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Taylor and Francis Group, High Pressure Research, 4(29), p. 573-577

DOI: 10.1080/08957950903474635

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Ab initiostudy of the high-pressure phases and dynamical properties of ZnAl2O4and ZnGa2O4

Journal article published in 2009 by S. López-Moreno, A. H. Romero, P. Rodríguez-Hernández ORCID, A. Muñoz
This paper was not found in any repository, but could be made available legally by the author.
This paper was not found in any repository, but could be made available legally by the author.

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Abstract

In this paper, we report ab initio calculations of the vibrational and structural properties of ZnAl2O4 and ZnGa2O4 spinel structures. The calculated vibrational modes at zero pressure, at the Γ point and the complete phonon spectrum of both compounds are presented. Also, we report our findings for the high-pressure structure