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A unified approach to the interpretation of displacive and order–disorder systems. I. Thermodynamical aspect

Aubry, S.·1975·The Journal of Chemical Physics

Abstract

Some properties of a linear chain of harmonically coupled double wells are studied by the technique of the transfer operator. Exact values for the chain specific heat, the displacement probability density, and the first six even moments of the dynamical displacement correlation function are obtained. The model is shown to be a prototype for displacive as well as for order–disorder transitions depending on the strength of the harmonic coupling. Criteria for the harmonic behavior of the system are derived. By this method, it was not possible to find the exact form of the dynamical correlation functions for very anharmonic cases; this is so in general for order–disorder systems, but also for a small wave vector and temperature region in displacive systems.

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Metadata

Authors
Aubry, S.
Venue
The Journal of Chemical Physics
Published
1975-04-15
Volume
62
Issue
8
Pages
3217-3229
ISSN
  • 0021-9606 (ISSN-L)
  • 1089-7690
OpenAlex
W2037512939
Cited by
261
References
0
FWCI
11.22
Type
journal article
Language
en
Open access
closed

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CoChat. (2026). Citation check: A unified approach to the interpretation of displacive and order–disorder systems. I. Thermodynamical aspect. https://app.cochat.ai/papers/10.1063/1.430872
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Aubry, S. (1975). A unified approach to the interpretation of displacive and order–disorder systems. I. Thermodynamical aspect. The Journal of Chemical Physics. https://doi.org/10.1063/1.430872

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