DOE Data Explorer title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on BaGaSn by Materials Project

Abstract

BaGaSn crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Ba is bonded in a 9-coordinate geometry to six equivalent Ga and three equivalent Sn atoms. There are a spread of Ba–Ga bond distances ranging from 3.59–3.72 Å. All Ba–Sn bond lengths are 3.51 Å. Ga is bonded in a 9-coordinate geometry to six equivalent Ba and three equivalent Ga atoms. There are one shorter (2.68 Å) and two longer (2.72 Å) Ga–Ga bond lengths. Sn is bonded to three equivalent Ba and three equivalent Sn atoms to form distorted edge-sharing SnBa3Sn3 octahedra. There are two shorter (2.93 Å) and one longer (2.94 Å) Sn–Sn bond lengths.

Authors:
Publication Date:
Other Number(s):
mp-1228005
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; BaGaSn; Ba-Ga-Sn
OSTI Identifier:
1689078
DOI:
https://doi.org/10.17188/1689078

Citation Formats

The Materials Project. Materials Data on BaGaSn by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1689078.
The Materials Project. Materials Data on BaGaSn by Materials Project. United States. doi:https://doi.org/10.17188/1689078
The Materials Project. 2020. "Materials Data on BaGaSn by Materials Project". United States. doi:https://doi.org/10.17188/1689078. https://www.osti.gov/servlets/purl/1689078. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1689078,
title = {Materials Data on BaGaSn by Materials Project},
author = {The Materials Project},
abstractNote = {BaGaSn crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Ba is bonded in a 9-coordinate geometry to six equivalent Ga and three equivalent Sn atoms. There are a spread of Ba–Ga bond distances ranging from 3.59–3.72 Å. All Ba–Sn bond lengths are 3.51 Å. Ga is bonded in a 9-coordinate geometry to six equivalent Ba and three equivalent Ga atoms. There are one shorter (2.68 Å) and two longer (2.72 Å) Ga–Ga bond lengths. Sn is bonded to three equivalent Ba and three equivalent Sn atoms to form distorted edge-sharing SnBa3Sn3 octahedra. There are two shorter (2.93 Å) and one longer (2.94 Å) Sn–Sn bond lengths.},
doi = {10.17188/1689078},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}