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Title: Materials Data on Ga2I3 by Materials Project

Abstract

Ga2I3 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four gallium molecules and two GaI3 clusters. In each GaI3 cluster, Ga is bonded in a distorted tetrahedral geometry to one Ga and three I atoms. The Ga–Ga bond length is 2.43 Å. There are two shorter (2.64 Å) and one longer (2.65 Å) Ga–I bond lengths. There are three inequivalent I sites. In the first I site, I is bonded in a distorted single-bond geometry to one Ga atom. In the second I site, I is bonded in a single-bond geometry to one Ga atom. In the third I site, I is bonded in a single-bond geometry to one Ga atom.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-636675
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; Ga2I3; Ga-I
OSTI Identifier:
1279598
DOI:
10.17188/1279598

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on Ga2I3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1279598.
Persson, Kristin, & Project, Materials. Materials Data on Ga2I3 by Materials Project. United States. doi:10.17188/1279598.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on Ga2I3 by Materials Project". United States. doi:10.17188/1279598. https://www.osti.gov/servlets/purl/1279598. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1279598,
title = {Materials Data on Ga2I3 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {Ga2I3 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four gallium molecules and two GaI3 clusters. In each GaI3 cluster, Ga is bonded in a distorted tetrahedral geometry to one Ga and three I atoms. The Ga–Ga bond length is 2.43 Å. There are two shorter (2.64 Å) and one longer (2.65 Å) Ga–I bond lengths. There are three inequivalent I sites. In the first I site, I is bonded in a distorted single-bond geometry to one Ga atom. In the second I site, I is bonded in a single-bond geometry to one Ga atom. In the third I site, I is bonded in a single-bond geometry to one Ga atom.},
doi = {10.17188/1279598},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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