Quasi-hydrostatic X-ray powder diffraction study of the low- and high-pressure phases of CaWO4 up to 28 GPa

Abstract

We have studied CaWO4 under compression using Ne as pressure-transmitting medium at room temperature by means of synchrotron X-ray powder diffraction. We have found that CaWO4 beyond 8.8 GPa transforms from its low-pressure tetragonal structure (scheelite) into a monoclinic structure (fergusonite). The high-pressure phase remains stable up to 28 GPa and the low-pressure phase is totally recovered after full decompression. The pressure dependence of the unit-cell parameters, as well as the pressure volume equation of state, has been determined for both phases. Compared with previous studies, we found in our quasi-hydrostatic experiments a different behavior for the unit-cell parameters of the fergusonite phase and a different transition pressure. These facts suggest that deviatoric stresses influence on the high-pressure structural behavior of CaWO4 as previously found in related compounds. The reported experiments also provide information on the pressure dependence of interatomic bond distances, shedding light on the transition mechanisms. (C) 2014 Elsevier Masson SAS. All rights reserved.