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Title: Materials Data on ErGaO3 by Materials Project

Abstract

ErGaO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Er3+ is bonded to twelve equivalent O2- atoms to form ErO12 cuboctahedra that share corners with twelve equivalent ErO12 cuboctahedra, faces with six equivalent ErO12 cuboctahedra, and faces with eight equivalent GaO6 octahedra. All Er–O bond lengths are 2.70 Å. Ga3+ is bonded to six equivalent O2- atoms to form GaO6 octahedra that share corners with six equivalent GaO6 octahedra and faces with eight equivalent ErO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Ga–O bond lengths are 1.91 Å. O2- is bonded in a distorted linear geometry to four equivalent Er3+ and two equivalent Ga3+ atoms.

Authors:
Publication Date:
Other Number(s):
mp-1184164
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; ErGaO3; Er-Ga-O
OSTI Identifier:
1747927
DOI:
https://doi.org/10.17188/1747927

Citation Formats

The Materials Project. Materials Data on ErGaO3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1747927.
The Materials Project. Materials Data on ErGaO3 by Materials Project. United States. doi:https://doi.org/10.17188/1747927
The Materials Project. 2020. "Materials Data on ErGaO3 by Materials Project". United States. doi:https://doi.org/10.17188/1747927. https://www.osti.gov/servlets/purl/1747927. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1747927,
title = {Materials Data on ErGaO3 by Materials Project},
author = {The Materials Project},
abstractNote = {ErGaO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Er3+ is bonded to twelve equivalent O2- atoms to form ErO12 cuboctahedra that share corners with twelve equivalent ErO12 cuboctahedra, faces with six equivalent ErO12 cuboctahedra, and faces with eight equivalent GaO6 octahedra. All Er–O bond lengths are 2.70 Å. Ga3+ is bonded to six equivalent O2- atoms to form GaO6 octahedra that share corners with six equivalent GaO6 octahedra and faces with eight equivalent ErO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Ga–O bond lengths are 1.91 Å. O2- is bonded in a distorted linear geometry to four equivalent Er3+ and two equivalent Ga3+ atoms.},
doi = {10.17188/1747927},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}