paper

The Stability of the Peierls Instability for Ring-Shaped Molecules

arXiv:cond-mat/9410100 · doi:10.1103/PhysRevB.51.4777

Abstract

We investigate the conventional tight-binding model of -electrons on a ring-shaped mol\-e\-cule of atoms with nearest neighbor hopping. The hopping amplitudes, , depend on the atomic spacings, , with an associated distortion energy . A Hubbard type on-site interaction as well as nearest-neighbor repulsive potentials can also be included. We prove that when the minimum energy occurs either for equal spacing or for alternating spacings (dimerization); nothing more chaotic can occur. In particular this statement is true for the Peierls-Hubbard Hamiltonian which is the case of linear and quadratic , i.e., and , but our results hold for any choice of couplings or functions and . When we prove that more chaotic minima {\it can\/} occur, as we show in an explicit example, but the alternating state is always asymptotically exact in the limit . Our analysis suggests three interesting conjectures about how dimerization stabilizes for large systems. We also treat the spin-Peierls problem and prove that nothing more chaotic than dimerization occurs for {\it and\/} .

32 pages, Plain TeX, 3 figures appended as postscript files, EHLBN26/June/94

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