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Materials Data on Er2Te4O11 by Materials Project

Er2Te4O11 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. Er3+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Er–O bond distances ranging from 2.24–2.57 Å. There are two inequivalent Te4+ sites. In the first Te4+ site, Te4+ is bonded in a 3-coordinate geometry to four O2- atoms. There are a spread of Te–O bond distances ranging from 1.90–2.55 Å. In the second Te4+ site, Te4+ is bonded in a distorted see-saw-like geometry to four O2- atoms. There are a spread of Te–O bond distances ranging from 1.87–2.31 Å. There are six inequivalent O2- sites. In the first O2- site, O2- is bonded in a bent 150 degrees geometry to two equivalent Te4+ atoms. In the second O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Er3+ and two Te4+ atoms. In the third O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one Er3+ and one Te4+ atom. In the fourth O2- site, O2- is bonded in a 3-coordinate geometry to one Er3+ and two Te4+ atoms. In the fifth O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent Er3+ and one Te4+ atom. In the sixth O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent Er3+ and one Te4+ atom.

36 MATERIALS SCIENCE↗

Materials Data on Er2TeO2 by Materials Project

Er2TeO2 crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Er3+ is bonded in a 4-coordinate geometry to three equivalent Te2- and four equivalent O2- atoms. All Er–Te bond lengths are 3.14 Å. There are one shorter (2.26 Å) and three longer (2.31 Å) Er–O bond lengths. Te2- is bonded in a 6-coordinate geometry to six equivalent Er3+ atoms. O2- is bonded to four equivalent Er3+ atoms to form a mixture of edge and corner-sharing OEr4 tetrahedra.

36 MATERIALS SCIENCE↗

Materials Data on Er2TeO2 by Materials Project

Er2TeO2 crystallizes in the trigonal P-3m1 space group. The structure is three-dimensional. Er3+ is bonded in a 4-coordinate geometry to three equivalent Te2- and four equivalent O2- atoms. All Er–Te bond lengths are 3.14 Å. There are one shorter (2.26 Å) and three longer (2.30 Å) Er–O bond lengths. Te2- is bonded in a 12-coordinate geometry to six equivalent Er3+ atoms. O2- is bonded to four equivalent Er3+ atoms to form a mixture of edge and corner-sharing OEr4 tetrahedra.

36 MATERIALS SCIENCE↗

Materials Data on Er2TeO6 by Materials Project

Er2TeO6 is Hydrophilite-derived structured and crystallizes in the tetragonal P4_2/mnm space group. The structure is three-dimensional. Er3+ is bonded to six O2- atoms to form ErO6 octahedra that share corners with four equivalent ErO6 octahedra, corners with four equivalent TeO6 octahedra, an edgeedge with one ErO6 octahedra, and an edgeedge with one TeO6 octahedra. The corner-sharing octahedra tilt angles range from 44–60°. There are a spread of Er–O bond distances ranging from 2.23–2.28 Å. Te6+ is bonded to six O2- atoms to form TeO6 octahedra that share corners with eight equivalent ErO6 octahedra and edges with two equivalent ErO6 octahedra. The corner-sharing octahedra tilt angles range from 44–47°. All Te–O bond lengths are 1.96 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted T-shaped geometry to two equivalent Er3+ and one Te6+ atom. In the second O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent Er3+ and one Te6+ atom.

36 MATERIALS SCIENCE↗