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Title: Materials Data on BaSi2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1326307· OSTI ID:1326307

BaSi2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Ba is bonded in a distorted q4 geometry to ten equivalent Si atoms. There are two shorter (3.36 Å) and eight longer (3.61 Å) Ba–Si bond lengths. Si is bonded in a 6-coordinate geometry to five equivalent Ba and one Si atom. The Si–Si bond length is 2.17 Å.

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:
1326307
Report Number(s):
mp-1009827
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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