Harmonic chain 2026-10-20
A uniform harmonic chain couples neighbouring displacements by quadratic spring energies. With periodic boundaries and spacing , a Fourier transform gives . Quantization makes each nonzero normal mode a phonon. The zero-frequency uniform displacement is a free centre-of-mass coordinate unless pinned, not an ordinary oscillator.[ref]
A periodic harmonic chain with masses , spacing and nearest-neighbour spring constant has
Hamilton's equations give . The discrete Fourier transform , , with in one Brillouin zone, diagonalizes the quadratic form:
The harmonic-chain normal-mode reality condition means , not that and are independent real coordinates. For canonical quantization, impose , equivalently . For set
Then the quantum harmonic chain is a set of independent phonon oscillators:
The centre-of-mass zero mode of a harmonic chain is the free coordinate , with ; it cannot be normalized by dividing by . Retaining it gives
with the corresponding momentum expansion and uniform term . The nonzero modes alone give the site commutator ; the uniform term supplies the missing . Each oscillator occupation is a nonnegative integer, and adding one phonon costs and crystal momentum modulo a reciprocal-lattice vector. [ref]
In the continuum limit of a harmonic chain, , and
The wave equation and linear low- dispersion relation follow. The lattice gives an ultraviolet cutoff; the acoustic approximation does not reproduce the zone-edge flattening.
With the centre of mass fixed, the oscillator partition function and Bose-Einstein distribution are
For a long chain, above its finite-size level spacing and below the zone-edge scale, integrating the two acoustic propagation directions gives . At high temperature each retained oscillator instead contributes to the heat capacity.
Figure 1.
Original monatomic-chain mode sketch and its acoustic lattice dispersion
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Take a uniform nearest-neighbour harmonic chain with displacement , conjugate momentum , mass , spring stiffness , lattice spacing and periodic length . These specify a standard model for the requested notes, not additional numerical exam data. Its Lagrangian and Hamiltonian are
Variation gives . For a mode , periodicity requires and
The lattice makes periodic modulo , so choose one Brillouin zone. At long wavelength , where is the sound speed. The continuum limit of a harmonic chain expands and replaces by . Defining mass density and one-dimensional elastic coefficient gives
The momentum density is , and the Hamiltonian density is . Translational invariance of makes total momentum conserved. The continuum approximation describes acoustic wavelengths large compared with ; it is not a justification for extending the lattice dispersion and zero-point sums to arbitrarily large wavevector.[ref]
canonical quantization promotes the coordinates and momenta to operators with and the other equal-time commutators zero. In the continuum, . The nonzero normal modes can be represented by independent phonon operators obeying . A useful lattice expansion is
where is the centre-of-mass displacement. The corresponding momentum is
Including the centre-of-mass term restores the full site commutator: the nonzero-mode sum alone gives . Substitution diagonalizes the Hamiltonian,
A phonon is one quantum of a collective normal mode, carrying energy and lattice momentum modulo a reciprocal-lattice vector. Reality of relates its Fourier coordinates by ; it does not remove the independent oppositely travelling phonon modes. Using one complete Brillouin zone avoids double-counting real standing-wave coordinates.[ref]
The free centre of mass has no restoring force and must not be treated as an oscillator of zero frequency. Fixing it, weakly pinning it, or specifying a finite centre-of-mass volume defines the corresponding zero-mode factor. With a fixed centre of mass, the internal thermal partition function and occupations are
The internal energy is ; its high-temperature heat capacity approaches . For a large one-dimensional chain at temperatures below the lattice cutoff but above its finite-size mode spacing,
This one-dimensional acoustic phonon heat capacity shows that quantization turns classical normal waves into bosonic excitations with a linear low-temperature heat capacity in one dimension. The Euclidean field action is Gaussian, with periodic imaginary-time boundary conditions; its Fourier modes reproduce these oscillators. Absolute displacement correlations require the zero-mode convention, and the lattice regulates short-distance fluctuations.