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Title: Materials Data on Re24Mo5 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1189111· OSTI ID:1189111

Mo5Re24 is alpha-derived structured and crystallizes in the cubic I-43m space group. The structure is three-dimensional. there are two inequivalent Mo sites. In the first Mo site, Mo is bonded in a 3-coordinate geometry to one Mo and fifteen Re atoms. The Mo–Mo bond length is 3.00 Å. There are a spread of Mo–Re bond distances ranging from 2.73–3.25 Å. In the second Mo site, Mo is bonded in a 12-coordinate geometry to four equivalent Mo and twelve equivalent Re atoms. All Mo–Re bond lengths are 3.01 Å. There are two inequivalent Re sites. In the first Re site, Re is bonded in a 1-coordinate geometry to two equivalent Mo and eleven Re atoms. There are a spread of Re–Re bond distances ranging from 2.59–2.91 Å. In the second Re site, Re is bonded in a 12-coordinate geometry to four Mo and eight Re atoms. There are one shorter (2.48 Å) and two longer (2.64 Å) Re–Re bond lengths.

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:
1189111
Report Number(s):
mp-12662
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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