Search results for "Hafnon"

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High-pressure structural study of the scheelite tungstatesCaWO4andSrWO4

2005

Angle-dispersive x-ray-diffraction and x-ray-absorption near-edge structure measurements have been performed on ${\mathrm{CaWO}}_{4}$ and ${\mathrm{SrWO}}_{4}$ up to pressures of approximately 20 GPa. Both materials display similar behavior in the range of pressures investigated in our experiments. As in the previously reported case of ${\mathrm{CaWO}}_{4}$, under hydrostatic conditions ${\mathrm{SrWO}}_{4}$ undergoes a pressure-induced scheelite-to-fergusonite transition around 10 GPa. Our experimental results are compared to those found in the literature and are further supported by ab initio total-energy calculations, from which we also predict the instability at larger pressures of the …

Bulk modulusCrystallographyMaterials scienceHafnonAb initio quantum chemistry methodsHydrostatic pressureX-ray crystallographySpace groupOrthorhombic crystal systemCondensed Matter PhysicsFergusonitePhysics::GeophysicsElectronic Optical and Magnetic MaterialsPhysical Review B
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