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Title: Materials Data on Hf10MnSb5 by Materials Project

Abstract

Hf10MnSb5 crystallizes in the tetragonal I422 space group. The structure is three-dimensional. there are two inequivalent Hf sites. In the first Hf site, Hf is bonded in a 6-coordinate geometry to one Mn and five Sb atoms. The Hf–Mn bond length is 2.84 Å. There are a spread of Hf–Sb bond distances ranging from 2.90–3.29 Å. In the second Hf site, Hf is bonded in a 4-coordinate geometry to four equivalent Sb atoms. All Hf–Sb bond lengths are 2.92 Å. Mn is bonded in a distorted q6 geometry to eight equivalent Hf and two equivalent Sb atoms. Both Mn–Sb bond lengths are 2.78 Å. There are two inequivalent Sb sites. In the first Sb site, Sb is bonded in a 10-coordinate geometry to ten Hf atoms. In the second Sb site, Sb is bonded in a distorted q6 geometry to eight equivalent Hf and two equivalent Mn atoms.

Authors:
Publication Date:
Other Number(s):
mp-1224484
DOE Contract Number:  
AC02-05CH11231; EDCBEE
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)
Collaborations:
MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; Hf10MnSb5; Hf-Mn-Sb
OSTI Identifier:
1731344
DOI:
https://doi.org/10.17188/1731344

Citation Formats

The Materials Project. Materials Data on Hf10MnSb5 by Materials Project. United States: N. p., 2019. Web. doi:10.17188/1731344.
The Materials Project. Materials Data on Hf10MnSb5 by Materials Project. United States. doi:https://doi.org/10.17188/1731344
The Materials Project. 2019. "Materials Data on Hf10MnSb5 by Materials Project". United States. doi:https://doi.org/10.17188/1731344. https://www.osti.gov/servlets/purl/1731344. Pub date:Sun Jan 13 00:00:00 EST 2019
@article{osti_1731344,
title = {Materials Data on Hf10MnSb5 by Materials Project},
author = {The Materials Project},
abstractNote = {Hf10MnSb5 crystallizes in the tetragonal I422 space group. The structure is three-dimensional. there are two inequivalent Hf sites. In the first Hf site, Hf is bonded in a 6-coordinate geometry to one Mn and five Sb atoms. The Hf–Mn bond length is 2.84 Å. There are a spread of Hf–Sb bond distances ranging from 2.90–3.29 Å. In the second Hf site, Hf is bonded in a 4-coordinate geometry to four equivalent Sb atoms. All Hf–Sb bond lengths are 2.92 Å. Mn is bonded in a distorted q6 geometry to eight equivalent Hf and two equivalent Sb atoms. Both Mn–Sb bond lengths are 2.78 Å. There are two inequivalent Sb sites. In the first Sb site, Sb is bonded in a 10-coordinate geometry to ten Hf atoms. In the second Sb site, Sb is bonded in a distorted q6 geometry to eight equivalent Hf and two equivalent Mn atoms.},
doi = {10.17188/1731344},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}