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Title: Materials Data on MgGa2 by Materials Project

Abstract

MgGa2 crystallizes in the orthorhombic Amm2 space group. The structure is three-dimensional. there are two inequivalent Mg sites. In the first Mg site, Mg is bonded in a 12-coordinate geometry to eight Ga atoms. There are a spread of Mg–Ga bond distances ranging from 2.87–3.06 Å. In the second Mg site, Mg is bonded in a 12-coordinate geometry to eight Ga atoms. There are a spread of Mg–Ga bond distances ranging from 2.85–3.01 Å. There are four inequivalent Ga sites. In the first Ga site, Ga is bonded in a 2-coordinate geometry to two equivalent Mg and eight Ga atoms. There are a spread of Ga–Ga bond distances ranging from 2.83–3.04 Å. In the second Ga site, Ga is bonded in a 10-coordinate geometry to four equivalent Mg and six Ga atoms. All Ga–Ga bond lengths are 2.93 Å. In the third Ga site, Ga is bonded in a 10-coordinate geometry to six Mg and four Ga atoms. In the fourth Ga site, Ga is bonded in a 4-coordinate geometry to four Mg and six Ga atoms.

Publication Date:
Other Number(s):
mp-1094622
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; MgGa2; Ga-Mg
OSTI Identifier:
1716913
DOI:
https://doi.org/10.17188/1716913

Citation Formats

The Materials Project. Materials Data on MgGa2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1716913.
The Materials Project. Materials Data on MgGa2 by Materials Project. United States. doi:https://doi.org/10.17188/1716913
The Materials Project. 2020. "Materials Data on MgGa2 by Materials Project". United States. doi:https://doi.org/10.17188/1716913. https://www.osti.gov/servlets/purl/1716913. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1716913,
title = {Materials Data on MgGa2 by Materials Project},
author = {The Materials Project},
abstractNote = {MgGa2 crystallizes in the orthorhombic Amm2 space group. The structure is three-dimensional. there are two inequivalent Mg sites. In the first Mg site, Mg is bonded in a 12-coordinate geometry to eight Ga atoms. There are a spread of Mg–Ga bond distances ranging from 2.87–3.06 Å. In the second Mg site, Mg is bonded in a 12-coordinate geometry to eight Ga atoms. There are a spread of Mg–Ga bond distances ranging from 2.85–3.01 Å. There are four inequivalent Ga sites. In the first Ga site, Ga is bonded in a 2-coordinate geometry to two equivalent Mg and eight Ga atoms. There are a spread of Ga–Ga bond distances ranging from 2.83–3.04 Å. In the second Ga site, Ga is bonded in a 10-coordinate geometry to four equivalent Mg and six Ga atoms. All Ga–Ga bond lengths are 2.93 Å. In the third Ga site, Ga is bonded in a 10-coordinate geometry to six Mg and four Ga atoms. In the fourth Ga site, Ga is bonded in a 4-coordinate geometry to four Mg and six Ga atoms.},
doi = {10.17188/1716913},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}