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Title: Materials Data on Ge3Ir2S3 by Materials Project

Abstract

Ir2Ge3S3 crystallizes in the cubic Pm-3 space group. The structure is three-dimensional. Ir is bonded to three equivalent Ge and three equivalent S atoms to form corner-sharing IrGe3S3 octahedra. The corner-sharing octahedra tilt angles range from 55–62°. All Ir–Ge bond lengths are 2.52 Å. All Ir–S bond lengths are 2.33 Å. Ge is bonded in a 4-coordinate geometry to two equivalent Ir and two equivalent Ge atoms. There are one shorter (2.44 Å) and one longer (2.86 Å) Ge–Ge bond lengths. S is bonded in a distorted trigonal non-coplanar geometry to two equivalent Ir and one S atom. The S–S bond length is 2.18 Å.

Authors:
Publication Date:
Other Number(s):
mp-1197434
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; Ge3Ir2S3; Ge-Ir-S
OSTI Identifier:
1751995
DOI:
https://doi.org/10.17188/1751995

Citation Formats

The Materials Project. Materials Data on Ge3Ir2S3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1751995.
The Materials Project. Materials Data on Ge3Ir2S3 by Materials Project. United States. doi:https://doi.org/10.17188/1751995
The Materials Project. 2020. "Materials Data on Ge3Ir2S3 by Materials Project". United States. doi:https://doi.org/10.17188/1751995. https://www.osti.gov/servlets/purl/1751995. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1751995,
title = {Materials Data on Ge3Ir2S3 by Materials Project},
author = {The Materials Project},
abstractNote = {Ir2Ge3S3 crystallizes in the cubic Pm-3 space group. The structure is three-dimensional. Ir is bonded to three equivalent Ge and three equivalent S atoms to form corner-sharing IrGe3S3 octahedra. The corner-sharing octahedra tilt angles range from 55–62°. All Ir–Ge bond lengths are 2.52 Å. All Ir–S bond lengths are 2.33 Å. Ge is bonded in a 4-coordinate geometry to two equivalent Ir and two equivalent Ge atoms. There are one shorter (2.44 Å) and one longer (2.86 Å) Ge–Ge bond lengths. S is bonded in a distorted trigonal non-coplanar geometry to two equivalent Ir and one S atom. The S–S bond length is 2.18 Å.},
doi = {10.17188/1751995},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}