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Title: Materials Data on La3SbI3 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1204431· OSTI ID:1204431

La3SbI3 crystallizes in the cubic I4_132 space group. The structure is three-dimensional. La2+ is bonded to two equivalent Sb3- and four equivalent I1- atoms to form a mixture of edge and corner-sharing LaSb2I4 octahedra. The corner-sharing octahedra tilt angles range from 3–7°. Both La–Sb bond lengths are 3.12 Å. There are two shorter (3.33 Å) and two longer (3.37 Å) La–I bond lengths. Sb3- is bonded to six equivalent La2+ atoms to form edge-sharing SbLa6 octahedra. I1- is bonded in a rectangular see-saw-like geometry to four equivalent La2+ 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:
1204431
Report Number(s):
mp-29998
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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