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Title: Materials Data on Mn3SbO8 by Materials Project

Abstract

Mn3SbO8 is trigonal omega-derived structured and crystallizes in the monoclinic C2/m space group. The structure is two-dimensional and consists of one Mn3SbO8 sheet oriented in the (2, 0, -1) direction. there are two inequivalent Mn+3.67+ sites. In the first Mn+3.67+ site, Mn+3.67+ is bonded to six O2- atoms to form MnO6 octahedra that share edges with two equivalent SbO6 octahedra and edges with four MnO6 octahedra. There are a spread of Mn–O bond distances ranging from 1.96–2.02 Å. In the second Mn+3.67+ site, Mn+3.67+ is bonded to six O2- atoms to form MnO6 octahedra that share edges with two equivalent SbO6 octahedra and edges with four equivalent MnO6 octahedra. There is two shorter (1.96 Å) and four longer (2.03 Å) Mn–O bond length. Sb5+ is bonded to six O2- atoms to form SbO6 octahedra that share edges with six MnO6 octahedra. There are four shorter (2.01 Å) and two longer (2.02 Å) Sb–O bond lengths. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a trigonal non-coplanar geometry to three Mn+3.67+ atoms. In the second O2- site, O2- is bonded in a 3-coordinate geometry to two Mn+3.67+ and one Sb5+ atom. In the thirdmore » O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Mn+3.67+ and one Sb5+ atom.« less

Publication Date:
Other Number(s):
mp-776354
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; Mn3SbO8; Mn-O-Sb
OSTI Identifier:
1304240
DOI:
10.17188/1304240

Citation Formats

The Materials Project. Materials Data on Mn3SbO8 by Materials Project. United States: N. p., 2017. Web. doi:10.17188/1304240.
The Materials Project. Materials Data on Mn3SbO8 by Materials Project. United States. doi:10.17188/1304240.
The Materials Project. 2017. "Materials Data on Mn3SbO8 by Materials Project". United States. doi:10.17188/1304240. https://www.osti.gov/servlets/purl/1304240. Pub date:Tue Jul 18 00:00:00 EDT 2017
@article{osti_1304240,
title = {Materials Data on Mn3SbO8 by Materials Project},
author = {The Materials Project},
abstractNote = {Mn3SbO8 is trigonal omega-derived structured and crystallizes in the monoclinic C2/m space group. The structure is two-dimensional and consists of one Mn3SbO8 sheet oriented in the (2, 0, -1) direction. there are two inequivalent Mn+3.67+ sites. In the first Mn+3.67+ site, Mn+3.67+ is bonded to six O2- atoms to form MnO6 octahedra that share edges with two equivalent SbO6 octahedra and edges with four MnO6 octahedra. There are a spread of Mn–O bond distances ranging from 1.96–2.02 Å. In the second Mn+3.67+ site, Mn+3.67+ is bonded to six O2- atoms to form MnO6 octahedra that share edges with two equivalent SbO6 octahedra and edges with four equivalent MnO6 octahedra. There is two shorter (1.96 Å) and four longer (2.03 Å) Mn–O bond length. Sb5+ is bonded to six O2- atoms to form SbO6 octahedra that share edges with six MnO6 octahedra. There are four shorter (2.01 Å) and two longer (2.02 Å) Sb–O bond lengths. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a trigonal non-coplanar geometry to three Mn+3.67+ atoms. In the second O2- site, O2- is bonded in a 3-coordinate geometry to two Mn+3.67+ and one Sb5+ atom. In the third O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Mn+3.67+ and one Sb5+ atom.},
doi = {10.17188/1304240},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2017},
month = {7}
}

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