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Title: Materials Data on MnSb2F12 by Materials Project

Abstract

MnSb2F12 crystallizes in the triclinic P-1 space group. The structure is two-dimensional and consists of one MnSb2F12 sheet oriented in the (0, 0, 1) direction. Mn2+ is bonded in a 4-coordinate geometry to six F1- atoms. There are a spread of Mn–F bond distances ranging from 1.76–2.79 Å. Sb5+ is bonded in a 6-coordinate geometry to six F1- atoms. There are a spread of Sb–F bond distances ranging from 1.64–2.43 Å. There are six inequivalent F1- sites. In the first F1- site, F1- is bonded in a single-bond geometry to one Sb5+ atom. In the second F1- site, F1- is bonded in a single-bond geometry to one Sb5+ atom. In the third F1- site, F1- is bonded in a 2-coordinate geometry to one Mn2+ and one Sb5+ atom. In the fourth F1- site, F1- is bonded in a distorted bent 150 degrees geometry to one Mn2+ and one Sb5+ atom. In the fifth F1- site, F1- is bonded in a distorted bent 120 degrees geometry to one Mn2+ and one Sb5+ atom. In the sixth F1- site, F1- is bonded in a single-bond geometry to one Sb5+ atom.

Publication Date:
Other Number(s):
mp-555052
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; MnSb2F12; F-Mn-Sb
OSTI Identifier:
1268598
DOI:
10.17188/1268598

Citation Formats

The Materials Project. Materials Data on MnSb2F12 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1268598.
The Materials Project. Materials Data on MnSb2F12 by Materials Project. United States. doi:10.17188/1268598.
The Materials Project. 2020. "Materials Data on MnSb2F12 by Materials Project". United States. doi:10.17188/1268598. https://www.osti.gov/servlets/purl/1268598. Pub date:Sat May 09 00:00:00 EDT 2020
@article{osti_1268598,
title = {Materials Data on MnSb2F12 by Materials Project},
author = {The Materials Project},
abstractNote = {MnSb2F12 crystallizes in the triclinic P-1 space group. The structure is two-dimensional and consists of one MnSb2F12 sheet oriented in the (0, 0, 1) direction. Mn2+ is bonded in a 4-coordinate geometry to six F1- atoms. There are a spread of Mn–F bond distances ranging from 1.76–2.79 Å. Sb5+ is bonded in a 6-coordinate geometry to six F1- atoms. There are a spread of Sb–F bond distances ranging from 1.64–2.43 Å. There are six inequivalent F1- sites. In the first F1- site, F1- is bonded in a single-bond geometry to one Sb5+ atom. In the second F1- site, F1- is bonded in a single-bond geometry to one Sb5+ atom. In the third F1- site, F1- is bonded in a 2-coordinate geometry to one Mn2+ and one Sb5+ atom. In the fourth F1- site, F1- is bonded in a distorted bent 150 degrees geometry to one Mn2+ and one Sb5+ atom. In the fifth F1- site, F1- is bonded in a distorted bent 120 degrees geometry to one Mn2+ and one Sb5+ atom. In the sixth F1- site, F1- is bonded in a single-bond geometry to one Sb5+ atom.},
doi = {10.17188/1268598},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}

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