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Title: Materials Data on LuMn5 by Materials Project

Abstract

LuMn5 crystallizes in the hexagonal P6_3mc space group. The structure is three-dimensional. Lu is bonded in a 12-coordinate geometry to sixteen Mn atoms. There are a spread of Lu–Mn bond distances ranging from 2.81–2.98 Å. There are three inequivalent Mn sites. In the first Mn site, Mn is bonded to three equivalent Lu and nine Mn atoms to form a mixture of distorted corner, edge, and face-sharing MnLu3Mn9 cuboctahedra. There are a spread of Mn–Mn bond distances ranging from 2.36–2.89 Å. In the second Mn site, Mn is bonded to three equivalent Lu and nine Mn atoms to form a mixture of corner, edge, and face-sharing MnLu3Mn9 cuboctahedra. All Mn–Mn bond lengths are 2.86 Å. In the third Mn site, Mn is bonded in a 4-coordinate geometry to four equivalent Lu and twelve Mn atoms.

Publication Date:
Other Number(s):
mp-30770
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
Research Org.:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; LuMn5; Lu-Mn
OSTI Identifier:
1205131
DOI:
https://doi.org/10.17188/1205131

Citation Formats

The Materials Project. Materials Data on LuMn5 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1205131.
The Materials Project. Materials Data on LuMn5 by Materials Project. United States. doi:https://doi.org/10.17188/1205131
The Materials Project. 2020. "Materials Data on LuMn5 by Materials Project". United States. doi:https://doi.org/10.17188/1205131. https://www.osti.gov/servlets/purl/1205131. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1205131,
title = {Materials Data on LuMn5 by Materials Project},
author = {The Materials Project},
abstractNote = {LuMn5 crystallizes in the hexagonal P6_3mc space group. The structure is three-dimensional. Lu is bonded in a 12-coordinate geometry to sixteen Mn atoms. There are a spread of Lu–Mn bond distances ranging from 2.81–2.98 Å. There are three inequivalent Mn sites. In the first Mn site, Mn is bonded to three equivalent Lu and nine Mn atoms to form a mixture of distorted corner, edge, and face-sharing MnLu3Mn9 cuboctahedra. There are a spread of Mn–Mn bond distances ranging from 2.36–2.89 Å. In the second Mn site, Mn is bonded to three equivalent Lu and nine Mn atoms to form a mixture of corner, edge, and face-sharing MnLu3Mn9 cuboctahedra. All Mn–Mn bond lengths are 2.86 Å. In the third Mn site, Mn is bonded in a 4-coordinate geometry to four equivalent Lu and twelve Mn atoms.},
doi = {10.17188/1205131},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}