skip to main content
OSTI.GOV title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on Cs2TeI6 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1264885· OSTI ID:1264885

Cs2TeI6 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Cs1+ is bonded to twelve equivalent I1- atoms to form CsI12 cuboctahedra that share corners with twelve equivalent CsI12 cuboctahedra, faces with six equivalent CsI12 cuboctahedra, and faces with four equivalent TeI6 octahedra. All Cs–I bond lengths are 4.27 Å. Te4+ is bonded to six equivalent I1- atoms to form TeI6 octahedra that share faces with eight equivalent CsI12 cuboctahedra. All Te–I bond lengths are 2.98 Å. I1- is bonded to four equivalent Cs1+ and one Te4+ atom to form a mixture of distorted edge, face, and corner-sharing ICs4Te square pyramids.

Research Organization:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Contributing Organization:
MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231; EDCBEE
OSTI ID:
1264885
Report Number(s):
mp-540957
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

Similar Records

Materials Data on Cs2HgAsI6 by Materials Project
Dataset · Thu Apr 30 00:00:00 EDT 2020 · OSTI ID:1264885

Materials Data on Cs2CeCuI6 by Materials Project
Dataset · Sat May 02 00:00:00 EDT 2020 · OSTI ID:1264885

Materials Data on Cs2AsAuI6 by Materials Project
Dataset · Sat May 02 00:00:00 EDT 2020 · OSTI ID:1264885