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Title: Materials Data on SrLaMnSbO6 by Materials Project

Abstract

SrLaMnSbO6 is Orthorhombic Perovskite-derived structured and crystallizes in the monoclinic Pc space group. The structure is three-dimensional. Sr2+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Sr–O bond distances ranging from 2.51–2.89 Å. La3+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of La–O bond distances ranging from 2.42–2.94 Å. Mn2+ is bonded to six O2- atoms to form MnO6 octahedra that share corners with six equivalent SbO6 octahedra. The corner-sharing octahedra tilt angles range from 24–32°. There are a spread of Mn–O bond distances ranging from 2.18–2.22 Å. Sb5+ is bonded to six O2- atoms to form SbO6 octahedra that share corners with six equivalent MnO6 octahedra. The corner-sharing octahedra tilt angles range from 24–32°. There are a spread of Sb–O bond distances ranging from 2.01–2.03 Å. There are six inequivalent O2- sites. In the first O2- site, O2- is bonded to one Sr2+, one La3+, one Mn2+, and one Sb5+ atom to form distorted corner-sharing OSrLaMnSb tetrahedra. In the second O2- site, O2- is bonded in a 5-coordinate geometry to one Sr2+, two equivalent La3+, one Mn2+, and one Sb5+ atom. In the third O2-more » site, O2- is bonded in a 5-coordinate geometry to one Sr2+, two equivalent La3+, one Mn2+, and one Sb5+ atom. In the fourth O2- site, O2- is bonded in a 5-coordinate geometry to two equivalent Sr2+, one La3+, one Mn2+, and one Sb5+ atom. In the fifth O2- site, O2- is bonded in a 5-coordinate geometry to two equivalent Sr2+, one La3+, one Mn2+, and one Sb5+ atom. In the sixth O2- site, O2- is bonded to one Sr2+, one La3+, one Mn2+, and one Sb5+ atom to form distorted corner-sharing OSrLaMnSb tetrahedra.« less

Authors:
Publication Date:
Other Number(s):
mp-743873
DOE Contract Number:  
AC02-05CH11231; EDCBEE
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)
Collaborations:
MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; SrLaMnSbO6; La-Mn-O-Sb-Sr
OSTI Identifier:
1288116
DOI:
https://doi.org/10.17188/1288116

Citation Formats

The Materials Project. Materials Data on SrLaMnSbO6 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1288116.
The Materials Project. Materials Data on SrLaMnSbO6 by Materials Project. United States. doi:https://doi.org/10.17188/1288116
The Materials Project. 2020. "Materials Data on SrLaMnSbO6 by Materials Project". United States. doi:https://doi.org/10.17188/1288116. https://www.osti.gov/servlets/purl/1288116. Pub date:Mon Aug 03 00:00:00 EDT 2020
@article{osti_1288116,
title = {Materials Data on SrLaMnSbO6 by Materials Project},
author = {The Materials Project},
abstractNote = {SrLaMnSbO6 is Orthorhombic Perovskite-derived structured and crystallizes in the monoclinic Pc space group. The structure is three-dimensional. Sr2+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Sr–O bond distances ranging from 2.51–2.89 Å. La3+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of La–O bond distances ranging from 2.42–2.94 Å. Mn2+ is bonded to six O2- atoms to form MnO6 octahedra that share corners with six equivalent SbO6 octahedra. The corner-sharing octahedra tilt angles range from 24–32°. There are a spread of Mn–O bond distances ranging from 2.18–2.22 Å. Sb5+ is bonded to six O2- atoms to form SbO6 octahedra that share corners with six equivalent MnO6 octahedra. The corner-sharing octahedra tilt angles range from 24–32°. There are a spread of Sb–O bond distances ranging from 2.01–2.03 Å. There are six inequivalent O2- sites. In the first O2- site, O2- is bonded to one Sr2+, one La3+, one Mn2+, and one Sb5+ atom to form distorted corner-sharing OSrLaMnSb tetrahedra. In the second O2- site, O2- is bonded in a 5-coordinate geometry to one Sr2+, two equivalent La3+, one Mn2+, and one Sb5+ atom. In the third O2- site, O2- is bonded in a 5-coordinate geometry to one Sr2+, two equivalent La3+, one Mn2+, and one Sb5+ atom. In the fourth O2- site, O2- is bonded in a 5-coordinate geometry to two equivalent Sr2+, one La3+, one Mn2+, and one Sb5+ atom. In the fifth O2- site, O2- is bonded in a 5-coordinate geometry to two equivalent Sr2+, one La3+, one Mn2+, and one Sb5+ atom. In the sixth O2- site, O2- is bonded to one Sr2+, one La3+, one Mn2+, and one Sb5+ atom to form distorted corner-sharing OSrLaMnSb tetrahedra.},
doi = {10.17188/1288116},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {8}
}