[X射线-物相XRD-PDF4学习资料]-17：Quantitative Analysis RIR.pptxVIP

Quantitative AnalysisReference Intensity Ratio (RI Reference Intensity Ratio (RWhat is it?The Reference Intensity Ratio (RIR) is a method used for Quantitative Analysis by Powder Diffraction.The RIR method is based upon scaling all diffraction data to the diffraction of standard reference materials. Reference Intensity Ratio (RIWhy?The intensity of a diffraction peak profile is a convolution of many factors, only one of which is the concentration of the analyte (species being measured).By using the RIR method, ratios scaled to a commonreference, are used in the experiment. The assumption is thatall the factors, except concentration, of the analyte are ratioed and reduced to a constant.By using ratios and measuring peak areas, the RIR method can be used to determine concentrations. Reference Intensity Ratio (RIHow ?The RIR method scales all diffraction data to a standard. By convention, corundum is used as the international reference and the scale factor is defined by:Intensity Analyte / IntensityCorundum = I / IcI/Ic can be experimentally derived by adding a known weight fraction of corundum to a pure specimen of the analyte of interest.I/Ic can also be calculated if the atomic parameters of analyte are known because the atomic parameters of corundum havebeen determined.In PDF-4+, I/Ic has been experimentally determined for close to 10,000 materials and has been calculated for 170,000 materials. Overview of the MethodTo understand how to use I/Ic values for quantitative analysis with the PDF-4+ database, a short description of the method is provided in the following slides.RIRMethod Reference Intensity Ratio (RIWhat? RIR, as used in the Powder Diffraction File, is I/ (reference to corundum). I/Ic can be determined, experimentally or calcula from a crystal structure, both methods are used in PDF‐4+ database.Experimentally, I/Ic can be determined by takingthe ratio of the strongest line of the pattern to t intensity of the strongest line of corundum in a 5 weight mixt