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Title: Materials Data on Tl2(SbO3)3 by Materials Project

Abstract

Tl2(SbO3)3 crystallizes in the cubic Pn-3 space group. The structure is three-dimensional. Tl is bonded in a 6-coordinate geometry to six O atoms. There are three shorter (2.70 Å) and three longer (2.86 Å) Tl–O bond lengths. Sb is bonded to six O atoms to form a mixture of edge and corner-sharing SbO6 octahedra. The corner-sharing octahedral tilt angles are 53°. There are a spread of Sb–O bond distances ranging from 1.99–2.04 Å. There are two inequivalent O sites. In the first O site, O is bonded in a water-like geometry to two equivalent Tl and two equivalent Sb atoms. In the second O site, O is bonded in a distorted trigonal planar geometry to one Tl and two equivalent Sb atoms.

Authors:
Publication Date:
Other Number(s):
mp-30059
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Research Org.:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Collaborations:
MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; Tl2(SbO3)3; O-Sb-Tl
OSTI Identifier:
1204486
DOI:
https://doi.org/10.17188/1204486

Citation Formats

The Materials Project. Materials Data on Tl2(SbO3)3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1204486.
The Materials Project. Materials Data on Tl2(SbO3)3 by Materials Project. United States. doi:https://doi.org/10.17188/1204486
The Materials Project. 2020. "Materials Data on Tl2(SbO3)3 by Materials Project". United States. doi:https://doi.org/10.17188/1204486. https://www.osti.gov/servlets/purl/1204486. Pub date:Thu Apr 30 00:00:00 EDT 2020
@article{osti_1204486,
title = {Materials Data on Tl2(SbO3)3 by Materials Project},
author = {The Materials Project},
abstractNote = {Tl2(SbO3)3 crystallizes in the cubic Pn-3 space group. The structure is three-dimensional. Tl is bonded in a 6-coordinate geometry to six O atoms. There are three shorter (2.70 Å) and three longer (2.86 Å) Tl–O bond lengths. Sb is bonded to six O atoms to form a mixture of edge and corner-sharing SbO6 octahedra. The corner-sharing octahedral tilt angles are 53°. There are a spread of Sb–O bond distances ranging from 1.99–2.04 Å. There are two inequivalent O sites. In the first O site, O is bonded in a water-like geometry to two equivalent Tl and two equivalent Sb atoms. In the second O site, O is bonded in a distorted trigonal planar geometry to one Tl and two equivalent Sb atoms.},
doi = {10.17188/1204486},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}