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Title: Materials Data on GaI3 by Materials Project

Abstract

GaI3 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of two GaI3 clusters. Ga3+ is bonded to four I1- atoms to form edge-sharing GaI4 tetrahedra. There are a spread of Ga–I bond distances ranging from 2.52–2.72 Å. There are three inequivalent I1- sites. In the first I1- site, I1- is bonded in a single-bond geometry to one Ga3+ atom. In the second I1- site, I1- is bonded in a single-bond geometry to one Ga3+ atom. In the third I1- site, I1- is bonded in an L-shaped geometry to two equivalent Ga3+ atoms.

Publication Date:
Other Number(s):
mp-30954
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; GaI3; Ga-I
OSTI Identifier:
1205294
DOI:
https://doi.org/10.17188/1205294

Citation Formats

The Materials Project. Materials Data on GaI3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1205294.
The Materials Project. Materials Data on GaI3 by Materials Project. United States. doi:https://doi.org/10.17188/1205294
The Materials Project. 2020. "Materials Data on GaI3 by Materials Project". United States. doi:https://doi.org/10.17188/1205294. https://www.osti.gov/servlets/purl/1205294. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1205294,
title = {Materials Data on GaI3 by Materials Project},
author = {The Materials Project},
abstractNote = {GaI3 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of two GaI3 clusters. Ga3+ is bonded to four I1- atoms to form edge-sharing GaI4 tetrahedra. There are a spread of Ga–I bond distances ranging from 2.52–2.72 Å. There are three inequivalent I1- sites. In the first I1- site, I1- is bonded in a single-bond geometry to one Ga3+ atom. In the second I1- site, I1- is bonded in a single-bond geometry to one Ga3+ atom. In the third I1- site, I1- is bonded in an L-shaped geometry to two equivalent Ga3+ atoms.},
doi = {10.17188/1205294},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}