Skip to main content
U.S. Department of Energy
Office of Scientific and Technical Information

Materials Data on NaTb3 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1739614· OSTI ID:1739614
NaTb3 is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Na is bonded in a distorted body-centered cubic geometry to fourteen Tb atoms. There are eight shorter (3.46 Å) and six longer (3.99 Å) Na–Tb bond lengths. There are two inequivalent Tb sites. In the first Tb site, Tb is bonded in a distorted body-centered cubic geometry to four equivalent Na and four equivalent Tb atoms. All Tb–Tb bond lengths are 3.46 Å. In the second Tb site, Tb is bonded in a 8-coordinate geometry to six equivalent Na and eight equivalent Tb 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:
1739614
Report Number(s):
mp-1186178
Country of Publication:
United States
Language:
English

Similar Records

Materials Data on NaAc3 by Materials Project
Dataset · Sat May 02 00:00:00 EDT 2020 · OSTI ID:1720008

Materials Data on SmTa3 by Materials Project
Dataset · Thu May 11 00:00:00 EDT 2017 · OSTI ID:1313861

Materials Data on NaEr3 by Materials Project
Dataset · Thu Jul 23 00:00:00 EDT 2020 · OSTI ID:1315210