A Peierls transition is a lattice distortion coupled to a gap in an initially partly filled quasi-one-dimensional electronic band. A modulation at couples the opposite Fermi points. At half filling with one orbital per atom, it doubles the cell and alternates strong and weak bonds; the dimerized tight-binding chain shows explicitly how the gap opens at the Fermi energy. In the ideal weak-coupling zero-temperature model, the Peierls energy gain has a negative term proportional to , which can outweigh a positive quadratic elastic cost.
Observation should connect electronic and structural evidence: cooling through the transition can reduce conductivity as the gap develops, while diffraction satellites identify the ordering wavevector. A softened phonon near tests the precursor electron-lattice coupling. In inelastic neutron scattering of TTF-TCNQ, measurements from to found an increasing Kohn anomaly near as the transition was approached. Those particular measurements were above the transition, so they probe the precursor dynamics rather than a static low-temperature diffraction pattern.[ref]
Phonon dispersion and Kohn anomaly in TTF-TCNQ by Gen Shirane and others. Abstract: temperature interval and wavevector-dependent anomaly
A real finite-temperature transition also depends on interchain coupling and fluctuations. The ideal one-dimensional energy argument by itself does not prove finite-temperature long-range order.
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