,各样品的SAE的差值均在1%左右. 展开更多
关键词 水泥熟料单矿物 X射线衍射 定量分析 rietveld Topas
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Rietveld法计算MH-Ni电池电极材料物相标准谱 被引量:8
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作者 王超群 王宁 李娜娜 《电源技术》 CAS CSCD 北大核心 2002年第6期445-447,共3页
用Rietveld分析法模拟计算MH Ni电池电极材料主要物相 [如 β Ni(OH) 2 ,γ NiOOH和LaNi5,La2 O3 与La(OH) 3等 ]标准X射线衍射谱 ,并根据多相体模型定量分析 (或称无标定量相分析法 )确定电极制备与充放电过程中少量第二相的含量。结... 用Rietveld分析法模拟计算MH Ni电池电极材料主要物相 [如 β Ni(OH) 2 ,γ NiOOH和LaNi5,La2 O3 与La(OH) 3等 ]标准X射线衍射谱 ,并根据多相体模型定量分析 (或称无标定量相分析法 )确定电极制备与充放电过程中少量第二相的含量。结果表明 :在峰形与峰宽参数选择合适以及无择优取向的条件下 ,模拟计算结果与参比强度法也即K值法[1]测算的结果相一致。该法的优点是可以给出全衍射谱的概念 。 展开更多
关键词 rietveld 计算 MH-NI电池 电极材料 物相标准谱 标准X射线衍射谱 定量相分析
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热轧板氧化皮Rietveld全谱拟合定量分析 被引量:7
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作者 宓小川 刘莲君 《物理测试》 CAS 2008年第2期31-34,共4页
利用Rietveld全谱线形拟合技术定量测定了热轧板表面氧化皮各组成相的含量,谱线拟合时准确、合理地选择晶体学参数和峰形模型是拟合成败的关键。与传统的X射线衍射定量方法相比,Rietveld全谱线形拟合定量分析具有无需标样、适用面广、... 利用Rietveld全谱线形拟合技术定量测定了热轧板表面氧化皮各组成相的含量,谱线拟合时准确、合理地选择晶体学参数和峰形模型是拟合成败的关键。与传统的X射线衍射定量方法相比,Rietveld全谱线形拟合定量分析具有无需标样、适用面广、结果准确等特点。 展开更多
关键词 rietveld全谱拟合 X射线衍射 氧化皮 定量分析
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Rietveld法在半结晶聚酯二相共存结构分析中的应用
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作者 韩甫田 郝建明 +2 位作者 郭立平 刘平安 刘军 《分析测试学报》 CAS CSCD 北大核心 2003年第3期18-21,共4页
用Rietveld法对试样BaF2 的实测X射线衍射全谱图 (XDWP)数据进行精修 ,获得正确的结晶相结构参数 ,重点讨论了如何正确选择衍射峰型函数和评价精修结构参数的可靠性 ;特别指出 ,当把Rietveld法和Fourier过滤技术及径向分布函数 (radiald... 用Rietveld法对试样BaF2 的实测X射线衍射全谱图 (XDWP)数据进行精修 ,获得正确的结晶相结构参数 ,重点讨论了如何正确选择衍射峰型函数和评价精修结构参数的可靠性 ;特别指出 ,当把Rietveld法和Fourier过滤技术及径向分布函数 (radialdistributionfunction,RDF)联用来研究半结晶聚酯 (PET)的两相结构参数时 ,除需用R因子判断结晶相之精修结构参数的可靠性外 ,还要判断由非晶相散射强度数据计算的RDF是否合理 ;如果忽视后一判据 ,则有可能导致错误的计算结果。 展开更多
关键词 rietveld 半结晶聚酯 结构分析 应用 径向分布函数 X射线衍射全谱图 Fourier过滤技术
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Rietveld全图拟合法定量分析伊利石矿的精确度及误差来源 被引量:4
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作者 陈爱清 张立雪 +3 位作者 李强 朱建喜 李尚颖 何宏平 《岩矿测试》 CSCD 北大核心 2022年第2期291-299,共9页
伊利石是一种重要的矿产资源,准确获得矿石中矿物组成和含量具有重要的理论和实际意义。Rietveld全图拟合法采用整个衍射图进行分析,具有较高的准确度。然而由于缺少纯的伊利石样品,目前对于该方法在分析伊利石矿样的精确度和误差来源... 伊利石是一种重要的矿产资源,准确获得矿石中矿物组成和含量具有重要的理论和实际意义。Rietveld全图拟合法采用整个衍射图进行分析,具有较高的准确度。然而由于缺少纯的伊利石样品,目前对于该方法在分析伊利石矿样的精确度和误差来源尚不清楚。本文采用Rietveld全图拟合法对人工配制和天然的伊利石典型矿样进行了分析和计算,并与X射线荧光光谱(XRF)分析结果进行了对比,探讨了该方法的精确度及产生误差的因素。结果表明:人工配制的伊利石-石英二元混合物绝对误差范围为-0.9%~0.9%;伊利石-石英-钠长石三元混合物绝对误差范围为-1.9%~1.6%;伊利石-石英-钠长石-方解石-高岭石多元混合物绝对误差范围-2.3%~1.6%。天然伊利石矿样的Rietveld定量结果与XRF分析结果具有很好的一致性。表明该方法在分析伊利石矿样中具有较高的精确度,误差来源主要受伊利石结构模型、各物相中原子热振动参数U;取值合理性,以及择优取向等因素的影响。因此,在实际分析伊利石矿样时,建议根据实际情况选择合理的矿物结构模型,原子热振动U;取值应参考文献进行合理设定,制备试样应尽量减弱择优取向。 展开更多
