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Title: Materials Data on Y3CBr3 by Materials Project

Abstract

Y3CBr3 crystallizes in the trigonal R-3 space group. The structure is two-dimensional and consists of three Y3CBr3 sheets oriented in the (0, 0, 1) direction. Y is bonded to two equivalent C and three equivalent Br atoms to form a mixture of edge and corner-sharing YC2Br3 square pyramids. Both Y–C bond lengths are 2.53 Å. There are a spread of Y–Br bond distances ranging from 2.84–2.94 Å. C is bonded to six equivalent Y atoms to form edge-sharing CY6 octahedra. Br is bonded in a distorted T-shaped geometry to three equivalent Y atoms.

Publication Date:
Other Number(s):
mp-1216138
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; Y3CBr3; Br-C-Y
OSTI Identifier:
1687677
DOI:
https://doi.org/10.17188/1687677

Citation Formats

The Materials Project. Materials Data on Y3CBr3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1687677.
The Materials Project. Materials Data on Y3CBr3 by Materials Project. United States. doi:https://doi.org/10.17188/1687677
The Materials Project. 2020. "Materials Data on Y3CBr3 by Materials Project". United States. doi:https://doi.org/10.17188/1687677. https://www.osti.gov/servlets/purl/1687677. Pub date:Wed Apr 29 00:00:00 EDT 2020
@article{osti_1687677,
title = {Materials Data on Y3CBr3 by Materials Project},
author = {The Materials Project},
abstractNote = {Y3CBr3 crystallizes in the trigonal R-3 space group. The structure is two-dimensional and consists of three Y3CBr3 sheets oriented in the (0, 0, 1) direction. Y is bonded to two equivalent C and three equivalent Br atoms to form a mixture of edge and corner-sharing YC2Br3 square pyramids. Both Y–C bond lengths are 2.53 Å. There are a spread of Y–Br bond distances ranging from 2.84–2.94 Å. C is bonded to six equivalent Y atoms to form edge-sharing CY6 octahedra. Br is bonded in a distorted T-shaped geometry to three equivalent Y atoms.},
doi = {10.17188/1687677},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}