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DOE OSTI · 1267451

Materials Data on HoBi2IO4 by Materials Project

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Abstract

HoBi2O4I is alpha bismuth trifluoride-derived structured and crystallizes in the tetragonal P4/mmm space group. The structure is three-dimensional. Ho3+ is bonded in a body-centered cubic geometry to eight equivalent O2- atoms. All Ho–O bond lengths are 2.40 Å. Bi3+ is bonded in a 4-coordinate geometry to four equivalent O2- and four equivalent I1- atoms. All Bi–O bond lengths are 2.26 Å. All Bi–I bond lengths are 3.65 Å. O2- is bonded to two equivalent Ho3+ and two equivalent Bi3+ atoms to form a mixture of edge and corner-sharing OHo2Bi2 tetrahedra. I1- is bonded in a distorted body-centered cubic geometry to eight equivalent Bi3+ atoms.

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36 MATERIALS SCIENCEBi-Ho-I-Ocrystal structureHoBi2IO4

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2020-07-16. Materials Data on HoBi2IO4 by Materials Project. https://doi.org/10.17188/1267451

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