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Title: Materials Data on Cs2MnF5 by Materials Project

Abstract

Cs2MnF5 crystallizes in the tetragonal P4/mmm space group. The structure is three-dimensional. Cs1+ is bonded in a distorted q6 geometry to ten F1- atoms. There are eight shorter (3.18 Å) and two longer (3.26 Å) Cs–F bond lengths. Mn3+ is bonded to six F1- atoms to form corner-sharing MnF6 octahedra. The corner-sharing octahedral tilt angles are 0°. There are four shorter (1.90 Å) and two longer (2.15 Å) Mn–F bond lengths. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a single-bond geometry to four equivalent Cs1+ and one Mn3+ atom. In the second F1- site, F1- is bonded in a linear geometry to four equivalent Cs1+ and two equivalent Mn3+ atoms.

Publication Date:
Other Number(s):
mp-555223
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; Cs2MnF5; Cs-F-Mn
OSTI Identifier:
1268693
DOI:
10.17188/1268693

Citation Formats

The Materials Project. Materials Data on Cs2MnF5 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1268693.
The Materials Project. Materials Data on Cs2MnF5 by Materials Project. United States. doi:10.17188/1268693.
The Materials Project. 2020. "Materials Data on Cs2MnF5 by Materials Project". United States. doi:10.17188/1268693. https://www.osti.gov/servlets/purl/1268693. Pub date:Mon Aug 03 00:00:00 EDT 2020
@article{osti_1268693,
title = {Materials Data on Cs2MnF5 by Materials Project},
author = {The Materials Project},
abstractNote = {Cs2MnF5 crystallizes in the tetragonal P4/mmm space group. The structure is three-dimensional. Cs1+ is bonded in a distorted q6 geometry to ten F1- atoms. There are eight shorter (3.18 Å) and two longer (3.26 Å) Cs–F bond lengths. Mn3+ is bonded to six F1- atoms to form corner-sharing MnF6 octahedra. The corner-sharing octahedral tilt angles are 0°. There are four shorter (1.90 Å) and two longer (2.15 Å) Mn–F bond lengths. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a single-bond geometry to four equivalent Cs1+ and one Mn3+ atom. In the second F1- site, F1- is bonded in a linear geometry to four equivalent Cs1+ and two equivalent Mn3+ atoms.},
doi = {10.17188/1268693},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {8}
}

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