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Title: Materials Data on SiMo3 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1189161· OSTI ID:1189161

Mo3Si crystallizes in the cubic Pm-3n space group. The structure is three-dimensional. Mo is bonded in a 6-coordinate geometry to two equivalent Mo and four equivalent Si atoms. Both Mo–Mo bond lengths are 2.46 Å. All Mo–Si bond lengths are 2.75 Å. Si is bonded to twelve equivalent Mo atoms to form a mixture of edge and face-sharing SiMo12 cuboctahedra.

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:
1189161
Report Number(s):
mp-1275
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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