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Title: Materials Data on K2MnCl6 by Materials Project

Abstract

K2MnCl6 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. K1+ is bonded to twelve equivalent Cl1- atoms to form KCl12 cuboctahedra that share corners with twelve equivalent KCl12 cuboctahedra, faces with six equivalent KCl12 cuboctahedra, and faces with four equivalent MnCl6 octahedra. All K–Cl bond lengths are 3.51 Å. Mn4+ is bonded to six equivalent Cl1- atoms to form MnCl6 octahedra that share faces with eight equivalent KCl12 cuboctahedra. All Mn–Cl bond lengths are 2.29 Å. Cl1- is bonded in a distorted single-bond geometry to four equivalent K1+ and one Mn4+ atom.

Publication Date:
Other Number(s):
mp-27304
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; K2MnCl6; Cl-K-Mn
OSTI Identifier:
1201515
DOI:
https://doi.org/10.17188/1201515

Citation Formats

The Materials Project. Materials Data on K2MnCl6 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1201515.
The Materials Project. Materials Data on K2MnCl6 by Materials Project. United States. doi:https://doi.org/10.17188/1201515
The Materials Project. 2020. "Materials Data on K2MnCl6 by Materials Project". United States. doi:https://doi.org/10.17188/1201515. https://www.osti.gov/servlets/purl/1201515. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1201515,
title = {Materials Data on K2MnCl6 by Materials Project},
author = {The Materials Project},
abstractNote = {K2MnCl6 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. K1+ is bonded to twelve equivalent Cl1- atoms to form KCl12 cuboctahedra that share corners with twelve equivalent KCl12 cuboctahedra, faces with six equivalent KCl12 cuboctahedra, and faces with four equivalent MnCl6 octahedra. All K–Cl bond lengths are 3.51 Å. Mn4+ is bonded to six equivalent Cl1- atoms to form MnCl6 octahedra that share faces with eight equivalent KCl12 cuboctahedra. All Mn–Cl bond lengths are 2.29 Å. Cl1- is bonded in a distorted single-bond geometry to four equivalent K1+ and one Mn4+ atom.},
doi = {10.17188/1201515},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}