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Title: Materials Data on U3MnSb5 by Materials Project

Abstract

U3MnSb5 crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. U+4.33+ is bonded in a 9-coordinate geometry to nine Sb3- atoms. There are a spread of U–Sb bond distances ranging from 3.08–3.32 Å. Mn2+ is bonded to six equivalent Sb3- atoms to form face-sharing MnSb6 octahedra. All Mn–Sb bond lengths are 2.69 Å. There are two inequivalent Sb3- sites. In the first Sb3- site, Sb3- is bonded in a 8-coordinate geometry to six equivalent U+4.33+ and two equivalent Sb3- atoms. Both Sb–Sb bond lengths are 3.05 Å. In the second Sb3- site, Sb3- is bonded to five equivalent U+4.33+ and two equivalent Mn2+ atoms to form a mixture of distorted corner, edge, and face-sharing SbU5Mn2 pentagonal bipyramids.

Publication Date:
Other Number(s):
mp-20513
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; U3MnSb5; Mn-Sb-U
OSTI Identifier:
1195645
DOI:
https://doi.org/10.17188/1195645

Citation Formats

The Materials Project. Materials Data on U3MnSb5 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1195645.
The Materials Project. Materials Data on U3MnSb5 by Materials Project. United States. doi:https://doi.org/10.17188/1195645
The Materials Project. 2020. "Materials Data on U3MnSb5 by Materials Project". United States. doi:https://doi.org/10.17188/1195645. https://www.osti.gov/servlets/purl/1195645. Pub date:Fri Jul 17 00:00:00 EDT 2020
@article{osti_1195645,
title = {Materials Data on U3MnSb5 by Materials Project},
author = {The Materials Project},
abstractNote = {U3MnSb5 crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. U+4.33+ is bonded in a 9-coordinate geometry to nine Sb3- atoms. There are a spread of U–Sb bond distances ranging from 3.08–3.32 Å. Mn2+ is bonded to six equivalent Sb3- atoms to form face-sharing MnSb6 octahedra. All Mn–Sb bond lengths are 2.69 Å. There are two inequivalent Sb3- sites. In the first Sb3- site, Sb3- is bonded in a 8-coordinate geometry to six equivalent U+4.33+ and two equivalent Sb3- atoms. Both Sb–Sb bond lengths are 3.05 Å. In the second Sb3- site, Sb3- is bonded to five equivalent U+4.33+ and two equivalent Mn2+ atoms to form a mixture of distorted corner, edge, and face-sharing SbU5Mn2 pentagonal bipyramids.},
doi = {10.17188/1195645},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}