New high-pressure phase and equation of state of Ce2Zr2O8

In this paper we report a new high-pressure rhombohedral phase of Ce2Zr2O8 observed in high-pressure angle-dispersive x-ray diffraction and Raman spectroscopy studies up to nearly 12 GPa. The ambient-pressure cubic phase of Ce2Zr2O8 transforms to a rhombohedral structure beyond 5 GPa with a feeble d...

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Detalles Bibliográficos
Autores: Errandonea, Daniel, Kumar, R.S., Achary, S.N., Shukla, R., Tyagi, A.K., Gomis, O.|||0000-0001-6763-0638, Manjón, Francisco-Javier|||0000-0002-3926-1705
Tipo de recurso: artículo
Fecha de publicación:2012
País:España
Institución:Universitat Politècnica de València (UPV)
Repositorio:RiuNet. Repositorio Institucional de la Universitat Politécnica de Valéncia
Idioma:inglés
OAI Identifier:oai:riunet.upv.es:10251/35868
Acceso en línea:https://riunet.upv.es/handle/10251/35868
Access Level:acceso abierto
Palabra clave:high pressure
Crystal structure
x-ray diffraction
powders
fluorite
raman spectra
phase transitions
Oxidation
Equations of state
rietveld refinement
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Descripción
Sumario:In this paper we report a new high-pressure rhombohedral phase of Ce2Zr2O8 observed in high-pressure angle-dispersive x-ray diffraction and Raman spectroscopy studies up to nearly 12 GPa. The ambient-pressure cubic phase of Ce2Zr2O8 transforms to a rhombohedral structure beyond 5 GPa with a feeble distortion in the lattice. The pressure evolution of the unit-cell volume showed a change in compressibility above 5 GPa. The unit-cell parameters of the high-pressure rhombohedral phase at 12.1 GPa are a h = 14.6791(3) Å, c h = 17.9421(5) Å, and V = 3348.1(1) Å3. The structure relations between the parent cubic (P213) and rhombohedral (P32) phases were obtained via group-subgroup relations. All the Raman modes of the cubic phase showed linear evolution with pressure, with the hardest one at 197 cm¿1. Some Raman modes of the high-pressure phase have a non-linear evolution with pressure, and softening of one low-frequency mode with pressure is found. The compressibility, equation of state, and pressure coefficients of Raman modes of Ce2Zr2O8 are also reported. © 2012 American Institute of Physics