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Materials Data on Li3Pm by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1655530· OSTI ID:1655530
Li3Pm is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Li sites. In the first Li site, Li is bonded in a body-centered cubic geometry to four equivalent Li and four equivalent Pm atoms. All Li–Li bond lengths are 3.16 Å. All Li–Pm bond lengths are 3.16 Å. In the second Li site, Li is bonded in a 8-coordinate geometry to eight equivalent Li and six equivalent Pm atoms. All Li–Pm bond lengths are 3.64 Å. Pm is bonded in a distorted body-centered cubic geometry to fourteen Li atoms.
Research Organization:
LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Contributing Organization:
The Materials Project; MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231
OSTI ID:
1655530
Report Number(s):
mp-1185191
Country of Publication:
United States
Language:
English

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