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Materials Data on Sn by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1721875· OSTI ID:1721875
Sn is Protactinium-like structured and crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. there are three inequivalent Sn sites. In the first Sn site, Sn is bonded in a distorted q6 geometry to ten Sn atoms. There are a spread of Sn–Sn bond distances ranging from 3.24–3.45 Å. In the second Sn site, Sn is bonded in a distorted q6 geometry to ten Sn atoms. There are two shorter (3.23 Å) and four longer (3.39 Å) Sn–Sn bond lengths. In the third Sn site, Sn is bonded in a 10-coordinate geometry to ten Sn atoms. There are a spread of Sn–Sn bond distances ranging from 3.37–3.46 Å.
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:
1721875
Report Number(s):
mp-1179414
Country of Publication:
United States
Language:
English

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