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Title: Materials Data on Sm3Se4 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1189586· OSTI ID:1189586

Sm3Se4 crystallizes in the cubic I-43d space group. The structure is three-dimensional. Sm+2.67+ is bonded to eight equivalent Se2- atoms to form a mixture of distorted corner, edge, and face-sharing SmSe8 hexagonal bipyramids. There are four shorter (2.97 Å) and four longer (3.16 Å) Sm–Se bond lengths. Se2- is bonded to six equivalent Sm+2.67+ atoms to form a mixture of distorted corner, edge, and face-sharing SeSm6 octahedra. The corner-sharing octahedra tilt angles range from 18–49°.

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:
1189586
Report Number(s):
mp-1344
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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