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101.
    
A new method for the quantitative phase analysis of multi‐component polycrystalline materials using the X‐ray powder diffraction technique is proposed. A formula for calculating weight fractions of individual crystalline phases has been derived from the intensity formula for powder diffraction in Bragg–Brentano geometry. The integrated intensity of a diffraction line is proportional to the volume fraction of a relevant crystalline phase in an irradiated sample, and the volume fraction, when it is multiplied with the chemical formula weight, can be related to the weight fraction. The structure‐factor‐related quantity in the intensity formula, when it is summed in an adequate 2θ range, can be replaced with the sum of squared numbers of electrons belonging to composing atoms in the chemical formula. Unit‐cell volumes and the number of chemical formula units are all cancelled out in the formula. Therefore, the formula requires only single‐measurement integrated intensity datasets for the individual phases and their chemical compositions. No standard reference material, reference intensity ratio or crystal structure parameter is required. A new procedure for partitioning the intensities of unresolved overlapped diffraction lines has also been proposed. It is an iterative procedure which starts from derived weight fractions, converts the weight fractions to volume fractions by utilizing additional information on material densities, and then partitions the intensities in proportion to the volume fractions. Use of the Pawley pattern decomposition method provides more accurate intensity datasets than the individual profile fitting technique, and it expands the applicability of the present method to more complex powder diffraction patterns. Test results using weighed mixture samples showed that the accuracy, evaluated by the root‐mean‐square error, is comparable to that obtained by Rietveld quantitative phase analysis.  相似文献   
102.
李慧  崔兰冲  章国磊  张萌萌  焦丽丽  吴巍 《色谱》2021,39(5):518-525
基于超高效液相色谱-串联质谱(UPLC-MS/MS)建立定量分析色氨酸(Trp)及代谢产物3-OH-犬尿氨酸(3-OH-Kyn)、3-OH-邻氨基苯甲酸(3-OH-AA)、黄尿酸(XA)、犬尿氨酸(Kyn)、5-羟基吲哚乙酸(5-HIAA)、犬尿喹啉酸(KA)和5-羟色胺(5-HT)的方法,应用该方法分析其在尿样中的含...  相似文献   
103.
This work presents a new science called atomic and molecular reaction statics (AMRS). There are four parts for AMRS, i.e. the group theoretical derivation of molecular electronic states, the principle of microscopic reversibility, the principle of microscopic transitivity and the optimum energy process rule. AMRS has been developed for about twenty years.  相似文献   
104.
非定常可压等熵流非线性方程显式解析解的推导   总被引:17,自引:5,他引:17  
本文对作者以前凭试凑、灵感、运气与经验得出的一系列非定常可压流动显式解析解,寻找线索,总结出其可能的推导途径,并以非定常可压等熵一维流为例,具体给出了四种新的求解方法。这些方法会对今后寻找工程热物理领域的非线性主控方程的解析解有所帮助。本文同时还给出了两个新的解析解。  相似文献   
105.
杨帅i  高守亭 《中国物理 B》2014,(11):704-709
For the potential vorticity (PV) invariant, there is a PV-based complete-form vorticity equation, which we use heuris- tically in the present paper to answer the following question: for the Ertel-Rossby invariant (ERI), is there a corresponding vorticity tendency equation? Such an ERI-based thermally-coupled vorticity equation is derived and discussed in detail in this study. From the obtained new vorticity equation, the vertical vorticity change is constrained by the vertical velocity term, the term associated with the slope of the generalized momentum surface, the term related to the horizontal vorticity change, and the baroclinic or solenoid term. It explicitly includes both the dynamical and thermodynamic factors' influence on the vorticity change. For the ERI itself, besides the traditional PV term, the ERI also includes the moisture factor, which is excluded in dry ERI, and the term related to the gradients of pressure, kinetic energy, and potential energy that reflects the fast-manifold property. Therefore, it is more complete to describe the fast motions off the slow manifold for severe weather than the PV term. These advantages are naturally handed on and inherited by the ERI-based thermally-coupled vorticity equation. Then the ERI-based thermally-coupled vorticity equation is further transformed and compared with the traditional vorticity equation. The main difference between the two equations is the term which describes the contribution of the solenoid term to the vertical vorticity development. In a barotropic flow, the solenoid term disappears, then the ERI-based thermally-coupled vorticity equation can regress to the traditional vorticity equation.  相似文献   
106.
An example is given of a model dynamics for which the Broadwell model of the Boltzmann equation seems to appear in the formal stage of the Boltzmann-Grad limit, but actually does not.  相似文献   
107.
Following Guin's approach to non-abelian cohomology [4] and, using the notion of a crossed bimodule, a second pointed set of cohomology is defined with coefficients in a crossed module, and Guin's six-term exact cohomology sequence is extended to a nine-term exact sequence of cohomology up to dimension 2  相似文献   
108.
从一般高斯型色噪声模型出发,通过泛函导数,应用小关联时间,近似计算多维色噪声,得到有效Fokker-Planck方程.将其应用到两相湍流中得到颗粒相的概率密度函数输运方程,从而得到颗粒相的二阶矩模型.将颗粒应力方程简化成代数方程,建立代数应力模型.将对流扩散方程的有限分析法运用到求解两相流模型中,对壁面两相射流进行数值模拟,并将求解结果与实验结果进行对比分析.  相似文献   
109.
110.
采用五氟苄基溴(PFBBr)衍生化和GC—MS分析方法对氟乙酰胺鼠药进行了检验,考察和优化了衍生化条件及分析参数等因素,线性范围为2.5~50μg/mL,相关系数r=0.9986,血液样品加标平均回收率为76.2%,测定结果的相对标;准偏差为3.07%。  相似文献   
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