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Title: Materials Data on YbInBr3 by Materials Project

Abstract

YbInBr3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Yb2+ is bonded to six Br1- atoms to form a mixture of edge and corner-sharing YbBr6 octahedra. The corner-sharing octahedral tilt angles are 42°. All Yb–Br bond lengths are 2.91 Å. In1+ is bonded in a 6-coordinate geometry to six Br1- atoms. There are two shorter (3.30 Å) and four longer (3.48 Å) In–Br bond lengths. There are two inequivalent Br1- sites. In the first Br1- site, Br1- is bonded in a distorted L-shaped geometry to two equivalent Yb2+ and two equivalent In1+ atoms. In the second Br1- site, Br1- is bonded in a 4-coordinate geometry to two equivalent Yb2+ and two equivalent In1+ atoms.

Publication Date:
Other Number(s):
mp-1205559
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; YbInBr3; Br-In-Yb
OSTI Identifier:
1682682
DOI:
https://doi.org/10.17188/1682682

Citation Formats

The Materials Project. Materials Data on YbInBr3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1682682.
The Materials Project. Materials Data on YbInBr3 by Materials Project. United States. doi:https://doi.org/10.17188/1682682
The Materials Project. 2020. "Materials Data on YbInBr3 by Materials Project". United States. doi:https://doi.org/10.17188/1682682. https://www.osti.gov/servlets/purl/1682682. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1682682,
title = {Materials Data on YbInBr3 by Materials Project},
author = {The Materials Project},
abstractNote = {YbInBr3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Yb2+ is bonded to six Br1- atoms to form a mixture of edge and corner-sharing YbBr6 octahedra. The corner-sharing octahedral tilt angles are 42°. All Yb–Br bond lengths are 2.91 Å. In1+ is bonded in a 6-coordinate geometry to six Br1- atoms. There are two shorter (3.30 Å) and four longer (3.48 Å) In–Br bond lengths. There are two inequivalent Br1- sites. In the first Br1- site, Br1- is bonded in a distorted L-shaped geometry to two equivalent Yb2+ and two equivalent In1+ atoms. In the second Br1- site, Br1- is bonded in a 4-coordinate geometry to two equivalent Yb2+ and two equivalent In1+ atoms.},
doi = {10.17188/1682682},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}