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Title: Materials Data on Sr11Sb10 by Materials Project

Abstract

Sr11Sb10 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are four inequivalent Sr2+ sites. In the first Sr2+ site, Sr2+ is bonded to seven Sb+2.20- atoms to form a mixture of distorted corner, edge, and face-sharing SrSb7 pentagonal bipyramids. There are a spread of Sr–Sb bond distances ranging from 3.33–3.74 Å. In the second Sr2+ site, Sr2+ is bonded to seven Sb+2.20- atoms to form a mixture of distorted corner, edge, and face-sharing SrSb7 pentagonal bipyramids. There are a spread of Sr–Sb bond distances ranging from 3.15–3.95 Å. In the third Sr2+ site, Sr2+ is bonded in a 8-coordinate geometry to eight Sb+2.20- atoms. There are four shorter (3.59 Å) and four longer (3.75 Å) Sr–Sb bond lengths. In the fourth Sr2+ site, Sr2+ is bonded in a 7-coordinate geometry to seven Sb+2.20- atoms. There are a spread of Sr–Sb bond distances ranging from 3.36–3.64 Å. There are five inequivalent Sb+2.20- sites. In the first Sb+2.20- site, Sb+2.20- is bonded in a 8-coordinate geometry to eight Sr2+ atoms. In the second Sb+2.20- site, Sb+2.20- is bonded in a 8-coordinate geometry to eight Sr2+ atoms. In the third Sb+2.20- site, Sb+2.20- is bonded in a 9-coordinate geometrymore » to seven Sr2+ and two equivalent Sb+2.20- atoms. Both Sb–Sb bond lengths are 3.05 Å. In the fourth Sb+2.20- site, Sb+2.20- is bonded in a 8-coordinate geometry to eight Sr2+ atoms. In the fifth Sb+2.20- site, Sb+2.20- is bonded in a 9-coordinate geometry to eight Sr2+ and one Sb+2.20- atom. The Sb–Sb bond length is 2.98 Å.« less

Publication Date:
Other Number(s):
mp-16475
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
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)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; Sr11Sb10; Sb-Sr
OSTI Identifier:
1191888
DOI:
https://doi.org/10.17188/1191888

Citation Formats

The Materials Project. Materials Data on Sr11Sb10 by Materials Project. United States: N. p., 2017. Web. doi:10.17188/1191888.
The Materials Project. Materials Data on Sr11Sb10 by Materials Project. United States. doi:https://doi.org/10.17188/1191888
The Materials Project. 2017. "Materials Data on Sr11Sb10 by Materials Project". United States. doi:https://doi.org/10.17188/1191888. https://www.osti.gov/servlets/purl/1191888. Pub date:Fri May 12 00:00:00 EDT 2017
@article{osti_1191888,
title = {Materials Data on Sr11Sb10 by Materials Project},
author = {The Materials Project},
abstractNote = {Sr11Sb10 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are four inequivalent Sr2+ sites. In the first Sr2+ site, Sr2+ is bonded to seven Sb+2.20- atoms to form a mixture of distorted corner, edge, and face-sharing SrSb7 pentagonal bipyramids. There are a spread of Sr–Sb bond distances ranging from 3.33–3.74 Å. In the second Sr2+ site, Sr2+ is bonded to seven Sb+2.20- atoms to form a mixture of distorted corner, edge, and face-sharing SrSb7 pentagonal bipyramids. There are a spread of Sr–Sb bond distances ranging from 3.15–3.95 Å. In the third Sr2+ site, Sr2+ is bonded in a 8-coordinate geometry to eight Sb+2.20- atoms. There are four shorter (3.59 Å) and four longer (3.75 Å) Sr–Sb bond lengths. In the fourth Sr2+ site, Sr2+ is bonded in a 7-coordinate geometry to seven Sb+2.20- atoms. There are a spread of Sr–Sb bond distances ranging from 3.36–3.64 Å. There are five inequivalent Sb+2.20- sites. In the first Sb+2.20- site, Sb+2.20- is bonded in a 8-coordinate geometry to eight Sr2+ atoms. In the second Sb+2.20- site, Sb+2.20- is bonded in a 8-coordinate geometry to eight Sr2+ atoms. In the third Sb+2.20- site, Sb+2.20- is bonded in a 9-coordinate geometry to seven Sr2+ and two equivalent Sb+2.20- atoms. Both Sb–Sb bond lengths are 3.05 Å. In the fourth Sb+2.20- site, Sb+2.20- is bonded in a 8-coordinate geometry to eight Sr2+ atoms. In the fifth Sb+2.20- site, Sb+2.20- is bonded in a 9-coordinate geometry to eight Sr2+ and one Sb+2.20- atom. The Sb–Sb bond length is 2.98 Å.},
doi = {10.17188/1191888},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2017},
month = {5}
}