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Title: Materials Data on Th(TeI)2 by Materials Project

Abstract

Th(TeI)2 crystallizes in the monoclinic C2/m space group. The structure is two-dimensional and consists of one Th(TeI)2 sheet oriented in the (0, 0, 1) direction. Th4+ is bonded in a 8-coordinate geometry to four Te1- and four equivalent I1- atoms. There are two shorter (3.21 Å) and two longer (3.24 Å) Th–Te bond lengths. There are two shorter (3.19 Å) and two longer (3.23 Å) Th–I bond lengths. There are two inequivalent Te1- sites. In the first Te1- site, Te1- is bonded in a 2-coordinate geometry to two equivalent Th4+ atoms. In the second Te1- site, Te1- is bonded in a 2-coordinate geometry to two equivalent Th4+ atoms. I1- is bonded in a distorted water-like geometry to two equivalent Th4+ atoms.

Publication Date:
Other Number(s):
mp-542180
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; Th(TeI)2; I-Te-Th
OSTI Identifier:
1266449
DOI:
10.17188/1266449

Citation Formats

The Materials Project. Materials Data on Th(TeI)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1266449.
The Materials Project. Materials Data on Th(TeI)2 by Materials Project. United States. doi:10.17188/1266449.
The Materials Project. 2020. "Materials Data on Th(TeI)2 by Materials Project". United States. doi:10.17188/1266449. https://www.osti.gov/servlets/purl/1266449. Pub date:Tue Jul 14 00:00:00 EDT 2020
@article{osti_1266449,
title = {Materials Data on Th(TeI)2 by Materials Project},
author = {The Materials Project},
abstractNote = {Th(TeI)2 crystallizes in the monoclinic C2/m space group. The structure is two-dimensional and consists of one Th(TeI)2 sheet oriented in the (0, 0, 1) direction. Th4+ is bonded in a 8-coordinate geometry to four Te1- and four equivalent I1- atoms. There are two shorter (3.21 Å) and two longer (3.24 Å) Th–Te bond lengths. There are two shorter (3.19 Å) and two longer (3.23 Å) Th–I bond lengths. There are two inequivalent Te1- sites. In the first Te1- site, Te1- is bonded in a 2-coordinate geometry to two equivalent Th4+ atoms. In the second Te1- site, Te1- is bonded in a 2-coordinate geometry to two equivalent Th4+ atoms. I1- is bonded in a distorted water-like geometry to two equivalent Th4+ atoms.},
doi = {10.17188/1266449},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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