Search results for "Zircon oxides"

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High-pressure polymorphs of TbVO4: A Raman and ab initio study

2013

Raman measurements on TbVO4 show the occurrence of three pressure-induced phase transitions. The first one, an irreversible transition from the zircon to the scheelite structure, occurs beyond 6.7 GPa. In addition, two reversible transformations take place at 26.7 and 34.4 GPa. The last transition was never reported before. The experimental findings are supported by structural and lattice-dynamics calculations that helped us to identify the post-scheelite phase as a monoclinic fergusonite structure. According to the calculations, the third transition involves a symmetry increase. An orthorhombic structure is proposed for the phase found above 34.4 GPa. The results have been compared with pr…

Phase transitionEquation of stateChemistryMechanical EngineeringMetals and AlloysAb initioFergusoniteCrystallographysymbols.namesakeMechanics of MaterialsAb initio quantum chemistry methodsPhase (matter)FISICA APLICADARaman spectroscopyMaterials ChemistrysymbolsOrthorhombic crystal systemAb initio calculationsPressure-driven transitionsRaman spectroscopyZircon oxidesMonoclinic crystal system
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