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DOE OSTI · 1278914

Materials Data on YbBi2IO4 by Materials Project

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Abstract

YbBi2O4I is alpha bismuth trifluoride-derived structured and crystallizes in the tetragonal P4/mmm space group. The structure is three-dimensional. Yb3+ is bonded in a body-centered cubic geometry to eight equivalent O2- atoms. All Yb–O bond lengths are 2.42 Å. Bi3+ is bonded in a 4-coordinate geometry to four equivalent O2- and four equivalent I1- atoms. All Bi–O bond lengths are 2.22 Å. All Bi–I bond lengths are 3.71 Å. O2- is bonded to two equivalent Yb3+ and two equivalent Bi3+ atoms to form a mixture of corner and edge-sharing OYb2Bi2 tetrahedra. I1- is bonded in a distorted body-centered cubic geometry to eight equivalent Bi3+ atoms.

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36 MATERIALS SCIENCEBi-I-O-Ybcrystal structureYbBi2IO4

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2020-07-15. Materials Data on YbBi2IO4 by Materials Project. https://doi.org/10.17188/1278914

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