High-pressure x-ray diffraction and Raman spectroscopic studies of the tetragonal spinel CoFe2O4

Zhongwu Wang, R. T. Downs, V. Pischedda, R. Shetty, S. K. Saxena, C. S. Zha, Y. S. Zhao, D. Schiferl, and A. Waskowska
Phys. Rev. B 68, 094101 – Published 2 September 2003
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Abstract

In situ x-ray diffraction and Raman spectroscopy have been carried out to pressures of 93.6 and 63.2 GPa, respectively, to explore the pressure-induced phase transformation of CoFe2O4 spinel. CoFe2O4 adopts a distorted tetragonal spinel structure at one atmosphere. At a pressure of ∼32.5 GPa, both x-ray diffraction and Raman spectroscopy indicate that CoFe2O4 transforms to the orthorhombic CaFe2O4 structure, which remains stable to at least 93.6 GPa. The bulk modulus (K0) of the tetragonal and the high-pressure polymorphs were calculated to be 94(12) and 145(16) GPa, respectively, with K4. Upon release of pressure the orthorhombic phase persists and appears to be structurally metastable. At zero pressure, laser induced heating leads to a significant transformation back to the tetragonal phase. The high-pressure orthorhombic phase at one atmosphere is 14.7% denser than the tetragonal phase.

  • Received 28 April 2003

DOI:https://doi.org/10.1103/PhysRevB.68.094101

©2003 American Physical Society

Authors & Affiliations

Zhongwu Wang1,2,*, R. T. Downs1,†, V. Pischedda1, R. Shetty1, S. K. Saxena1, C. S. Zha3, Y. S. Zhao2, D. Schiferl2, and A. Waskowska4

  • 1Center for Study of Matter at Extreme Conditions (CeSMEC), Florida International University, VH-150, University Park, Miami, Florida 33199, USA
  • 2LANSCE-12, MS-H805, Los Alamos National Laboratory, Los Alamos, New Mexico 87545, USA
  • 3Cornell High Energy Synchrotron Source (CHESS), Wilson Laboratory, Cornell University, Ithaca, New York 14853, USA
  • 4Institute of Low Temperature and Structure Research, Polish Academy of Sciences, P.O. Box 1410, 50-950 Wroclaw 2, Poland

  • *Fax: 505-665-2676. Email address: z_wang@lanl.gov
  • On leave from The Department of Geosciences, University of Arizona, Tucson, Arizona 85721-0077, USA.

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Vol. 68, Iss. 9 — 1 September 2003

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