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Materials Data on W2O7 by Materials Project

W2O7 crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. W is bonded in a distorted body-centered cubic geometry to eight O atoms. There are six shorter (2.01 Å) and two longer (2.21 Å) W–O bond lengths. There are two inequivalent O sites. In the first O site, O is bonded in a bent 120 degrees geometry to two equivalent W atoms. In the second O site, O is bonded to four equivalent W atoms to form corner-sharing OW4 tetrahedra.

36 MATERIALS SCIENCE↗

Materials Data on BaP4(W2O7)8 by Materials Project

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

36 MATERIALS SCIENCE↗

Materials Data on W2O7 by Materials Project

(WO3)4O2 crystallizes in the cubic Fd-3m space group. The structure is three-dimensional and consists of eight water molecules and one WO3 framework. In the WO3 framework, W is bonded to six equivalent O atoms to form corner-sharing WO6 octahedra. The corner-sharing octahedral tilt angles are 37°. All W–O bond lengths are 1.94 Å. O is bonded in a bent 150 degrees geometry to two equivalent W atoms.

36 MATERIALS SCIENCE↗

Materials Data on P(W2O7)2 by Materials Project

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

36 MATERIALS SCIENCE↗