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Materials Data on Eu2HoTaO6 by Materials Project

HoEu2TaO6 is Orthorhombic Perovskite-derived structured and crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Ho3+ is bonded to six O2- atoms to form HoO6 octahedra that share corners with six equivalent TaO6 octahedra. The corner-sharing octahedra tilt angles range from 28–31°. There are a spread of Ho–O bond distances ranging from 2.24–2.26 Å. Eu2+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Eu–O bond distances ranging from 2.47–2.95 Å. Ta5+ is bonded to six O2- atoms to form TaO6 octahedra that share corners with six equivalent HoO6 octahedra. The corner-sharing octahedra tilt angles range from 28–31°. There are four shorter (2.02 Å) and two longer (2.03 Å) Ta–O bond lengths. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded to one Ho3+, two equivalent Eu2+, and one Ta5+ atom to form distorted corner-sharing OEu2HoTa tetrahedra. In the second O2- site, O2- is bonded in a 5-coordinate geometry to one Ho3+, three equivalent Eu2+, and one Ta5+ atom. In the third O2- site, O2- is bonded in a 5-coordinate geometry to one Ho3+, three equivalent Eu2+, and one Ta5+ atom.

36 MATERIALS SCIENCE↗

Materials Data on Eu2HoTaO6 by Materials Project

HoEu2TaO6 is (Cubic) Perovskite-derived structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ho3+ is bonded to six equivalent O2- atoms to form HoO6 octahedra that share corners with six equivalent TaO6 octahedra and faces with eight equivalent EuO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Ho–O bond lengths are 2.20 Å. Eu2+ is bonded to twelve equivalent O2- atoms to form EuO12 cuboctahedra that share corners with twelve equivalent EuO12 cuboctahedra, faces with six equivalent EuO12 cuboctahedra, faces with four equivalent HoO6 octahedra, and faces with four equivalent TaO6 octahedra. All Eu–O bond lengths are 2.97 Å. Ta5+ is bonded to six equivalent O2- atoms to form TaO6 octahedra that share corners with six equivalent HoO6 octahedra and faces with eight equivalent EuO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Ta–O bond lengths are 1.99 Å. O2- is bonded in a distorted linear geometry to one Ho3+, four equivalent Eu2+, and one Ta5+ atom.

36 MATERIALS SCIENCE↗