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An Introduction to Neutron Scattering - Spallation Neutron Source

An Introduction to Neutron Scattering - Spallation Neutron Source

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Working<br />

⎛ dσ<br />

⎞<br />

⎜ ⎟<br />

⎝ dΩ<br />

⎠<br />

and W<br />

is<br />

Bragg <strong>Scattering</strong> from Crystals<br />

through the<br />

( 2π<br />

)<br />

V<br />

where the unit - cell structure fac<strong>to</strong>r<br />

r<br />

r r<br />

iQ.<br />

d −Wd<br />

F ( Q)<br />

= b e e<br />

hkl<br />

Bragg<br />

d<br />

=<br />

∑<br />

d<br />

N<br />

d<br />

0<br />

the Debye - Waller<br />

3<br />

math (see, for example, Squires' book), we find :<br />

r r<br />

δ ( Q − G ) F<br />

r 2<br />

( Q)<br />

∑<br />

hkl<br />

hkl<br />

is<br />

hkl<br />

fac<strong>to</strong>r that<br />

given<br />

accounts<br />

for thermal<br />

motions<br />

a<strong>to</strong>ms<br />

• Using either single crystals or powders, neutron diffraction can be used <strong>to</strong><br />

measure F 2 (which is proportional <strong>to</strong> the intensity of a Bragg peak) for<br />

various values of (hkl).<br />

• Direct Fourier inversion of diffraction data <strong>to</strong> yield crystal structures is not<br />

possible because we only measure the magnitude of F, and not its phase =><br />

models must be fit <strong>to</strong> the data<br />

• <strong>Neutron</strong> powder diffraction has been particularly successful at determining<br />

structures of new materials, e.g. high T c materials<br />

by<br />

of

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