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Introduction to XRPD Data Analysis

Introduction toX-Ray Powder DiffractionData AnalysisScott A Speakman, for Materials Science and Engineering at X-ray diffraction pattern is a plot of the intensity of X-rays scattered at different angles by a sample The detector moves in a circle around the sample The detector position is recorded as the angle 2theta (2 ) The detector records the number of X-rays observed at each angle 2 The X-ray intensity is usually recorded as counts or as counts per second To keep the X-ray beam properly focused, the sample will also rotate. On some instruments, the X-ray tube may rotate instead of the # of 20 Scott A Speakman, 2 2 2 2 X-ray tubesamplePosition [ 2 Theta] (Cu K-alpha)3540455055 Intensity (Counts)0500010000 Each phase produces a unique diffraction pattern A phase is a specific chemistry and atomic arrangement. Quartz, cristobalite, and glass are all different phases of SiO2 They are chemically identical, but the atoms are arranged differently.

Quantitative Analysis of XRD Data Slide ‹#› of 20 Scott A Speakman, Ph.D. ... • The unit cell dimensions can be correlated to interatomic distances • Anything the changes interatomic distances- temperature, subsitutional doping, stress- will be reflected by a change in peak positions Slide ‹#› of 20 Scott A Speakman, Ph.D.

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  Analysis, Data, Data analysis, Correlated

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