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Materials Data on NaS by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1713602· OSTI ID:1713602

NaS is Halite, Rock Salt structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Na1+ is bonded to six equivalent S1- atoms to form a mixture of corner and edge-sharing NaS6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Na–S bond lengths are 2.87 Å. S1- is bonded to six equivalent Na1+ atoms to form a mixture of corner and edge-sharing SNa6 octahedra. The corner-sharing octahedral tilt angles are 0°.

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:
1713602
Report Number(s):
mp-1058171
Country of Publication:
United States
Language:
English

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