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Neutron Scattering

Neutron Scattering - JuSER - Forschungszentrum Jülich

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5 .1 Pole Figure Inversion<br />

The détermination of thé ODF f(g) from equation (5) is called pole figure inversion . Different<br />

mathematical procedures have been developed to calculate thé ODF from experimental pole<br />

figures . Depending on thé method, thé calculated ODF is a continuons or a step function . A<br />

widely applied method in texture analyses of high symmetry materials (metals) is thé seriesexpansion<br />

or harmonic method developed by H . J. Bunge [6] (compare chapter 3 .0) . Analogous<br />

to thé classical procedure in single crystal structure determination, thé ODF is expanded<br />

into its corresponding Fourier orthogonal series using surface spherical harmonic functions<br />

with coefficients C (see equation (2) . A similar expansion is performed with thé experimental<br />

pole densities P yielding thé coefficients F(hkl) . A system of linear equations and appropriate<br />

transformations of coefficients are used to détermine thé unknown coefficients C from thé<br />

experimentally known coefficients F . Routine computer programs are available to perform<br />

these calculations . The calculated coefficients C are those texture coefficients C which have<br />

been used in equation (3) to describe thé anisotropy of macroscopic physical properties of a<br />

texturized polycrystal .<br />

After thé ODF has been determined it is possible to calculate pole figures of all planes<br />

(hkl), also of those which have not been or cannot been measured, for instance, because of<br />

extinction. It is also useful to recalculate experimental pole figures from thé ODF in order to<br />

estimate or control thé reliability ofthé texture analysis performed .<br />

A different mathematical approach to thé ODF calculation is thé discretization method<br />

based on thé maximum entropy concept [7] using a finit series expansion into indicator<br />

functions . This method was introduced into thé program MENTEX by H . Schaeben [8] . The<br />

so-called WIMV-method [9] which is rather common in geological texture analysis is based<br />

on certain probability assumptions of f(g) which may then be further improved by itérative<br />

refnements .<br />

8c=o<br />

Fig . 18.19 :<br />

Representation ofa<br />

texture component g`<br />

by a Gaussian<br />

distribution function<br />

f(g) ofhafvidth b °. af<br />

denotes the déviation<br />

of crystalltie<br />

orientations from g°<br />

(atof - 09.<br />

n ° represents a sample<br />

fzxed axis (see [101)

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