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Title: Materials Data on KAc3 by Materials Project

Abstract

KAc3 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 Ac atoms. There are eight shorter (3.98 Å) and six longer (4.59 Å) K–Ac bond lengths. There are two inequivalent Ac sites. In the first Ac site, Ac is bonded in a distorted body-centered cubic geometry to four equivalent K and four equivalent Ac atoms. All Ac–Ac bond lengths are 3.98 Å. In the second Ac site, Ac is bonded in a 8-coordinate geometry to six equivalent K and eight equivalent Ac atoms.

Publication Date:
Other Number(s):
mp-1185033
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; KAc3; Ac-K
OSTI Identifier:
1759671
DOI:
https://doi.org/10.17188/1759671

Citation Formats

The Materials Project. Materials Data on KAc3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1759671.
The Materials Project. Materials Data on KAc3 by Materials Project. United States. doi:https://doi.org/10.17188/1759671
The Materials Project. 2020. "Materials Data on KAc3 by Materials Project". United States. doi:https://doi.org/10.17188/1759671. https://www.osti.gov/servlets/purl/1759671. Pub date:Thu Sep 03 00:00:00 EDT 2020
@article{osti_1759671,
title = {Materials Data on KAc3 by Materials Project},
author = {The Materials Project},
abstractNote = {KAc3 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 Ac atoms. There are eight shorter (3.98 Å) and six longer (4.59 Å) K–Ac bond lengths. There are two inequivalent Ac sites. In the first Ac site, Ac is bonded in a distorted body-centered cubic geometry to four equivalent K and four equivalent Ac atoms. All Ac–Ac bond lengths are 3.98 Å. In the second Ac site, Ac is bonded in a 8-coordinate geometry to six equivalent K and eight equivalent Ac atoms.},
doi = {10.17188/1759671},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {9}
}