关键词 伊利石 rietveld全图拟合法 精确度 误差来源 X射线衍射法 结构精修
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采用Rietveld精修,谢乐公式以及Williamson-Hall法分析不同煅烧温度TiO_(2)的晶粒尺寸 被引量:10
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作者 刘娟丽 吴蓉 +3 位作者 祖一丹 肖家逊 张斌 邹函君 《化工管理》 2023年第13期151-155,共5页
二氧化钛(TiO_(2))具有无毒、成本低、光氧化能力强、物理化学稳定性好等特性,目前被认为是最有前途的半导体材料之一。文章采用了简便的水热法合成了TiO_(2)纳米颗粒,并经过不同的煅烧温度处理得到目标样品,采用XRD、TEM等测试及粒径... 二氧化钛(TiO_(2))具有无毒、成本低、光氧化能力强、物理化学稳定性好等特性,目前被认为是最有前途的半导体材料之一。文章采用了简便的水热法合成了TiO_(2)纳米颗粒,并经过不同的煅烧温度处理得到目标样品,采用XRD、TEM等测试及粒径分布统计对样品进行了表征。分析结果表明煅烧温度对TiO_(2)物相的组成、结晶性和晶粒尺寸有重要的影响。同时,比较Rietveld精修、传统的谢乐公式和W-H方法对TiO_(2)的平均晶粒尺寸分析,结果表明这三种方法得到TiO_(2)的晶粒尺寸大小比较符合,且随着煅烧温度的升高而增大。通过TEM进一步验证了随温度的升高,TiO_(2)的晶粒尺寸和形貌也呈规律性变化。 展开更多
关键词 X射线衍射 rietveld精修 谢乐公式 W-H法
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Method for Measuring Residual Stresses Induced by Boring in Internal Surface of Tube and Its Validation with XRD Method 被引量:13
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作者 孟龙晖 何宁 +2 位作者 杨吟飞 赵威 戎斌 《Transactions of Nanjing University of Aeronautics and Astronautics》 EI 2014年第5期508-514,共7页
Residual stresses can have a strong effect on the usability of machined parts,and the X-ray diffraction(XRD)measuring equipment,which is commonly used to measure residual stresses,is very expensive.This paper presents... Residual stresses can have a strong effect on the usability of machined parts,and the X-ray diffraction(XRD)measuring equipment,which is commonly used to measure residual stresses,is very expensive.This paper presents a method of measuring the residual stresses induced by boring in the internal surface of a tube with much cheaper equipment.The method,called the strain-based method is mainly based on the strains measured on the external surface of the tube.It is proposed on the basis of the very long tube assumption.The finite element method(FEM)analysis is thus used to validate the length of the tube.Guided by the FEM results,an appropriate length of the tube is chosen,and the residual stresses are obtained from both the strain-based method and the XRD method.Stress profiles obtained from both two methods are compared.The comparison result indicates that the profiles of the two methods agree well with each other.Therefore,it can be concluded that the accuracy of the strain-based method is high enough,and it can be applied to residual stress measurement in practice. 展开更多
关键词 residual stress finite element method(FEM) strain element birth and death x-ray diffraction (XRD)
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