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Title: Materials Data on Mn3SbO8 by Materials Project

Abstract

Mn3SbO8 is trigonal omega-derived structured and crystallizes in the tetragonal P4_32_12 space group. The structure is three-dimensional. 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 equivalent MnO6 octahedra. There are a spread of Mn–O bond distances ranging from 1.97–2.23 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 MnO6 octahedra. There are a spread of Mn–O bond distances ranging from 1.93–2.00 Å. Sb5+ is bonded to six O2- atoms to form SbO6 octahedra that share edges with six MnO6 octahedra. There are a spread of Sb–O bond distances ranging from 1.99–2.06 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a 3-coordinate geometry to two Mn+3.67+ and one Sb5+ atom. In the second O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to two Mn+3.67+ and one Sb5+ atom. In the third O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to threemore » Mn+3.67+ atoms. In the fourth 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-774390
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:
1302551
DOI:
10.17188/1302551

Citation Formats

The Materials Project. Materials Data on Mn3SbO8 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1302551.
The Materials Project. Materials Data on Mn3SbO8 by Materials Project. United States. doi:10.17188/1302551.
The Materials Project. 2020. "Materials Data on Mn3SbO8 by Materials Project". United States. doi:10.17188/1302551. https://www.osti.gov/servlets/purl/1302551. Pub date:Tue Jul 14 00:00:00 EDT 2020
@article{osti_1302551,
title = {Materials Data on Mn3SbO8 by Materials Project},
author = {The Materials Project},
abstractNote = {Mn3SbO8 is trigonal omega-derived structured and crystallizes in the tetragonal P4_32_12 space group. The structure is three-dimensional. 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 equivalent MnO6 octahedra. There are a spread of Mn–O bond distances ranging from 1.97–2.23 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 MnO6 octahedra. There are a spread of Mn–O bond distances ranging from 1.93–2.00 Å. Sb5+ is bonded to six O2- atoms to form SbO6 octahedra that share edges with six MnO6 octahedra. There are a spread of Sb–O bond distances ranging from 1.99–2.06 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a 3-coordinate geometry to two Mn+3.67+ and one Sb5+ atom. In the second O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to two Mn+3.67+ and one Sb5+ atom. In the third O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to three Mn+3.67+ atoms. In the fourth O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Mn+3.67+ and one Sb5+ atom.},
doi = {10.17188/1302551},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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