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SIMPLE QUANTIFICATION OF COMPOSITION OF MINERAL

机译:矿物成分的简单定量

摘要

PURPOSE:To expedite a quantitative analysis by a method wherein crystallochemical data and a peak profile of each mineral subjected to a qualitative analysis beforehand are field in a storage device and a comparison is made on a display with a peak profile obtained from strength data of an unknown sample. CONSTITUTION:A theoretical strength is computed by using the lattice constant, atomic coordinates and an atomic scattering factor of minerals of various kinds and the like, and it is inputted beforehand to a storage device of a microcomputer or the like. Next, based on the results of a qualitative analysis by an X-ray diffraction method, a necessary crystal file is called, a parameter shaped in a peak is determined automatically so that it coincides with a half-width of a measured peak profile, and the peak profile is computed. Then, the parameter of an item DELTAV of a volume is varied so that the computed peak profile and the measured peak profile be coincident on a computer screen, the determined DELTAV is multiplied by the specific gravity of each mineral, and the results of quantification are outputted onto the screen.
机译:目的:通过一种方法进行定量分析,其中事先将晶体化学数据和每种要进行定性分析的矿物的峰轮廓存储在存储设备中,然后在显示器上进行比较,该峰轮廓是根据样品的强度数据获得的未知样本。组成:理论强度是通过使用各种矿物等的晶格常数,原子坐标和原子散射因子来计算的,并且预先输入到微型计算机等的存储设备中。接下来,基于通过X射线衍射法进行的定性分析的结果,调用必要的晶体文件,自动确定在峰中成形的参数,以使其与测得的峰轮廓的半峰宽一致,并且计算峰轮廓。然后,改变体积的商品DELTAV的参数,以使计算的峰轮廓和测得的峰轮廓在计算机屏幕上重合,将确定的DELTAV乘以每种矿物的比重,定量结果为输出到屏幕上。

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