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Title: Materials Data on KMg3 by Materials Project

Abstract

KMg3 is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. K is bonded in a distorted body-centered cubic geometry to fourteen Mg atoms. There are eight shorter (3.38 Å) and six longer (3.91 Å) K–Mg bond lengths. There are two inequivalent Mg sites. In the first Mg site, Mg is bonded in a distorted body-centered cubic geometry to four equivalent K and four equivalent Mg atoms. All Mg–Mg bond lengths are 3.38 Å. In the second Mg site, Mg is bonded in a 8-coordinate geometry to six equivalent K and eight equivalent Mg atoms.

Authors:
Publication Date:
Other Number(s):
mp-1184990
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; KMg3; K-Mg
OSTI Identifier:
1652924
DOI:
https://doi.org/10.17188/1652924

Citation Formats

The Materials Project. Materials Data on KMg3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1652924.
The Materials Project. Materials Data on KMg3 by Materials Project. United States. doi:https://doi.org/10.17188/1652924
The Materials Project. 2020. "Materials Data on KMg3 by Materials Project". United States. doi:https://doi.org/10.17188/1652924. https://www.osti.gov/servlets/purl/1652924. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1652924,
title = {Materials Data on KMg3 by Materials Project},
author = {The Materials Project},
abstractNote = {KMg3 is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. K is bonded in a distorted body-centered cubic geometry to fourteen Mg atoms. There are eight shorter (3.38 Å) and six longer (3.91 Å) K–Mg bond lengths. There are two inequivalent Mg sites. In the first Mg site, Mg is bonded in a distorted body-centered cubic geometry to four equivalent K and four equivalent Mg atoms. All Mg–Mg bond lengths are 3.38 Å. In the second Mg site, Mg is bonded in a 8-coordinate geometry to six equivalent K and eight equivalent Mg atoms.},
doi = {10.17188/1652924},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}