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Title: Materials Data on UMn2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1273995· OSTI ID:1273995

UMn2 is Cubic Laves structured and crystallizes in the orthorhombic Imma space group. The structure is three-dimensional. U is bonded in a 4-coordinate geometry to two equivalent U and twelve Mn atoms. Both U–U bond lengths are 2.79 Å. There are a spread of U–Mn bond distances ranging from 2.75–3.06 Å. There are two inequivalent Mn sites. In the first Mn site, Mn is bonded to six equivalent U and six Mn atoms to form a mixture of face, edge, and corner-sharing MnU6Mn6 cuboctahedra. There are four shorter (2.52 Å) and two longer (2.62 Å) Mn–Mn bond lengths. In the second Mn site, Mn is bonded to six equivalent U and six Mn atoms to form a mixture of distorted face, edge, and corner-sharing MnU6Mn6 cuboctahedra. Both Mn–Mn bond lengths are 2.20 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:
1273995
Report Number(s):
mp-567695
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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