A very simple picture of a vibrating atom in a crystal treats it as a classical…
PHYSICS · Multi-part · Fermi University Physics · Condensed Matter, Materials & Soft Matter · Lattice dynamics and thermal properties of solids · Lattice dynamics and thermal properties of solids
Solid State Physics, Ch Anharmonicity: expansion, phonon lifetimes and thermal conductivity
Problem
A very simple picture of a vibrating atom in a crystal treats it as a classical particle with one coordinate x, its displacement from its equilibrium separation from a neighbour, moving in a potential V(x)=21Kx2, with K>0 a spring constant and no term beyond quadratic order (a strictly harmonic crystal).
((a)) Using the classical Boltzmann weight p(x)∝e−V(x)/kBT, show that the thermal average displacement ⟨x⟩ is exactly zero at every temperature T>0, so this strictly harmonic model predicts no thermal expansion at all.
((b)) In the full three-dimensional harmonic crystal the normal-mode occupation numbers nqs are constants of the motion: no term in the harmonic Hamiltonian couples one mode to another. State what this implies for the phonon lifetime τ and mean free path ℓ=vτ (with v a group speed), and use the kinetic formula κ=31Cvℓ (with C the heat capacity per unit volume) to show that the thermal conductivity of a strictly harmonic crystal is infinite.