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Title: Materials Data on Sm2Te3 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1284035· OSTI ID:1284035

Sm2Te3 crystallizes in the tetragonal I-42d space group. The structure is three-dimensional. there are three inequivalent Sm3+ sites. In the first Sm3+ site, Sm3+ is bonded to eight Te2- atoms to form a mixture of distorted face, edge, and corner-sharing SmTe8 hexagonal bipyramids. There are a spread of Sm–Te bond distances ranging from 3.17–3.38 Å. In the second Sm3+ site, Sm3+ is bonded to eight Te2- atoms to form a mixture of distorted face, edge, and corner-sharing SmTe8 hexagonal bipyramids. There are a spread of Sm–Te bond distances ranging from 3.18–3.42 Å. In the third Sm3+ site, Sm3+ is bonded to eight Te2- atoms to form a mixture of distorted face, edge, and corner-sharing SmTe8 hexagonal bipyramids. There are a spread of Sm–Te bond distances ranging from 3.14–3.44 Å. There are three inequivalent Te2- sites. In the first Te2- site, Te2- is bonded to five Sm3+ atoms to form a mixture of distorted face, edge, and corner-sharing TeSm5 square pyramids. In the second Te2- site, Te2- is bonded in a 6-coordinate geometry to six Sm3+ atoms. In the third Te2- site, Te2- is bonded to five Sm3+ atoms to form a mixture of distorted face, edge, and corner-sharing TeSm5 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:
1284035
Report Number(s):
mp-684911
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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