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The quantum paraelectric behavior of SrTiO3 revisited: relevance of the structural phase transition temperature

Manuel I. Marques, Carmen Arago, Julio A. Gonzalo

cond-mat.mtrl-sciarXiv:cond-mat/0603354

Abstract

It has been known for a long time that the low temperature behavior shown by the dielectric constant of quantum paraelectric SrTiO3 can not be fitted properly by Barrett's formula using a single zero point energy or saturation temperature (T1). As it was originally shown [K. A. Müller and H. Burkard, Phys. Rev. B 19, 3593 (1979)] a crossover between two different saturation temperatures (T1l=77.8K and T1h=80K) at T10K is needed to explain the low and high temperature behavior of the dielectric constant. However, the physical reason for the crossover between these two particular values of the saturation temperature at T10K is unknown. In this work we show that the crossover between these two values of the saturation temperature at T10K can be taken as a direct consequence of (i) the quantum distribution of frequencies g(Ω)Ω2 associated with the complete set of low-lying modes and (ii) the existence of a definite maximum phonon frequency given by the structural transition critical temperature Ttr.

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