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3.5. DIFFRACTION CONDITIONS AND BRILLOUIN ZONES 45<br />
Figure 3.8:<br />
Illustration <strong>of</strong> Bragg scattering from a crystal<br />
Define the scattered wavevector<br />
and the momentum transfer<br />
we then have for the waveform<br />
k = k o<br />
r<br />
r<br />
(3.13)<br />
q = k o − k (3.14)<br />
[<br />
]<br />
ψ ∝ e iko·r eiq·R<br />
1 + cf(ˆr)<br />
r<br />
. (3.15)<br />
Now sum over all the identical sites in the lattice, and the final formula is<br />
[<br />
ψ ∝ e iko·r 1 + c ∑ ]<br />
eiq·R i<br />
f i (ˆr) . (3.16)<br />
r<br />
i<br />
Away from the forward scattering direction, the incoming beam does not contribute, and<br />
we need only look at the summation term. We are adding together terms with different phases<br />
q · R i , and these will lead to a cancellation unless the Bragg condition is satisfied<br />
q · R = 2πm (3.17)<br />
for all R in the lattice, and with m an integer (that depends on R). The special values <strong>of</strong> q ≡ G<br />
that satisfy this requirement lie on a lattice, which is called the reciprocal lattice. 4<br />
One can check that the following prescription for the reciprocal lattice will satisfy the Bragg<br />
condition. The primitive vectors b i <strong>of</strong> the reciprocal lattice are given by<br />
b 1 = 2π a 2 ∧ a 3<br />
a 1 · a 2 ∧ a 3<br />
and cyclic permutations . (3.18)<br />
3.5 Diffraction conditions and Brillouin zones<br />
For elastic scattering, there are two conditions relating incident and outgoing momenta. Conservation<br />
<strong>of</strong> energy requires that the magnitudes <strong>of</strong> k o and k are equal, and the Bragg condition<br />
requires their difference to be a reciprocal lattice vector k − k o = G. The combination <strong>of</strong> the<br />
two can be rewritten as<br />
k · G<br />
2 = (G 2 )2 . (3.19)<br />
4 We can be sure that they are on a lattice, because if we have found any two vectors that satisfy (3.17), then<br />
their sum also satisfies the Bragg condition.