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Title: Materials Data on TeI by Materials Project

Abstract

TeI crystallizes in the triclinic P-1 space group. The structure is one-dimensional and consists of two TeI ribbons oriented in the (1, 0, 0) direction. there are four inequivalent Te sites. In the first Te site, Te is bonded in a distorted single-bond geometry to two Te and one I atom. There are one shorter (2.87 Å) and one longer (2.89 Å) Te–Te bond lengths. The Te–I bond length is 2.78 Å. In the second Te site, Te is bonded in a rectangular see-saw-like geometry to two Te and two I atoms. The Te–Te bond length is 2.87 Å. There are one shorter (3.23 Å) and one longer (3.26 Å) Te–I bond lengths. In the third Te site, Te is bonded in a distorted single-bond geometry to two Te and one I atom. The Te–Te bond length is 2.89 Å. The Te–I bond length is 2.78 Å. In the fourth Te site, Te is bonded in a rectangular see-saw-like geometry to two Te and two I atoms. There are one shorter (3.18 Å) and one longer (3.20 Å) Te–I bond lengths. There are four inequivalent I sites. In the first I site, I is bonded in a single-bond geometry tomore » one Te atom. In the second I site, I is bonded in a single-bond geometry to one Te atom. In the third I site, I is bonded in an L-shaped geometry to two Te atoms. In the fourth I site, I is bonded in an L-shaped geometry to two Te atoms.« less

Authors:
Publication Date:
Other Number(s):
mp-23273
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; TeI; I-Te
OSTI Identifier:
1199383
DOI:
https://doi.org/10.17188/1199383

Citation Formats

The Materials Project. Materials Data on TeI by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1199383.
The Materials Project. Materials Data on TeI by Materials Project. United States. doi:https://doi.org/10.17188/1199383
The Materials Project. 2020. "Materials Data on TeI by Materials Project". United States. doi:https://doi.org/10.17188/1199383. https://www.osti.gov/servlets/purl/1199383. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1199383,
title = {Materials Data on TeI by Materials Project},
author = {The Materials Project},
abstractNote = {TeI crystallizes in the triclinic P-1 space group. The structure is one-dimensional and consists of two TeI ribbons oriented in the (1, 0, 0) direction. there are four inequivalent Te sites. In the first Te site, Te is bonded in a distorted single-bond geometry to two Te and one I atom. There are one shorter (2.87 Å) and one longer (2.89 Å) Te–Te bond lengths. The Te–I bond length is 2.78 Å. In the second Te site, Te is bonded in a rectangular see-saw-like geometry to two Te and two I atoms. The Te–Te bond length is 2.87 Å. There are one shorter (3.23 Å) and one longer (3.26 Å) Te–I bond lengths. In the third Te site, Te is bonded in a distorted single-bond geometry to two Te and one I atom. The Te–Te bond length is 2.89 Å. The Te–I bond length is 2.78 Å. In the fourth Te site, Te is bonded in a rectangular see-saw-like geometry to two Te and two I atoms. There are one shorter (3.18 Å) and one longer (3.20 Å) Te–I bond lengths. There are four inequivalent I sites. In the first I site, I is bonded in a single-bond geometry to one Te atom. In the second I site, I is bonded in a single-bond geometry to one Te atom. In the third I site, I is bonded in an L-shaped geometry to two Te atoms. In the fourth I site, I is bonded in an L-shaped geometry to two Te atoms.},
doi = {10.17188/1199383},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}