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Title: Materials Data on B5SbO10 by Materials Project

Abstract

B5SbO10 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional and consists of two B5SbO10 frameworks. there are five inequivalent B3+ sites. In the first B3+ site, B3+ is bonded in a trigonal planar geometry to three O2- atoms. There are a spread of B–O bond distances ranging from 1.34–1.42 Å. In the second B3+ site, B3+ is bonded in a trigonal planar geometry to three O2- atoms. There are a spread of B–O bond distances ranging from 1.34–1.42 Å. In the third B3+ site, B3+ is bonded in a trigonal planar geometry to three O2- atoms. There are a spread of B–O bond distances ranging from 1.33–1.42 Å. In the fourth B3+ site, B3+ is bonded in a tetrahedral geometry to four O2- atoms. There are a spread of B–O bond distances ranging from 1.47–1.50 Å. In the fifth B3+ site, B3+ is bonded in a trigonal planar geometry to three O2- atoms. There are a spread of B–O bond distances ranging from 1.33–1.42 Å. Sb5+ is bonded in a tetrahedral geometry to four O2- atoms. There is one shorter (1.89 Å) and three longer (1.90 Å) Sb–O bond length. There are ten inequivalent O2- sites. Inmore » the first O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one B3+ and one Sb5+ atom. In the second O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one B3+ and one Sb5+ atom. In the third O2- site, O2- is bonded in a bent 120 degrees geometry to two B3+ atoms. In the fourth O2- site, O2- is bonded in a bent 120 degrees geometry to two B3+ atoms. In the fifth O2- site, O2- is bonded in a bent 120 degrees geometry to two B3+ atoms. In the sixth O2- site, O2- is bonded in a bent 120 degrees geometry to two B3+ atoms. In the seventh O2- site, O2- is bonded in a distorted bent 150 degrees geometry to one B3+ and one Sb5+ atom. In the eighth O2- site, O2- is bonded in a bent 150 degrees geometry to one B3+ and one Sb5+ atom. In the ninth O2- site, O2- is bonded in a bent 120 degrees geometry to two B3+ atoms. In the tenth O2- site, O2- is bonded in a bent 120 degrees geometry to two B3+ atoms.« less

Publication Date:
Other Number(s):
mp-779174
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; B5SbO10; B-O-Sb
OSTI Identifier:
1306069
DOI:
10.17188/1306069

Citation Formats

The Materials Project. Materials Data on B5SbO10 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1306069.
The Materials Project. Materials Data on B5SbO10 by Materials Project. United States. doi:10.17188/1306069.
The Materials Project. 2020. "Materials Data on B5SbO10 by Materials Project". United States. doi:10.17188/1306069. https://www.osti.gov/servlets/purl/1306069. Pub date:Thu Apr 30 00:00:00 EDT 2020
@article{osti_1306069,
title = {Materials Data on B5SbO10 by Materials Project},
author = {The Materials Project},
abstractNote = {B5SbO10 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional and consists of two B5SbO10 frameworks. there are five inequivalent B3+ sites. In the first B3+ site, B3+ is bonded in a trigonal planar geometry to three O2- atoms. There are a spread of B–O bond distances ranging from 1.34–1.42 Å. In the second B3+ site, B3+ is bonded in a trigonal planar geometry to three O2- atoms. There are a spread of B–O bond distances ranging from 1.34–1.42 Å. In the third B3+ site, B3+ is bonded in a trigonal planar geometry to three O2- atoms. There are a spread of B–O bond distances ranging from 1.33–1.42 Å. In the fourth B3+ site, B3+ is bonded in a tetrahedral geometry to four O2- atoms. There are a spread of B–O bond distances ranging from 1.47–1.50 Å. In the fifth B3+ site, B3+ is bonded in a trigonal planar geometry to three O2- atoms. There are a spread of B–O bond distances ranging from 1.33–1.42 Å. Sb5+ is bonded in a tetrahedral geometry to four O2- atoms. There is one shorter (1.89 Å) and three longer (1.90 Å) Sb–O bond length. There are ten inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one B3+ and one Sb5+ atom. In the second O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one B3+ and one Sb5+ atom. In the third O2- site, O2- is bonded in a bent 120 degrees geometry to two B3+ atoms. In the fourth O2- site, O2- is bonded in a bent 120 degrees geometry to two B3+ atoms. In the fifth O2- site, O2- is bonded in a bent 120 degrees geometry to two B3+ atoms. In the sixth O2- site, O2- is bonded in a bent 120 degrees geometry to two B3+ atoms. In the seventh O2- site, O2- is bonded in a distorted bent 150 degrees geometry to one B3+ and one Sb5+ atom. In the eighth O2- site, O2- is bonded in a bent 150 degrees geometry to one B3+ and one Sb5+ atom. In the ninth O2- site, O2- is bonded in a bent 120 degrees geometry to two B3+ atoms. In the tenth O2- site, O2- is bonded in a bent 120 degrees geometry to two B3+ atoms.},
doi = {10.17188/1306069},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}

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