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Title: Materials Data on BaGaSnH by Materials Project

Abstract

BaGaSnH crystallizes in the trigonal P3m1 space group. The structure is three-dimensional. Ba is bonded in a distorted trigonal planar geometry to three equivalent Sn and three equivalent H atoms. All Ba–Sn bond lengths are 3.64 Å. All Ba–H bond lengths are 2.71 Å. Ga is bonded in a distorted single-bond geometry to three equivalent Sn and one H atom. All Ga–Sn bond lengths are 2.75 Å. The Ga–H bond length is 1.75 Å. Sn is bonded in a 6-coordinate geometry to three equivalent Ba and three equivalent Ga atoms. H is bonded to three equivalent Ba and one Ga atom to form distorted corner-sharing HBa3Ga trigonal pyramids.

Publication Date:
Other Number(s):
mp-1018094
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; BaGaSnH; Ba-Ga-H-Sn
OSTI Identifier:
1350253
DOI:
10.17188/1350253

Citation Formats

The Materials Project. Materials Data on BaGaSnH by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1350253.
The Materials Project. Materials Data on BaGaSnH by Materials Project. United States. doi:10.17188/1350253.
The Materials Project. 2020. "Materials Data on BaGaSnH by Materials Project". United States. doi:10.17188/1350253. https://www.osti.gov/servlets/purl/1350253. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1350253,
title = {Materials Data on BaGaSnH by Materials Project},
author = {The Materials Project},
abstractNote = {BaGaSnH crystallizes in the trigonal P3m1 space group. The structure is three-dimensional. Ba is bonded in a distorted trigonal planar geometry to three equivalent Sn and three equivalent H atoms. All Ba–Sn bond lengths are 3.64 Å. All Ba–H bond lengths are 2.71 Å. Ga is bonded in a distorted single-bond geometry to three equivalent Sn and one H atom. All Ga–Sn bond lengths are 2.75 Å. The Ga–H bond length is 1.75 Å. Sn is bonded in a 6-coordinate geometry to three equivalent Ba and three equivalent Ga atoms. H is bonded to three equivalent Ba and one Ga atom to form distorted corner-sharing HBa3Ga trigonal pyramids.},
doi = {10.17188/1350253},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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