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Title: Materials Data on MnAlO3 by Materials Project

Abstract

MnAlO3 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. Mn3+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Mn–O bond distances ranging from 1.78–2.55 Å. Al3+ is bonded in a distorted bent 150 degrees geometry to three O2- atoms. There are a spread of Al–O bond distances ranging from 1.14–2.49 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted bent 120 degrees geometry to two equivalent Mn3+ and one Al3+ atom. In the second O2- site, O2- is bonded in a 1-coordinate geometry to two equivalent Mn3+ and one Al3+ atom. In the third O2- site, O2- is bonded in a 1-coordinate geometry to two equivalent Mn3+ and one Al3+ atom.

Publication Date:
Other Number(s):
mp-774250
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; MnAlO3; Al-Mn-O
OSTI Identifier:
1302440
DOI:
10.17188/1302440

Citation Formats

The Materials Project. Materials Data on MnAlO3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1302440.
The Materials Project. Materials Data on MnAlO3 by Materials Project. United States. doi:10.17188/1302440.
The Materials Project. 2020. "Materials Data on MnAlO3 by Materials Project". United States. doi:10.17188/1302440. https://www.osti.gov/servlets/purl/1302440. Pub date:Sat Apr 25 00:00:00 EDT 2020
@article{osti_1302440,
title = {Materials Data on MnAlO3 by Materials Project},
author = {The Materials Project},
abstractNote = {MnAlO3 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. Mn3+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Mn–O bond distances ranging from 1.78–2.55 Å. Al3+ is bonded in a distorted bent 150 degrees geometry to three O2- atoms. There are a spread of Al–O bond distances ranging from 1.14–2.49 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted bent 120 degrees geometry to two equivalent Mn3+ and one Al3+ atom. In the second O2- site, O2- is bonded in a 1-coordinate geometry to two equivalent Mn3+ and one Al3+ atom. In the third O2- site, O2- is bonded in a 1-coordinate geometry to two equivalent Mn3+ and one Al3+ atom.},
doi = {10.17188/1302440},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}

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