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Title: Materials Data on Tb2CI by Materials Project

Abstract

Tb2CI is H-Phase structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Tb is bonded to three equivalent C and three equivalent I atoms to form a mixture of distorted face, edge, and corner-sharing TbC3I3 octahedra. The corner-sharing octahedra tilt angles range from 0–39°. All Tb–C bond lengths are 2.53 Å. All Tb–I bond lengths are 3.27 Å. C is bonded to six equivalent Tb atoms to form edge-sharing CTb6 octahedra. I is bonded in a 6-coordinate geometry to six equivalent Tb atoms.

Authors:
Publication Date:
Other Number(s):
mp-1207197
DOE Contract Number:  
AC02-05CH11231; EDCBEE
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)
Collaborations:
MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; Tb2CI; C-I-Tb
OSTI Identifier:
1749434
DOI:
https://doi.org/10.17188/1749434

Citation Formats

The Materials Project. Materials Data on Tb2CI by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1749434.
The Materials Project. Materials Data on Tb2CI by Materials Project. United States. doi:https://doi.org/10.17188/1749434
The Materials Project. 2020. "Materials Data on Tb2CI by Materials Project". United States. doi:https://doi.org/10.17188/1749434. https://www.osti.gov/servlets/purl/1749434. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1749434,
title = {Materials Data on Tb2CI by Materials Project},
author = {The Materials Project},
abstractNote = {Tb2CI is H-Phase structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Tb is bonded to three equivalent C and three equivalent I atoms to form a mixture of distorted face, edge, and corner-sharing TbC3I3 octahedra. The corner-sharing octahedra tilt angles range from 0–39°. All Tb–C bond lengths are 2.53 Å. All Tb–I bond lengths are 3.27 Å. C is bonded to six equivalent Tb atoms to form edge-sharing CTb6 octahedra. I is bonded in a 6-coordinate geometry to six equivalent Tb atoms.},
doi = {10.17188/1749434},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}