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Title: Materials Data on UFeGe by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1277583· OSTI ID:1277583

UFeGe crystallizes in the monoclinic P2_1/m space group. The structure is three-dimensional. there are two inequivalent U sites. In the first U site, U is bonded in a 2-coordinate geometry to four Fe and six Ge atoms. There are a spread of U–Fe bond distances ranging from 2.14–3.09 Å. There are a spread of U–Ge bond distances ranging from 3.03–3.29 Å. In the second U site, U is bonded in a 10-coordinate geometry to four Fe and six Ge atoms. There are a spread of U–Fe bond distances ranging from 2.97–3.18 Å. There are a spread of U–Ge bond distances ranging from 2.97–3.06 Å. There are two inequivalent Fe sites. In the first Fe site, Fe is bonded in a 1-coordinate geometry to four U and four Ge atoms. There are a spread of Fe–Ge bond distances ranging from 2.52–3.28 Å. In the second Fe site, Fe is bonded in a 5-coordinate geometry to four U and four Ge atoms. There are a spread of Fe–Ge bond distances ranging from 2.44–2.61 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 10-coordinate geometry to six U and four Fe atoms. In the second Ge site, Ge is bonded in a 10-coordinate geometry to six U and four Fe atoms.

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:
1277583
Report Number(s):
mp-607816
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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