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Title: Materials Data on Te2Ir by Materials Project

Abstract

IrTe2 is Pyrite-like structured and crystallizes in the cubic Pa-3 space group. The structure is three-dimensional. Ir4+ is bonded to six equivalent Te2- atoms to form corner-sharing IrTe6 octahedra. The corner-sharing octahedral tilt angles are 62°. All Ir–Te bond lengths are 2.70 Å. Te2- is bonded in a 4-coordinate geometry to three equivalent Ir4+ and one Te2- atom. The Te–Te bond length is 3.01 Å.

Publication Date:
Other Number(s):
mp-10844
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; Te2Ir; Ir-Te
OSTI Identifier:
1187389
DOI:
https://doi.org/10.17188/1187389

Citation Formats

The Materials Project. Materials Data on Te2Ir by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1187389.
The Materials Project. Materials Data on Te2Ir by Materials Project. United States. doi:https://doi.org/10.17188/1187389
The Materials Project. 2020. "Materials Data on Te2Ir by Materials Project". United States. doi:https://doi.org/10.17188/1187389. https://www.osti.gov/servlets/purl/1187389. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1187389,
title = {Materials Data on Te2Ir by Materials Project},
author = {The Materials Project},
abstractNote = {IrTe2 is Pyrite-like structured and crystallizes in the cubic Pa-3 space group. The structure is three-dimensional. Ir4+ is bonded to six equivalent Te2- atoms to form corner-sharing IrTe6 octahedra. The corner-sharing octahedral tilt angles are 62°. All Ir–Te bond lengths are 2.70 Å. Te2- is bonded in a 4-coordinate geometry to three equivalent Ir4+ and one Te2- atom. The Te–Te bond length is 3.01 Å.},
doi = {10.17188/1187389},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}