Solution

ID: past-exam-of-the-condensed-matter-physics-course-of-the-university-of-oxford/2015/2/a/solution

The structure factor is the coherent scattering amplitude of the contents of a unit cell at a specified momentum transfer. Contributions from its atoms add with phases fixed by their positions. At a reciprocal lattice vector indexed by Miller indices, the crystal basis structure factor is
Changing every phase sign conjugates the amplitude for real scattering factors and leaves the intensity unchanged. The positions here are fractions of the chosen cell edges. An atomic basis of a crystal should not be confused with a set of primitive translation vectors.
In kinematic elastic scattering the diffraction intensity of a Bragg reflection is proportional to , after including geometrical, polarization, thermal-displacement and experimental factors. Powder integrated intensities also include multiplicity. The many-cell interference factor selects reciprocal-lattice vectors satisfying the diffraction geometry; the unit-cell factor determines their relative amplitudes and additional extinctions. Ring positions determine spacings through Bragg's law, while intensity patterns and systematic absences constrain lattice centering and atomic arrangements. Intensity loses the overall complex phase, so structure determination is not a direct measurement of every individual atomic phase.
X-rays scatter from electron density, giving an atomic factor that changes with momentum transfer and chemical charge distribution. Neutrons scatter coherently from nuclei with bound coherent scattering lengths, which need not track atomic number; magnetic neutron scattering is an additional channel in magnetic materials. Their different elemental/isotopic contrasts make the two probes complementary.

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