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Title: Materials Data on ZrSnTe by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1313113· OSTI ID:1313113

ZrSnTe is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Zr is bonded in a 9-coordinate geometry to four equivalent Sn and five equivalent Te atoms. All Zr–Sn bond lengths are 3.10 Å. There are four shorter (3.08 Å) and one longer (3.13 Å) Zr–Te bond lengths. Sn is bonded in a 8-coordinate geometry to four equivalent Zr and four equivalent Sn atoms. All Sn–Sn bond lengths are 2.91 Å. Te is bonded in a 5-coordinate geometry to five equivalent Zr atoms.

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:
1313113
Report Number(s):
mp-9289
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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