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Title: Materials Data on Y5Ga3 by Materials Project

Abstract

Y5Ga3 crystallizes in the tetragonal P4/ncc space group. The structure is three-dimensional. there are two inequivalent Y sites. In the first Y site, Y is bonded to five Ga atoms to form a mixture of distorted face, edge, and corner-sharing YGa5 trigonal bipyramids. There are a spread of Y–Ga bond distances ranging from 3.07–3.21 Å. In the second Y site, Y is bonded in a 4-coordinate geometry to six Ga atoms. There are a spread of Y–Ga bond distances ranging from 3.04–3.65 Å. There are two inequivalent Ga sites. In the first Ga site, Ga is bonded in a 9-coordinate geometry to eight Y and one Ga atom. The Ga–Ga bond length is 2.66 Å. In the second Ga site, Ga is bonded in a 10-coordinate geometry to ten Y atoms.

Authors:
Publication Date:
Other Number(s):
mp-672256
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; Y5Ga3; Ga-Y
OSTI Identifier:
1281805
DOI:
https://doi.org/10.17188/1281805

Citation Formats

The Materials Project. Materials Data on Y5Ga3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1281805.
The Materials Project. Materials Data on Y5Ga3 by Materials Project. United States. doi:https://doi.org/10.17188/1281805
The Materials Project. 2020. "Materials Data on Y5Ga3 by Materials Project". United States. doi:https://doi.org/10.17188/1281805. https://www.osti.gov/servlets/purl/1281805. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1281805,
title = {Materials Data on Y5Ga3 by Materials Project},
author = {The Materials Project},
abstractNote = {Y5Ga3 crystallizes in the tetragonal P4/ncc space group. The structure is three-dimensional. there are two inequivalent Y sites. In the first Y site, Y is bonded to five Ga atoms to form a mixture of distorted face, edge, and corner-sharing YGa5 trigonal bipyramids. There are a spread of Y–Ga bond distances ranging from 3.07–3.21 Å. In the second Y site, Y is bonded in a 4-coordinate geometry to six Ga atoms. There are a spread of Y–Ga bond distances ranging from 3.04–3.65 Å. There are two inequivalent Ga sites. In the first Ga site, Ga is bonded in a 9-coordinate geometry to eight Y and one Ga atom. The Ga–Ga bond length is 2.66 Å. In the second Ga site, Ga is bonded in a 10-coordinate geometry to ten Y atoms.},
doi = {10.17188/1281805},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}