Abstract

Two-dimensional X-ray diffraction pattern can be described by the diffraction intensity distribution in both 2θ and γ directions. The 2D pattern can be reduced to two kinds of profiles: 2θ-profile and γ-profile. The 2θ-profile can be evaluated for phase identification, crystal structure refinement and many applications with many existing algorithms and software. The γ-profile contains information on texture, stress, and crystal grain size. This article introduces the concept and fundamental algorithms for stress, texture and crystal size analysis by γ-profile analysis.

Highlights

  • The diffracted x-rays from a polycrystalline sample form a series diffraction cone in 3D space since large numbers of crystals oriented randomly in the space are covered by the incident xray beam

  • Based on the effective diffraction volume and the crystallographic nature of the sample, in reflection mode diffraction, the crystal size is given by: d phkl b2 arcsin[cos θsin(∆γ where d is the average diameter of the crystallite, phkl is the multiplicity of the diffracting planes, b is the size of the incident beam, μ is the linear absorption coefficient and N s is the number of diffraction spots within the measured range ∆γ of the diffraction ring

  • Two-dimensional X-ray diffraction pattern can be described by the diffraction intensity distribution in both 2θ and γ directions

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Summary

Introduction

The diffracted x-rays from a polycrystalline (powder) sample form a series diffraction cone in 3D space since large numbers of crystals oriented randomly in the space are covered by the incident xray beam. Two-dimensional x-ray diffraction (abbreviated as XRD2) pattern from a polycrystalline solid or powder sample can be considered as a cross section of the detecting plane and the diffraction cones [1]. In order to evaluate the materials structure associated with the intensity distribution along γ angle, either the 2D diffraction pattern should be directly analyzed or the γ-profile generated by 2θ-integration should be used. The diffraction vector H and its unit vector hL in the laboratory coordinates are given by Advanced Materials Research Vol 996

H H hx hy
Conclusions
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