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Title: Materials Data on Ba2Sb by Materials Project

Abstract

Ba2Sb crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Ba sites. In the first Ba site, Ba is bonded in a 5-coordinate geometry to five equivalent Sb atoms. There are one shorter (3.54 Å) and four longer (3.85 Å) Ba–Sb bond lengths. In the second Ba site, Ba is bonded in a distorted square co-planar geometry to four equivalent Sb atoms. All Ba–Sb bond lengths are 3.67 Å. Sb is bonded in a 9-coordinate geometry to nine Ba atoms.

Publication Date:
Other Number(s):
mp-9908
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; Ba2Sb; Ba-Sb
OSTI Identifier:
1316968
DOI:
https://doi.org/10.17188/1316968

Citation Formats

The Materials Project. Materials Data on Ba2Sb by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1316968.
The Materials Project. Materials Data on Ba2Sb by Materials Project. United States. doi:https://doi.org/10.17188/1316968
The Materials Project. 2020. "Materials Data on Ba2Sb by Materials Project". United States. doi:https://doi.org/10.17188/1316968. https://www.osti.gov/servlets/purl/1316968. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1316968,
title = {Materials Data on Ba2Sb by Materials Project},
author = {The Materials Project},
abstractNote = {Ba2Sb crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Ba sites. In the first Ba site, Ba is bonded in a 5-coordinate geometry to five equivalent Sb atoms. There are one shorter (3.54 Å) and four longer (3.85 Å) Ba–Sb bond lengths. In the second Ba site, Ba is bonded in a distorted square co-planar geometry to four equivalent Sb atoms. All Ba–Sb bond lengths are 3.67 Å. Sb is bonded in a 9-coordinate geometry to nine Ba atoms.},
doi = {10.17188/1316968},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}